In [4]:
from xmlrpclib import ServerProxy
from IPython.display import Image
import os, sys
In [5]:
from IPython.display import Image
In [9]:
%%bash
export PATH=${PATH}:/home/preps/golovin/progs/bin
export MOPAC_LICENSE=/home/preps/golovin/progs/bin
export LD_LIBRARY_PATH=${LD_LIBRARY_PATH}:/home/preps/golovin/progs/lib
cd
cd Term6/Practice4
1. Создадим оптимизированную структуру этана в виде Z-матрицы.¶
In [15]:
f = open('/home/students/y12/iltarn/Term6/Practice4/et.inp', 'w')
f.write(""" $CONTRL COORD=ZMT UNITS=ANGS dfttyp=b3lyp RUNTYP=ENERGY $END
$BASIS GBASIS=N31 NGAUSS=6
POLAR=POPN31 NDFUNC=1 $END
$GUESS GUESS=HUCKEL $END
$system mwords=2 $end
$DATA
eth
C1
C
C 1 cc
H 2 ch 1 cchv
H 2 ch 1 cch 3 d1 0
H 2 ch 1 cch 3 d2 0
H 1 ch 2 cch 3 d3 0
H 1 ch 2 cch 5 d3 0
H 1 chv 2 cch 4 d3 0
cc=1.52986
ch=1.08439
chv=1.08439
cch=111.200
cchv=111.200
d1=120
d2=-120
d3=180
$END""")
f.close()
2-3. Размножение...¶
In [18]:
%%bash
### делаем цикл от -10 до 10 #####
cd
cd Term6
cd Practice4
for i in {-10..10}; do
#### нам надо рассчитать новую длину связи #####
#### с шагом 0.02 ангстрема, #####
#### воспользуемся калькулятором bc #####
#### и результат поместим в переменную nb #####
nb=$(echo "scale=5; 1.52986 + $i/50" | bc -l)
#### пролистаем файл et.inp и заменим указание переменной ###
#### на новое значение и пере направим результат в файл ###
sed "s/cc=1.52986/cc=$nb/" et.inp > b_${i}.inp
done
Итого: 21 разных .inp файлов с разными значениями cc.
4. Рассчет¶
In [19]:
%%bash
### делаем цикл от -10 до 10 #####
cd
cd Term6
cd Practice4
for i in {-10..10}; do
#### нам надо рассчитать новую длину связи #####
#### с шагом 0.02 ангстрема, #####
#### воспользуемся калькулятором bc #####
#### и результат поместим в переменную nb #####
nb=$(echo "scale=5; 1.52986 + $i/50" | bc -l)
#### пролистаем файл et.inp и заменим указание переменной ###
#### на новое значение и пере направим результат в файл ###
sed "s/cc=1.52986/cc=$nb/" et.inp > b_${i}.inp
gms b_${i}.inp 1 > b_${i}.log
done
# output скрыт, т.к. занимает очень много места.
mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp b_-10.inp /home/students/y12/iltarn/gamess-scratch/b_-10.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/b_-10.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/b_-10.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/b_-10.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/b_-10.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/b_-10.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/b_-10.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/b_-10.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/b_-10.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/b_-10.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/b_-10.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/b_-10.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/b_-10.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/b_-10.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/b_-10.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/b_-10.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/b_-10.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/b_-10.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/b_-10.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/b_-10.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/b_-10.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/b_-10.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/b_-10.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/b_-10.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/b_-10.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/b_-10.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/b_-10.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/b_-10.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/b_-10.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/b_-10.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/b_-10.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/b_-10.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/b_-10.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/b_-10.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/b_-10.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/b_-10.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/b_-10.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/b_-10.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/b_-10.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/b_-10.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/b_-10.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/b_-10.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/b_-10.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/b_-10.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/b_-10.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/b_-10.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/b_-10.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/b_-10.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/b_-10.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/b_-10.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/b_-10.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/b_-10.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/b_-10.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/b_-10.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/b_-10.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/b_-10.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/b_-10.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/b_-10.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/b_-10.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/b_-10.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/b_-10.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/b_-10.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/b_-10.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/b_-10.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/b_-10.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/b_-10.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/b_-10.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/b_-10.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/b_-10.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/b_-10.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/b_-10.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/b_-10.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/b_-10.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/b_-10.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/b_-10.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/b_-10.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/b_-10.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/b_-10.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/b_-10.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/b_-10.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/b_-10.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/b_-10.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/b_-10.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/b_-10.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/b_-10.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/b_-10.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/b_-10.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/b_-10.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/b_-10.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/b_-10.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/b_-10.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/b_-10.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/b_-10.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/b_-10.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/b_-10.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/b_-10.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/b_-10.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/b_-10.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/b_-10.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/b_-10.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/b_-10.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/b_-10.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/b_-10.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/b_-10.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/b_-10.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/b_-10.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/b_-10.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/b_-10.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/b_-10.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/b_-10.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/b_-10.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x b_-10 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp b_-9.inp /home/students/y12/iltarn/gamess-scratch/b_-9.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/b_-9.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/b_-9.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/b_-9.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/b_-9.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/b_-9.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/b_-9.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/b_-9.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/b_-9.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/b_-9.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/b_-9.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/b_-9.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/b_-9.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/b_-9.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/b_-9.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/b_-9.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/b_-9.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/b_-9.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/b_-9.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/b_-9.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/b_-9.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/b_-9.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/b_-9.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/b_-9.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/b_-9.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/b_-9.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/b_-9.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/b_-9.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/b_-9.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/b_-9.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/b_-9.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/b_-9.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/b_-9.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/b_-9.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/b_-9.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/b_-9.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/b_-9.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/b_-9.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/b_-9.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/b_-9.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/b_-9.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/b_-9.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/b_-9.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/b_-9.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/b_-9.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/b_-9.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/b_-9.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/b_-9.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/b_-9.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/b_-9.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/b_-9.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/b_-9.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/b_-9.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/b_-9.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/b_-9.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/b_-9.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/b_-9.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/b_-9.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/b_-9.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/b_-9.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/b_-9.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/b_-9.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/b_-9.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/b_-9.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/b_-9.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/b_-9.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/b_-9.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/b_-9.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/b_-9.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/b_-9.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/b_-9.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/b_-9.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/b_-9.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/b_-9.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/b_-9.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/b_-9.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/b_-9.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/b_-9.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/b_-9.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/b_-9.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/b_-9.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/b_-9.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/b_-9.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/b_-9.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/b_-9.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/b_-9.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/b_-9.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/b_-9.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/b_-9.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/b_-9.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/b_-9.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/b_-9.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/b_-9.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/b_-9.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/b_-9.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/b_-9.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/b_-9.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/b_-9.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/b_-9.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/b_-9.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/b_-9.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/b_-9.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/b_-9.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/b_-9.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/b_-9.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/b_-9.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/b_-9.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/b_-9.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/b_-9.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/b_-9.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/b_-9.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x b_-9 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp b_-8.inp /home/students/y12/iltarn/gamess-scratch/b_-8.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/b_-8.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/b_-8.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/b_-8.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/b_-8.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/b_-8.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/b_-8.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/b_-8.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/b_-8.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/b_-8.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/b_-8.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/b_-8.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/b_-8.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/b_-8.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/b_-8.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/b_-8.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/b_-8.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/b_-8.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/b_-8.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/b_-8.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/b_-8.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/b_-8.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/b_-8.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/b_-8.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/b_-8.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/b_-8.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/b_-8.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/b_-8.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/b_-8.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/b_-8.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/b_-8.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/b_-8.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/b_-8.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/b_-8.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/b_-8.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/b_-8.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/b_-8.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/b_-8.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/b_-8.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/b_-8.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/b_-8.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/b_-8.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/b_-8.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/b_-8.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/b_-8.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/b_-8.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/b_-8.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/b_-8.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/b_-8.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/b_-8.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/b_-8.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/b_-8.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/b_-8.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/b_-8.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/b_-8.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/b_-8.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/b_-8.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/b_-8.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/b_-8.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/b_-8.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/b_-8.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/b_-8.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/b_-8.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/b_-8.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/b_-8.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/b_-8.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/b_-8.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/b_-8.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/b_-8.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/b_-8.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/b_-8.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/b_-8.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/b_-8.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/b_-8.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/b_-8.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/b_-8.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/b_-8.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/b_-8.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/b_-8.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/b_-8.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/b_-8.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/b_-8.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/b_-8.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/b_-8.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/b_-8.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/b_-8.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/b_-8.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/b_-8.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/b_-8.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/b_-8.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/b_-8.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/b_-8.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/b_-8.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/b_-8.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/b_-8.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/b_-8.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/b_-8.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/b_-8.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/b_-8.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/b_-8.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/b_-8.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/b_-8.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/b_-8.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/b_-8.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/b_-8.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/b_-8.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/b_-8.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/b_-8.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/b_-8.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/b_-8.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/b_-8.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x b_-8 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp b_-7.inp /home/students/y12/iltarn/gamess-scratch/b_-7.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/b_-7.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/b_-7.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/b_-7.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/b_-7.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/b_-7.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/b_-7.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/b_-7.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/b_-7.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/b_-7.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/b_-7.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/b_-7.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/b_-7.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/b_-7.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/b_-7.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/b_-7.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/b_-7.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/b_-7.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/b_-7.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/b_-7.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/b_-7.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/b_-7.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/b_-7.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/b_-7.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/b_-7.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/b_-7.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/b_-7.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/b_-7.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/b_-7.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/b_-7.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/b_-7.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/b_-7.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/b_-7.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/b_-7.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/b_-7.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/b_-7.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/b_-7.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/b_-7.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/b_-7.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/b_-7.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/b_-7.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/b_-7.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/b_-7.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/b_-7.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/b_-7.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/b_-7.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/b_-7.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/b_-7.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/b_-7.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/b_-7.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/b_-7.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/b_-7.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/b_-7.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/b_-7.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/b_-7.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/b_-7.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/b_-7.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/b_-7.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/b_-7.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/b_-7.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/b_-7.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/b_-7.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/b_-7.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/b_-7.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/b_-7.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/b_-7.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/b_-7.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/b_-7.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/b_-7.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/b_-7.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/b_-7.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/b_-7.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/b_-7.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/b_-7.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/b_-7.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/b_-7.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/b_-7.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/b_-7.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/b_-7.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/b_-7.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/b_-7.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/b_-7.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/b_-7.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/b_-7.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/b_-7.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/b_-7.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/b_-7.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/b_-7.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/b_-7.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/b_-7.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/b_-7.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/b_-7.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/b_-7.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/b_-7.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/b_-7.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/b_-7.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/b_-7.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/b_-7.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/b_-7.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/b_-7.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/b_-7.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/b_-7.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/b_-7.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/b_-7.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/b_-7.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/b_-7.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/b_-7.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/b_-7.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/b_-7.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/b_-7.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/b_-7.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x b_-7 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp b_-6.inp /home/students/y12/iltarn/gamess-scratch/b_-6.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/b_-6.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/b_-6.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/b_-6.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/b_-6.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/b_-6.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/b_-6.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/b_-6.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/b_-6.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/b_-6.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/b_-6.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/b_-6.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/b_-6.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/b_-6.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/b_-6.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/b_-6.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/b_-6.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/b_-6.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/b_-6.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/b_-6.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/b_-6.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/b_-6.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/b_-6.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/b_-6.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/b_-6.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/b_-6.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/b_-6.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/b_-6.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/b_-6.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/b_-6.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/b_-6.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/b_-6.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/b_-6.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/b_-6.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/b_-6.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/b_-6.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/b_-6.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/b_-6.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/b_-6.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/b_-6.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/b_-6.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/b_-6.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/b_-6.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/b_-6.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/b_-6.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/b_-6.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/b_-6.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/b_-6.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/b_-6.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/b_-6.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/b_-6.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/b_-6.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/b_-6.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/b_-6.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/b_-6.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/b_-6.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/b_-6.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/b_-6.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/b_-6.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/b_-6.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/b_-6.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/b_-6.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/b_-6.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/b_-6.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/b_-6.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/b_-6.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/b_-6.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/b_-6.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/b_-6.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/b_-6.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/b_-6.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/b_-6.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/b_-6.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/b_-6.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/b_-6.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/b_-6.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/b_-6.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/b_-6.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/b_-6.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/b_-6.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/b_-6.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/b_-6.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/b_-6.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/b_-6.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/b_-6.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/b_-6.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/b_-6.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/b_-6.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/b_-6.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/b_-6.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/b_-6.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/b_-6.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/b_-6.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/b_-6.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/b_-6.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/b_-6.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/b_-6.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/b_-6.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/b_-6.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/b_-6.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/b_-6.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/b_-6.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/b_-6.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/b_-6.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/b_-6.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/b_-6.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/b_-6.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/b_-6.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/b_-6.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/b_-6.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/b_-6.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x b_-6 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp b_-5.inp /home/students/y12/iltarn/gamess-scratch/b_-5.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/b_-5.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/b_-5.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/b_-5.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/b_-5.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/b_-5.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/b_-5.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/b_-5.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/b_-5.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/b_-5.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/b_-5.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/b_-5.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/b_-5.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/b_-5.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/b_-5.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/b_-5.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/b_-5.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/b_-5.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/b_-5.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/b_-5.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/b_-5.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/b_-5.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/b_-5.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/b_-5.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/b_-5.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/b_-5.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/b_-5.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/b_-5.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/b_-5.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/b_-5.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/b_-5.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/b_-5.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/b_-5.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/b_-5.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/b_-5.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/b_-5.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/b_-5.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/b_-5.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/b_-5.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/b_-5.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/b_-5.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/b_-5.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/b_-5.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/b_-5.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/b_-5.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/b_-5.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/b_-5.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/b_-5.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/b_-5.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/b_-5.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/b_-5.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/b_-5.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/b_-5.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/b_-5.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/b_-5.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/b_-5.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/b_-5.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/b_-5.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/b_-5.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/b_-5.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/b_-5.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/b_-5.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/b_-5.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/b_-5.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/b_-5.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/b_-5.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/b_-5.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/b_-5.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/b_-5.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/b_-5.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/b_-5.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/b_-5.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/b_-5.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/b_-5.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/b_-5.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/b_-5.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/b_-5.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/b_-5.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/b_-5.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/b_-5.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/b_-5.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/b_-5.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/b_-5.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/b_-5.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/b_-5.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/b_-5.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/b_-5.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/b_-5.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/b_-5.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/b_-5.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/b_-5.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/b_-5.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/b_-5.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/b_-5.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/b_-5.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/b_-5.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/b_-5.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/b_-5.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/b_-5.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/b_-5.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/b_-5.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/b_-5.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/b_-5.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/b_-5.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/b_-5.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/b_-5.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/b_-5.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/b_-5.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/b_-5.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/b_-5.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/b_-5.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x b_-5 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp b_-4.inp /home/students/y12/iltarn/gamess-scratch/b_-4.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/b_-4.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/b_-4.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/b_-4.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/b_-4.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/b_-4.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/b_-4.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/b_-4.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/b_-4.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/b_-4.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/b_-4.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/b_-4.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/b_-4.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/b_-4.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/b_-4.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/b_-4.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/b_-4.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/b_-4.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/b_-4.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/b_-4.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/b_-4.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/b_-4.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/b_-4.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/b_-4.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/b_-4.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/b_-4.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/b_-4.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/b_-4.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/b_-4.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/b_-4.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/b_-4.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/b_-4.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/b_-4.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/b_-4.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/b_-4.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/b_-4.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/b_-4.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/b_-4.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/b_-4.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/b_-4.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/b_-4.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/b_-4.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/b_-4.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/b_-4.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/b_-4.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/b_-4.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/b_-4.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/b_-4.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/b_-4.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/b_-4.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/b_-4.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/b_-4.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/b_-4.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/b_-4.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/b_-4.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/b_-4.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/b_-4.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/b_-4.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/b_-4.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/b_-4.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/b_-4.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/b_-4.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/b_-4.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/b_-4.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/b_-4.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/b_-4.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/b_-4.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/b_-4.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/b_-4.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/b_-4.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/b_-4.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/b_-4.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/b_-4.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/b_-4.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/b_-4.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/b_-4.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/b_-4.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/b_-4.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/b_-4.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/b_-4.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/b_-4.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/b_-4.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/b_-4.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/b_-4.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/b_-4.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/b_-4.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/b_-4.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/b_-4.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/b_-4.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/b_-4.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/b_-4.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/b_-4.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/b_-4.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/b_-4.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/b_-4.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/b_-4.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/b_-4.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/b_-4.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/b_-4.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/b_-4.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/b_-4.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/b_-4.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/b_-4.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/b_-4.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/b_-4.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/b_-4.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/b_-4.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/b_-4.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/b_-4.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/b_-4.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/b_-4.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x b_-4 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp b_-3.inp /home/students/y12/iltarn/gamess-scratch/b_-3.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/b_-3.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/b_-3.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/b_-3.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/b_-3.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/b_-3.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/b_-3.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/b_-3.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/b_-3.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/b_-3.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/b_-3.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/b_-3.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/b_-3.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/b_-3.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/b_-3.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/b_-3.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/b_-3.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/b_-3.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/b_-3.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/b_-3.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/b_-3.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/b_-3.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/b_-3.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/b_-3.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/b_-3.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/b_-3.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/b_-3.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/b_-3.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/b_-3.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/b_-3.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/b_-3.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/b_-3.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/b_-3.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/b_-3.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/b_-3.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/b_-3.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/b_-3.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/b_-3.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/b_-3.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/b_-3.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/b_-3.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/b_-3.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/b_-3.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/b_-3.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/b_-3.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/b_-3.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/b_-3.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/b_-3.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/b_-3.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/b_-3.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/b_-3.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/b_-3.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/b_-3.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/b_-3.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/b_-3.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/b_-3.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/b_-3.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/b_-3.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/b_-3.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/b_-3.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/b_-3.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/b_-3.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/b_-3.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/b_-3.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/b_-3.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/b_-3.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/b_-3.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/b_-3.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/b_-3.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/b_-3.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/b_-3.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/b_-3.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/b_-3.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/b_-3.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/b_-3.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/b_-3.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/b_-3.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/b_-3.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/b_-3.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/b_-3.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/b_-3.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/b_-3.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/b_-3.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/b_-3.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/b_-3.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/b_-3.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/b_-3.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/b_-3.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/b_-3.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/b_-3.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/b_-3.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/b_-3.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/b_-3.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/b_-3.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/b_-3.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/b_-3.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/b_-3.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/b_-3.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/b_-3.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/b_-3.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/b_-3.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/b_-3.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/b_-3.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/b_-3.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/b_-3.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/b_-3.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/b_-3.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/b_-3.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/b_-3.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/b_-3.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/b_-3.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x b_-3 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp b_-2.inp /home/students/y12/iltarn/gamess-scratch/b_-2.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/b_-2.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/b_-2.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/b_-2.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/b_-2.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/b_-2.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/b_-2.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/b_-2.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/b_-2.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/b_-2.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/b_-2.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/b_-2.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/b_-2.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/b_-2.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/b_-2.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/b_-2.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/b_-2.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/b_-2.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/b_-2.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/b_-2.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/b_-2.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/b_-2.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/b_-2.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/b_-2.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/b_-2.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/b_-2.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/b_-2.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/b_-2.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/b_-2.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/b_-2.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/b_-2.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/b_-2.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/b_-2.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/b_-2.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/b_-2.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/b_-2.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/b_-2.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/b_-2.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/b_-2.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/b_-2.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/b_-2.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/b_-2.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/b_-2.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/b_-2.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/b_-2.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/b_-2.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/b_-2.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/b_-2.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/b_-2.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/b_-2.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/b_-2.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/b_-2.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/b_-2.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/b_-2.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/b_-2.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/b_-2.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/b_-2.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/b_-2.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/b_-2.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/b_-2.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/b_-2.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/b_-2.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/b_-2.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/b_-2.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/b_-2.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/b_-2.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/b_-2.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/b_-2.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/b_-2.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/b_-2.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/b_-2.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/b_-2.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/b_-2.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/b_-2.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/b_-2.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/b_-2.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/b_-2.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/b_-2.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/b_-2.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/b_-2.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/b_-2.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/b_-2.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/b_-2.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/b_-2.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/b_-2.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/b_-2.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/b_-2.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/b_-2.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/b_-2.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/b_-2.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/b_-2.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/b_-2.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/b_-2.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/b_-2.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/b_-2.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/b_-2.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/b_-2.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/b_-2.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/b_-2.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/b_-2.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/b_-2.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/b_-2.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/b_-2.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/b_-2.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/b_-2.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/b_-2.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/b_-2.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/b_-2.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/b_-2.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/b_-2.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/b_-2.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x b_-2 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp b_-1.inp /home/students/y12/iltarn/gamess-scratch/b_-1.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/b_-1.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/b_-1.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/b_-1.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/b_-1.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/b_-1.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/b_-1.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/b_-1.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/b_-1.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/b_-1.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/b_-1.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/b_-1.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/b_-1.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/b_-1.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/b_-1.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/b_-1.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/b_-1.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/b_-1.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/b_-1.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/b_-1.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/b_-1.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/b_-1.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/b_-1.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/b_-1.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/b_-1.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/b_-1.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/b_-1.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/b_-1.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/b_-1.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/b_-1.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/b_-1.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/b_-1.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/b_-1.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/b_-1.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/b_-1.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/b_-1.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/b_-1.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/b_-1.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/b_-1.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/b_-1.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/b_-1.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/b_-1.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/b_-1.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/b_-1.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/b_-1.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/b_-1.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/b_-1.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/b_-1.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/b_-1.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/b_-1.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/b_-1.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/b_-1.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/b_-1.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/b_-1.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/b_-1.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/b_-1.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/b_-1.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/b_-1.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/b_-1.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/b_-1.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/b_-1.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/b_-1.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/b_-1.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/b_-1.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/b_-1.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/b_-1.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/b_-1.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/b_-1.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/b_-1.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/b_-1.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/b_-1.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/b_-1.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/b_-1.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/b_-1.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/b_-1.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/b_-1.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/b_-1.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/b_-1.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/b_-1.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/b_-1.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/b_-1.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/b_-1.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/b_-1.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/b_-1.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/b_-1.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/b_-1.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/b_-1.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/b_-1.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/b_-1.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/b_-1.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/b_-1.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/b_-1.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/b_-1.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/b_-1.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/b_-1.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/b_-1.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/b_-1.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/b_-1.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/b_-1.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/b_-1.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/b_-1.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/b_-1.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/b_-1.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/b_-1.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/b_-1.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/b_-1.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/b_-1.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/b_-1.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/b_-1.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/b_-1.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/b_-1.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x b_-1 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp b_0.inp /home/students/y12/iltarn/gamess-scratch/b_0.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/b_0.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/b_0.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/b_0.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/b_0.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/b_0.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/b_0.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/b_0.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/b_0.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/b_0.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/b_0.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/b_0.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/b_0.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/b_0.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/b_0.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/b_0.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/b_0.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/b_0.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/b_0.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/b_0.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/b_0.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/b_0.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/b_0.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/b_0.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/b_0.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/b_0.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/b_0.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/b_0.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/b_0.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/b_0.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/b_0.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/b_0.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/b_0.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/b_0.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/b_0.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/b_0.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/b_0.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/b_0.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/b_0.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/b_0.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/b_0.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/b_0.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/b_0.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/b_0.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/b_0.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/b_0.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/b_0.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/b_0.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/b_0.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/b_0.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/b_0.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/b_0.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/b_0.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/b_0.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/b_0.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/b_0.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/b_0.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/b_0.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/b_0.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/b_0.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/b_0.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/b_0.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/b_0.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/b_0.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/b_0.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/b_0.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/b_0.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/b_0.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/b_0.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/b_0.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/b_0.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/b_0.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/b_0.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/b_0.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/b_0.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/b_0.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/b_0.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/b_0.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/b_0.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/b_0.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/b_0.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/b_0.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/b_0.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/b_0.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/b_0.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/b_0.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/b_0.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/b_0.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/b_0.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/b_0.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/b_0.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/b_0.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/b_0.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/b_0.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/b_0.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/b_0.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/b_0.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/b_0.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/b_0.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/b_0.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/b_0.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/b_0.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/b_0.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/b_0.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/b_0.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/b_0.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/b_0.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/b_0.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/b_0.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/b_0.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/b_0.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x b_0 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp b_1.inp /home/students/y12/iltarn/gamess-scratch/b_1.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/b_1.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/b_1.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/b_1.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/b_1.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/b_1.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/b_1.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/b_1.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/b_1.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/b_1.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/b_1.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/b_1.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/b_1.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/b_1.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/b_1.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/b_1.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/b_1.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/b_1.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/b_1.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/b_1.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/b_1.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/b_1.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/b_1.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/b_1.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/b_1.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/b_1.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/b_1.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/b_1.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/b_1.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/b_1.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/b_1.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/b_1.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/b_1.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/b_1.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/b_1.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/b_1.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/b_1.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/b_1.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/b_1.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/b_1.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/b_1.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/b_1.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/b_1.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/b_1.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/b_1.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/b_1.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/b_1.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/b_1.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/b_1.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/b_1.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/b_1.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/b_1.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/b_1.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/b_1.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/b_1.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/b_1.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/b_1.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/b_1.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/b_1.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/b_1.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/b_1.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/b_1.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/b_1.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/b_1.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/b_1.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/b_1.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/b_1.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/b_1.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/b_1.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/b_1.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/b_1.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/b_1.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/b_1.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/b_1.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/b_1.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/b_1.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/b_1.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/b_1.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/b_1.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/b_1.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/b_1.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/b_1.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/b_1.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/b_1.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/b_1.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/b_1.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/b_1.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/b_1.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/b_1.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/b_1.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/b_1.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/b_1.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/b_1.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/b_1.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/b_1.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/b_1.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/b_1.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/b_1.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/b_1.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/b_1.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/b_1.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/b_1.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/b_1.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/b_1.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/b_1.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/b_1.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/b_1.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/b_1.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/b_1.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/b_1.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/b_1.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x b_1 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp b_2.inp /home/students/y12/iltarn/gamess-scratch/b_2.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/b_2.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/b_2.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/b_2.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/b_2.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/b_2.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/b_2.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/b_2.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/b_2.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/b_2.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/b_2.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/b_2.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/b_2.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/b_2.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/b_2.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/b_2.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/b_2.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/b_2.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/b_2.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/b_2.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/b_2.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/b_2.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/b_2.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/b_2.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/b_2.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/b_2.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/b_2.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/b_2.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/b_2.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/b_2.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/b_2.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/b_2.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/b_2.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/b_2.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/b_2.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/b_2.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/b_2.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/b_2.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/b_2.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/b_2.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/b_2.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/b_2.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/b_2.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/b_2.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/b_2.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/b_2.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/b_2.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/b_2.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/b_2.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/b_2.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/b_2.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/b_2.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/b_2.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/b_2.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/b_2.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/b_2.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/b_2.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/b_2.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/b_2.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/b_2.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/b_2.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/b_2.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/b_2.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/b_2.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/b_2.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/b_2.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/b_2.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/b_2.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/b_2.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/b_2.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/b_2.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/b_2.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/b_2.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/b_2.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/b_2.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/b_2.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/b_2.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/b_2.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/b_2.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/b_2.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/b_2.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/b_2.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/b_2.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/b_2.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/b_2.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/b_2.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/b_2.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/b_2.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/b_2.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/b_2.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/b_2.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/b_2.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/b_2.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/b_2.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/b_2.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/b_2.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/b_2.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/b_2.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/b_2.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/b_2.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/b_2.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/b_2.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/b_2.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/b_2.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/b_2.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/b_2.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/b_2.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/b_2.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/b_2.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/b_2.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/b_2.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x b_2 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp b_3.inp /home/students/y12/iltarn/gamess-scratch/b_3.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/b_3.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/b_3.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/b_3.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/b_3.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/b_3.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/b_3.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/b_3.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/b_3.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/b_3.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/b_3.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/b_3.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/b_3.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/b_3.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/b_3.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/b_3.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/b_3.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/b_3.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/b_3.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/b_3.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/b_3.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/b_3.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/b_3.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/b_3.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/b_3.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/b_3.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/b_3.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/b_3.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/b_3.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/b_3.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/b_3.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/b_3.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/b_3.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/b_3.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/b_3.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/b_3.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/b_3.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/b_3.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/b_3.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/b_3.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/b_3.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/b_3.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/b_3.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/b_3.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/b_3.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/b_3.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/b_3.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/b_3.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/b_3.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/b_3.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/b_3.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/b_3.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/b_3.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/b_3.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/b_3.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/b_3.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/b_3.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/b_3.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/b_3.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/b_3.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/b_3.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/b_3.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/b_3.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/b_3.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/b_3.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/b_3.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/b_3.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/b_3.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/b_3.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/b_3.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/b_3.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/b_3.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/b_3.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/b_3.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/b_3.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/b_3.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/b_3.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/b_3.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/b_3.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/b_3.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/b_3.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/b_3.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/b_3.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/b_3.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/b_3.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/b_3.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/b_3.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/b_3.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/b_3.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/b_3.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/b_3.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/b_3.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/b_3.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/b_3.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/b_3.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/b_3.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/b_3.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/b_3.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/b_3.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/b_3.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/b_3.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/b_3.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/b_3.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/b_3.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/b_3.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/b_3.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/b_3.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/b_3.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/b_3.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/b_3.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/b_3.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x b_3 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp b_4.inp /home/students/y12/iltarn/gamess-scratch/b_4.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/b_4.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/b_4.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/b_4.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/b_4.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/b_4.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/b_4.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/b_4.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/b_4.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/b_4.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/b_4.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/b_4.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/b_4.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/b_4.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/b_4.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/b_4.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/b_4.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/b_4.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/b_4.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/b_4.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/b_4.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/b_4.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/b_4.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/b_4.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/b_4.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/b_4.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/b_4.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/b_4.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/b_4.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/b_4.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/b_4.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/b_4.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/b_4.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/b_4.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/b_4.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/b_4.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/b_4.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/b_4.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/b_4.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/b_4.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/b_4.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/b_4.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/b_4.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/b_4.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/b_4.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/b_4.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/b_4.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/b_4.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/b_4.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/b_4.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/b_4.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/b_4.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/b_4.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/b_4.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/b_4.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/b_4.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/b_4.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/b_4.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/b_4.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/b_4.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/b_4.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/b_4.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/b_4.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/b_4.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/b_4.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/b_4.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/b_4.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/b_4.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/b_4.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/b_4.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/b_4.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/b_4.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/b_4.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/b_4.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/b_4.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/b_4.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/b_4.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/b_4.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/b_4.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/b_4.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/b_4.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/b_4.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/b_4.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/b_4.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/b_4.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/b_4.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/b_4.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/b_4.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/b_4.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/b_4.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/b_4.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/b_4.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/b_4.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/b_4.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/b_4.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/b_4.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/b_4.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/b_4.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/b_4.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/b_4.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/b_4.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/b_4.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/b_4.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/b_4.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/b_4.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/b_4.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/b_4.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/b_4.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/b_4.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/b_4.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/b_4.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x b_4 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp b_5.inp /home/students/y12/iltarn/gamess-scratch/b_5.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/b_5.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/b_5.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/b_5.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/b_5.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/b_5.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/b_5.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/b_5.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/b_5.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/b_5.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/b_5.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/b_5.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/b_5.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/b_5.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/b_5.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/b_5.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/b_5.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/b_5.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/b_5.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/b_5.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/b_5.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/b_5.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/b_5.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/b_5.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/b_5.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/b_5.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/b_5.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/b_5.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/b_5.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/b_5.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/b_5.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/b_5.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/b_5.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/b_5.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/b_5.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/b_5.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/b_5.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/b_5.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/b_5.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/b_5.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/b_5.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/b_5.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/b_5.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/b_5.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/b_5.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/b_5.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/b_5.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/b_5.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/b_5.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/b_5.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/b_5.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/b_5.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/b_5.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/b_5.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/b_5.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/b_5.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/b_5.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/b_5.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/b_5.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/b_5.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/b_5.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/b_5.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/b_5.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/b_5.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/b_5.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/b_5.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/b_5.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/b_5.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/b_5.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/b_5.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/b_5.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/b_5.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/b_5.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/b_5.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/b_5.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/b_5.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/b_5.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/b_5.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/b_5.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/b_5.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/b_5.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/b_5.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/b_5.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/b_5.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/b_5.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/b_5.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/b_5.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/b_5.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/b_5.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/b_5.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/b_5.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/b_5.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/b_5.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/b_5.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/b_5.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/b_5.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/b_5.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/b_5.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/b_5.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/b_5.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/b_5.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/b_5.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/b_5.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/b_5.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/b_5.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/b_5.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/b_5.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/b_5.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/b_5.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/b_5.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/b_5.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x b_5 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp b_6.inp /home/students/y12/iltarn/gamess-scratch/b_6.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/b_6.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/b_6.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/b_6.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/b_6.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/b_6.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/b_6.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/b_6.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/b_6.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/b_6.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/b_6.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/b_6.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/b_6.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/b_6.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/b_6.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/b_6.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/b_6.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/b_6.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/b_6.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/b_6.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/b_6.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/b_6.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/b_6.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/b_6.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/b_6.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/b_6.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/b_6.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/b_6.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/b_6.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/b_6.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/b_6.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/b_6.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/b_6.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/b_6.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/b_6.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/b_6.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/b_6.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/b_6.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/b_6.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/b_6.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/b_6.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/b_6.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/b_6.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/b_6.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/b_6.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/b_6.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/b_6.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/b_6.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/b_6.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/b_6.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/b_6.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/b_6.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/b_6.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/b_6.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/b_6.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/b_6.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/b_6.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/b_6.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/b_6.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/b_6.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/b_6.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/b_6.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/b_6.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/b_6.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/b_6.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/b_6.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/b_6.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/b_6.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/b_6.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/b_6.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/b_6.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/b_6.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/b_6.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/b_6.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/b_6.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/b_6.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/b_6.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/b_6.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/b_6.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/b_6.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/b_6.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/b_6.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/b_6.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/b_6.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/b_6.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/b_6.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/b_6.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/b_6.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/b_6.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/b_6.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/b_6.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/b_6.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/b_6.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/b_6.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/b_6.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/b_6.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/b_6.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/b_6.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/b_6.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/b_6.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/b_6.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/b_6.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/b_6.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/b_6.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/b_6.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/b_6.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/b_6.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/b_6.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/b_6.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/b_6.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/b_6.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x b_6 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp b_7.inp /home/students/y12/iltarn/gamess-scratch/b_7.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/b_7.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/b_7.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/b_7.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/b_7.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/b_7.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/b_7.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/b_7.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/b_7.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/b_7.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/b_7.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/b_7.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/b_7.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/b_7.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/b_7.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/b_7.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/b_7.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/b_7.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/b_7.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/b_7.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/b_7.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/b_7.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/b_7.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/b_7.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/b_7.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/b_7.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/b_7.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/b_7.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/b_7.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/b_7.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/b_7.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/b_7.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/b_7.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/b_7.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/b_7.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/b_7.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/b_7.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/b_7.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/b_7.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/b_7.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/b_7.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/b_7.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/b_7.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/b_7.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/b_7.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/b_7.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/b_7.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/b_7.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/b_7.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/b_7.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/b_7.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/b_7.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/b_7.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/b_7.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/b_7.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/b_7.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/b_7.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/b_7.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/b_7.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/b_7.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/b_7.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/b_7.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/b_7.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/b_7.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/b_7.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/b_7.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/b_7.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/b_7.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/b_7.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/b_7.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/b_7.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/b_7.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/b_7.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/b_7.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/b_7.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/b_7.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/b_7.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/b_7.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/b_7.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/b_7.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/b_7.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/b_7.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/b_7.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/b_7.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/b_7.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/b_7.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/b_7.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/b_7.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/b_7.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/b_7.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/b_7.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/b_7.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/b_7.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/b_7.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/b_7.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/b_7.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/b_7.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/b_7.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/b_7.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/b_7.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/b_7.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/b_7.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/b_7.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/b_7.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/b_7.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/b_7.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/b_7.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/b_7.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/b_7.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/b_7.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/b_7.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x b_7 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp b_8.inp /home/students/y12/iltarn/gamess-scratch/b_8.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/b_8.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/b_8.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/b_8.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/b_8.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/b_8.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/b_8.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/b_8.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/b_8.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/b_8.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/b_8.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/b_8.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/b_8.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/b_8.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/b_8.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/b_8.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/b_8.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/b_8.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/b_8.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/b_8.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/b_8.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/b_8.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/b_8.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/b_8.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/b_8.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/b_8.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/b_8.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/b_8.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/b_8.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/b_8.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/b_8.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/b_8.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/b_8.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/b_8.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/b_8.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/b_8.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/b_8.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/b_8.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/b_8.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/b_8.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/b_8.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/b_8.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/b_8.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/b_8.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/b_8.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/b_8.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/b_8.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/b_8.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/b_8.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/b_8.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/b_8.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/b_8.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/b_8.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/b_8.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/b_8.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/b_8.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/b_8.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/b_8.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/b_8.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/b_8.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/b_8.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/b_8.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/b_8.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/b_8.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/b_8.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/b_8.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/b_8.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/b_8.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/b_8.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/b_8.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/b_8.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/b_8.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/b_8.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/b_8.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/b_8.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/b_8.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/b_8.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/b_8.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/b_8.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/b_8.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/b_8.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/b_8.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/b_8.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/b_8.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/b_8.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/b_8.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/b_8.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/b_8.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/b_8.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/b_8.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/b_8.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/b_8.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/b_8.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/b_8.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/b_8.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/b_8.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/b_8.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/b_8.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/b_8.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/b_8.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/b_8.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/b_8.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/b_8.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/b_8.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/b_8.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/b_8.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/b_8.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/b_8.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/b_8.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/b_8.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/b_8.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x b_8 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp b_9.inp /home/students/y12/iltarn/gamess-scratch/b_9.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/b_9.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/b_9.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/b_9.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/b_9.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/b_9.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/b_9.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/b_9.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/b_9.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/b_9.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/b_9.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/b_9.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/b_9.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/b_9.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/b_9.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/b_9.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/b_9.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/b_9.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/b_9.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/b_9.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/b_9.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/b_9.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/b_9.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/b_9.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/b_9.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/b_9.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/b_9.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/b_9.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/b_9.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/b_9.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/b_9.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/b_9.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/b_9.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/b_9.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/b_9.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/b_9.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/b_9.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/b_9.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/b_9.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/b_9.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/b_9.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/b_9.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/b_9.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/b_9.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/b_9.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/b_9.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/b_9.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/b_9.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/b_9.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/b_9.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/b_9.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/b_9.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/b_9.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/b_9.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/b_9.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/b_9.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/b_9.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/b_9.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/b_9.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/b_9.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/b_9.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/b_9.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/b_9.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/b_9.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/b_9.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/b_9.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/b_9.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/b_9.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/b_9.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/b_9.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/b_9.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/b_9.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/b_9.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/b_9.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/b_9.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/b_9.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/b_9.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/b_9.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/b_9.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/b_9.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/b_9.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/b_9.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/b_9.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/b_9.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/b_9.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/b_9.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/b_9.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/b_9.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/b_9.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/b_9.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/b_9.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/b_9.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/b_9.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/b_9.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/b_9.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/b_9.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/b_9.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/b_9.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/b_9.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/b_9.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/b_9.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/b_9.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/b_9.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/b_9.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/b_9.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/b_9.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/b_9.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/b_9.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/b_9.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/b_9.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/b_9.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x b_9 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp b_10.inp /home/students/y12/iltarn/gamess-scratch/b_10.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/b_10.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/b_10.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/b_10.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/b_10.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/b_10.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/b_10.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/b_10.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/b_10.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/b_10.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/b_10.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/b_10.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/b_10.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/b_10.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/b_10.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/b_10.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/b_10.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/b_10.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/b_10.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/b_10.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/b_10.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/b_10.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/b_10.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/b_10.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/b_10.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/b_10.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/b_10.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/b_10.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/b_10.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/b_10.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/b_10.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/b_10.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/b_10.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/b_10.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/b_10.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/b_10.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/b_10.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/b_10.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/b_10.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/b_10.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/b_10.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/b_10.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/b_10.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/b_10.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/b_10.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/b_10.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/b_10.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/b_10.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/b_10.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/b_10.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/b_10.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/b_10.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/b_10.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/b_10.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/b_10.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/b_10.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/b_10.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/b_10.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/b_10.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/b_10.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/b_10.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/b_10.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/b_10.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/b_10.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/b_10.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/b_10.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/b_10.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/b_10.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/b_10.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/b_10.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/b_10.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/b_10.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/b_10.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/b_10.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/b_10.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/b_10.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/b_10.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/b_10.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/b_10.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/b_10.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/b_10.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/b_10.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/b_10.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/b_10.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/b_10.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/b_10.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/b_10.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/b_10.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/b_10.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/b_10.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/b_10.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/b_10.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/b_10.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/b_10.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/b_10.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/b_10.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/b_10.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/b_10.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/b_10.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/b_10.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/b_10.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/b_10.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/b_10.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/b_10.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/b_10.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/b_10.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/b_10.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/b_10.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/b_10.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/b_10.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/b_10.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x b_10 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo
In [39]:
%%bash
#### Собираем информацию об энергиях в 1 файл (каждому варианту соответствует значение энергии)
cd
cd Term6
cd Practice4
for i in {-10..10}; do
nb=$(echo "scale=5; 1.52986 + $i/50" | bc -l)
sed "s/cc=1.52986/cc=$nb/" et.inp > b_${i}.inp
#gms b_${i}.inp 1 > b_${i}.log
echo -n "$nb " >> bond
awk '/TOTAL ENERGY =/{print $4}' b_${i}.log >> bond
done
5. Построение зависимости в matplotlib¶
In [56]:
%matplotlib inline
import numpy as np
import matplotlib.pyplot as plt
from scipy import optimize
In [62]:
a = np.loadtxt("/home/students/y12/iltarn/Term6/Practice4/bond")
x_o=a[:,0]
y_o=a[:,1]
print "Initial data:", y_o
#function is f(x)=k(b-x)^2 + a
fitfunc = lambda p, x: p[0]*pow(p[1]-x,2) + p[2] # Target function
errfunc = lambda p, x, y: fitfunc(p, x) - y # Error function
p0 = [1,1, -79] # Initial guess for the parameters
p1, success = optimize.leastsq(errfunc, p0[:], args=(x_o, y_o))
print "Optimized params:", p1
#Plot it
plt.plot(x_o, y_o, "ro", x_o,fitfunc(p1,x_o),"r-",c='blue',alpha=0.5)
plt.xlim(1.3,1.8)
plt.savefig('bond.png')
plt.show()
Initial data: [-79.73393153 -79.74061737 -79.74628686 -79.75103318 -79.75494129 -79.75808863 -79.76054578 -79.76237713 -79.76364138 -79.76439208 -79.76467808 -79.76454395 -79.7640304 -79.76317457 -79.76201041 -79.76056892 -79.75887846 -79.75696494 -79.75485209 -79.75256157 -79.75011326] Optimized params: [ 0.56360732 1.55431773 -79.76518585]
In [51]:
Image(filename='bond.png')
Out[51]:
Разница между функцией и расположением точек может объяснятся тем, что зависимость энергии молекулы от длины связи имеет более сложный вид, чем просто парабола.
6. То же самое для валентного угла HCH (109.2 - 113.2)¶
In [52]:
%%bash
rm -rf ~/gamess-scratch/
cd
cd Term6
cd Practice4
for i in {-10..10}; do
nb=$(echo "scale=5; 111.2 + $i/5" | bc -l)
sed "s/cch=111.2/cch=$nb/" et.inp > a_${i}.inp
gms a_${i}.inp 1 > a_${i}.log
echo -n "$nb " >> hch
awk '/TOTAL ENERGY =/{print $4}' a_${i}.log >> hch
done
rm: cannot remove `angle': No such file or directory cp a_-10.inp /home/students/y12/iltarn/gamess-scratch/a_-10.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/a_-10.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/a_-10.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/a_-10.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/a_-10.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/a_-10.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/a_-10.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/a_-10.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/a_-10.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/a_-10.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/a_-10.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/a_-10.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/a_-10.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/a_-10.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/a_-10.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/a_-10.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/a_-10.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/a_-10.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/a_-10.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/a_-10.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/a_-10.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/a_-10.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/a_-10.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/a_-10.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/a_-10.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/a_-10.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/a_-10.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/a_-10.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/a_-10.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/a_-10.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/a_-10.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/a_-10.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/a_-10.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/a_-10.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/a_-10.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/a_-10.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/a_-10.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/a_-10.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/a_-10.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/a_-10.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/a_-10.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/a_-10.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/a_-10.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/a_-10.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/a_-10.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/a_-10.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/a_-10.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/a_-10.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/a_-10.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/a_-10.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/a_-10.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/a_-10.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/a_-10.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/a_-10.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/a_-10.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/a_-10.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/a_-10.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/a_-10.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/a_-10.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/a_-10.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/a_-10.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/a_-10.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/a_-10.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/a_-10.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/a_-10.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/a_-10.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/a_-10.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/a_-10.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/a_-10.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/a_-10.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/a_-10.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/a_-10.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/a_-10.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/a_-10.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/a_-10.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/a_-10.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/a_-10.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/a_-10.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/a_-10.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/a_-10.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/a_-10.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/a_-10.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/a_-10.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/a_-10.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/a_-10.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/a_-10.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/a_-10.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/a_-10.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/a_-10.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/a_-10.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/a_-10.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/a_-10.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/a_-10.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/a_-10.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/a_-10.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/a_-10.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/a_-10.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/a_-10.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/a_-10.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/a_-10.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/a_-10.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/a_-10.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/a_-10.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/a_-10.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/a_-10.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/a_-10.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/a_-10.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/a_-10.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/a_-10.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/a_-10.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/a_-10.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x a_-10 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp a_-9.inp /home/students/y12/iltarn/gamess-scratch/a_-9.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/a_-9.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/a_-9.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/a_-9.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/a_-9.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/a_-9.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/a_-9.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/a_-9.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/a_-9.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/a_-9.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/a_-9.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/a_-9.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/a_-9.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/a_-9.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/a_-9.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/a_-9.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/a_-9.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/a_-9.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/a_-9.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/a_-9.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/a_-9.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/a_-9.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/a_-9.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/a_-9.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/a_-9.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/a_-9.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/a_-9.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/a_-9.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/a_-9.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/a_-9.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/a_-9.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/a_-9.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/a_-9.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/a_-9.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/a_-9.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/a_-9.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/a_-9.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/a_-9.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/a_-9.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/a_-9.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/a_-9.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/a_-9.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/a_-9.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/a_-9.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/a_-9.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/a_-9.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/a_-9.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/a_-9.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/a_-9.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/a_-9.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/a_-9.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/a_-9.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/a_-9.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/a_-9.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/a_-9.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/a_-9.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/a_-9.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/a_-9.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/a_-9.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/a_-9.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/a_-9.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/a_-9.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/a_-9.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/a_-9.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/a_-9.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/a_-9.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/a_-9.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/a_-9.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/a_-9.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/a_-9.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/a_-9.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/a_-9.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/a_-9.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/a_-9.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/a_-9.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/a_-9.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/a_-9.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/a_-9.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/a_-9.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/a_-9.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/a_-9.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/a_-9.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/a_-9.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/a_-9.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/a_-9.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/a_-9.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/a_-9.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/a_-9.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/a_-9.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/a_-9.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/a_-9.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/a_-9.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/a_-9.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/a_-9.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/a_-9.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/a_-9.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/a_-9.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/a_-9.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/a_-9.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/a_-9.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/a_-9.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/a_-9.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/a_-9.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/a_-9.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/a_-9.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/a_-9.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/a_-9.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/a_-9.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/a_-9.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/a_-9.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/a_-9.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x a_-9 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp a_-8.inp /home/students/y12/iltarn/gamess-scratch/a_-8.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/a_-8.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/a_-8.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/a_-8.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/a_-8.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/a_-8.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/a_-8.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/a_-8.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/a_-8.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/a_-8.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/a_-8.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/a_-8.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/a_-8.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/a_-8.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/a_-8.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/a_-8.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/a_-8.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/a_-8.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/a_-8.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/a_-8.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/a_-8.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/a_-8.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/a_-8.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/a_-8.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/a_-8.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/a_-8.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/a_-8.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/a_-8.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/a_-8.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/a_-8.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/a_-8.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/a_-8.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/a_-8.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/a_-8.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/a_-8.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/a_-8.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/a_-8.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/a_-8.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/a_-8.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/a_-8.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/a_-8.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/a_-8.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/a_-8.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/a_-8.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/a_-8.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/a_-8.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/a_-8.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/a_-8.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/a_-8.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/a_-8.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/a_-8.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/a_-8.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/a_-8.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/a_-8.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/a_-8.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/a_-8.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/a_-8.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/a_-8.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/a_-8.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/a_-8.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/a_-8.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/a_-8.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/a_-8.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/a_-8.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/a_-8.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/a_-8.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/a_-8.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/a_-8.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/a_-8.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/a_-8.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/a_-8.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/a_-8.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/a_-8.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/a_-8.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/a_-8.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/a_-8.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/a_-8.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/a_-8.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/a_-8.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/a_-8.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/a_-8.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/a_-8.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/a_-8.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/a_-8.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/a_-8.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/a_-8.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/a_-8.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/a_-8.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/a_-8.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/a_-8.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/a_-8.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/a_-8.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/a_-8.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/a_-8.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/a_-8.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/a_-8.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/a_-8.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/a_-8.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/a_-8.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/a_-8.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/a_-8.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/a_-8.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/a_-8.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/a_-8.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/a_-8.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/a_-8.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/a_-8.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/a_-8.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/a_-8.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/a_-8.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/a_-8.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x a_-8 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp a_-7.inp /home/students/y12/iltarn/gamess-scratch/a_-7.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/a_-7.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/a_-7.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/a_-7.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/a_-7.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/a_-7.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/a_-7.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/a_-7.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/a_-7.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/a_-7.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/a_-7.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/a_-7.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/a_-7.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/a_-7.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/a_-7.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/a_-7.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/a_-7.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/a_-7.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/a_-7.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/a_-7.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/a_-7.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/a_-7.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/a_-7.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/a_-7.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/a_-7.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/a_-7.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/a_-7.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/a_-7.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/a_-7.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/a_-7.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/a_-7.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/a_-7.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/a_-7.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/a_-7.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/a_-7.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/a_-7.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/a_-7.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/a_-7.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/a_-7.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/a_-7.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/a_-7.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/a_-7.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/a_-7.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/a_-7.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/a_-7.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/a_-7.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/a_-7.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/a_-7.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/a_-7.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/a_-7.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/a_-7.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/a_-7.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/a_-7.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/a_-7.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/a_-7.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/a_-7.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/a_-7.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/a_-7.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/a_-7.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/a_-7.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/a_-7.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/a_-7.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/a_-7.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/a_-7.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/a_-7.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/a_-7.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/a_-7.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/a_-7.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/a_-7.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/a_-7.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/a_-7.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/a_-7.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/a_-7.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/a_-7.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/a_-7.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/a_-7.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/a_-7.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/a_-7.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/a_-7.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/a_-7.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/a_-7.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/a_-7.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/a_-7.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/a_-7.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/a_-7.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/a_-7.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/a_-7.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/a_-7.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/a_-7.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/a_-7.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/a_-7.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/a_-7.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/a_-7.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/a_-7.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/a_-7.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/a_-7.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/a_-7.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/a_-7.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/a_-7.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/a_-7.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/a_-7.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/a_-7.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/a_-7.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/a_-7.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/a_-7.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/a_-7.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/a_-7.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/a_-7.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/a_-7.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/a_-7.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/a_-7.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x a_-7 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp a_-6.inp /home/students/y12/iltarn/gamess-scratch/a_-6.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/a_-6.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/a_-6.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/a_-6.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/a_-6.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/a_-6.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/a_-6.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/a_-6.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/a_-6.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/a_-6.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/a_-6.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/a_-6.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/a_-6.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/a_-6.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/a_-6.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/a_-6.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/a_-6.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/a_-6.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/a_-6.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/a_-6.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/a_-6.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/a_-6.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/a_-6.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/a_-6.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/a_-6.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/a_-6.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/a_-6.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/a_-6.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/a_-6.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/a_-6.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/a_-6.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/a_-6.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/a_-6.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/a_-6.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/a_-6.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/a_-6.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/a_-6.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/a_-6.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/a_-6.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/a_-6.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/a_-6.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/a_-6.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/a_-6.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/a_-6.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/a_-6.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/a_-6.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/a_-6.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/a_-6.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/a_-6.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/a_-6.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/a_-6.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/a_-6.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/a_-6.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/a_-6.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/a_-6.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/a_-6.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/a_-6.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/a_-6.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/a_-6.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/a_-6.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/a_-6.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/a_-6.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/a_-6.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/a_-6.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/a_-6.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/a_-6.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/a_-6.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/a_-6.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/a_-6.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/a_-6.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/a_-6.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/a_-6.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/a_-6.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/a_-6.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/a_-6.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/a_-6.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/a_-6.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/a_-6.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/a_-6.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/a_-6.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/a_-6.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/a_-6.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/a_-6.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/a_-6.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/a_-6.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/a_-6.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/a_-6.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/a_-6.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/a_-6.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/a_-6.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/a_-6.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/a_-6.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/a_-6.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/a_-6.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/a_-6.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/a_-6.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/a_-6.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/a_-6.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/a_-6.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/a_-6.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/a_-6.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/a_-6.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/a_-6.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/a_-6.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/a_-6.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/a_-6.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/a_-6.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/a_-6.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/a_-6.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/a_-6.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/a_-6.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x a_-6 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp a_-5.inp /home/students/y12/iltarn/gamess-scratch/a_-5.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/a_-5.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/a_-5.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/a_-5.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/a_-5.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/a_-5.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/a_-5.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/a_-5.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/a_-5.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/a_-5.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/a_-5.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/a_-5.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/a_-5.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/a_-5.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/a_-5.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/a_-5.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/a_-5.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/a_-5.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/a_-5.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/a_-5.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/a_-5.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/a_-5.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/a_-5.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/a_-5.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/a_-5.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/a_-5.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/a_-5.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/a_-5.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/a_-5.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/a_-5.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/a_-5.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/a_-5.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/a_-5.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/a_-5.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/a_-5.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/a_-5.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/a_-5.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/a_-5.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/a_-5.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/a_-5.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/a_-5.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/a_-5.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/a_-5.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/a_-5.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/a_-5.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/a_-5.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/a_-5.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/a_-5.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/a_-5.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/a_-5.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/a_-5.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/a_-5.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/a_-5.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/a_-5.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/a_-5.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/a_-5.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/a_-5.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/a_-5.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/a_-5.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/a_-5.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/a_-5.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/a_-5.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/a_-5.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/a_-5.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/a_-5.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/a_-5.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/a_-5.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/a_-5.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/a_-5.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/a_-5.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/a_-5.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/a_-5.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/a_-5.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/a_-5.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/a_-5.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/a_-5.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/a_-5.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/a_-5.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/a_-5.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/a_-5.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/a_-5.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/a_-5.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/a_-5.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/a_-5.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/a_-5.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/a_-5.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/a_-5.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/a_-5.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/a_-5.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/a_-5.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/a_-5.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/a_-5.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/a_-5.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/a_-5.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/a_-5.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/a_-5.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/a_-5.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/a_-5.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/a_-5.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/a_-5.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/a_-5.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/a_-5.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/a_-5.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/a_-5.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/a_-5.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/a_-5.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/a_-5.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/a_-5.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/a_-5.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/a_-5.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/a_-5.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x a_-5 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp a_-4.inp /home/students/y12/iltarn/gamess-scratch/a_-4.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/a_-4.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/a_-4.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/a_-4.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/a_-4.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/a_-4.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/a_-4.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/a_-4.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/a_-4.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/a_-4.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/a_-4.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/a_-4.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/a_-4.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/a_-4.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/a_-4.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/a_-4.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/a_-4.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/a_-4.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/a_-4.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/a_-4.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/a_-4.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/a_-4.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/a_-4.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/a_-4.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/a_-4.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/a_-4.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/a_-4.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/a_-4.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/a_-4.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/a_-4.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/a_-4.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/a_-4.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/a_-4.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/a_-4.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/a_-4.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/a_-4.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/a_-4.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/a_-4.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/a_-4.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/a_-4.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/a_-4.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/a_-4.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/a_-4.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/a_-4.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/a_-4.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/a_-4.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/a_-4.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/a_-4.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/a_-4.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/a_-4.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/a_-4.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/a_-4.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/a_-4.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/a_-4.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/a_-4.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/a_-4.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/a_-4.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/a_-4.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/a_-4.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/a_-4.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/a_-4.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/a_-4.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/a_-4.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/a_-4.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/a_-4.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/a_-4.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/a_-4.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/a_-4.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/a_-4.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/a_-4.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/a_-4.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/a_-4.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/a_-4.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/a_-4.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/a_-4.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/a_-4.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/a_-4.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/a_-4.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/a_-4.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/a_-4.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/a_-4.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/a_-4.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/a_-4.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/a_-4.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/a_-4.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/a_-4.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/a_-4.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/a_-4.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/a_-4.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/a_-4.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/a_-4.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/a_-4.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/a_-4.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/a_-4.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/a_-4.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/a_-4.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/a_-4.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/a_-4.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/a_-4.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/a_-4.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/a_-4.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/a_-4.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/a_-4.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/a_-4.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/a_-4.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/a_-4.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/a_-4.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/a_-4.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/a_-4.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/a_-4.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/a_-4.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x a_-4 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp a_-3.inp /home/students/y12/iltarn/gamess-scratch/a_-3.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/a_-3.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/a_-3.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/a_-3.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/a_-3.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/a_-3.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/a_-3.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/a_-3.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/a_-3.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/a_-3.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/a_-3.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/a_-3.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/a_-3.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/a_-3.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/a_-3.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/a_-3.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/a_-3.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/a_-3.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/a_-3.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/a_-3.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/a_-3.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/a_-3.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/a_-3.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/a_-3.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/a_-3.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/a_-3.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/a_-3.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/a_-3.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/a_-3.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/a_-3.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/a_-3.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/a_-3.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/a_-3.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/a_-3.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/a_-3.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/a_-3.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/a_-3.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/a_-3.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/a_-3.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/a_-3.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/a_-3.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/a_-3.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/a_-3.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/a_-3.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/a_-3.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/a_-3.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/a_-3.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/a_-3.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/a_-3.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/a_-3.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/a_-3.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/a_-3.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/a_-3.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/a_-3.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/a_-3.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/a_-3.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/a_-3.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/a_-3.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/a_-3.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/a_-3.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/a_-3.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/a_-3.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/a_-3.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/a_-3.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/a_-3.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/a_-3.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/a_-3.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/a_-3.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/a_-3.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/a_-3.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/a_-3.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/a_-3.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/a_-3.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/a_-3.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/a_-3.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/a_-3.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/a_-3.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/a_-3.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/a_-3.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/a_-3.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/a_-3.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/a_-3.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/a_-3.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/a_-3.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/a_-3.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/a_-3.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/a_-3.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/a_-3.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/a_-3.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/a_-3.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/a_-3.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/a_-3.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/a_-3.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/a_-3.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/a_-3.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/a_-3.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/a_-3.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/a_-3.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/a_-3.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/a_-3.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/a_-3.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/a_-3.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/a_-3.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/a_-3.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/a_-3.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/a_-3.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/a_-3.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/a_-3.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/a_-3.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/a_-3.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/a_-3.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x a_-3 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp a_-2.inp /home/students/y12/iltarn/gamess-scratch/a_-2.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/a_-2.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/a_-2.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/a_-2.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/a_-2.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/a_-2.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/a_-2.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/a_-2.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/a_-2.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/a_-2.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/a_-2.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/a_-2.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/a_-2.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/a_-2.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/a_-2.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/a_-2.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/a_-2.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/a_-2.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/a_-2.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/a_-2.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/a_-2.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/a_-2.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/a_-2.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/a_-2.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/a_-2.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/a_-2.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/a_-2.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/a_-2.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/a_-2.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/a_-2.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/a_-2.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/a_-2.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/a_-2.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/a_-2.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/a_-2.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/a_-2.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/a_-2.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/a_-2.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/a_-2.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/a_-2.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/a_-2.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/a_-2.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/a_-2.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/a_-2.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/a_-2.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/a_-2.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/a_-2.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/a_-2.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/a_-2.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/a_-2.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/a_-2.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/a_-2.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/a_-2.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/a_-2.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/a_-2.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/a_-2.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/a_-2.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/a_-2.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/a_-2.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/a_-2.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/a_-2.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/a_-2.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/a_-2.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/a_-2.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/a_-2.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/a_-2.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/a_-2.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/a_-2.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/a_-2.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/a_-2.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/a_-2.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/a_-2.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/a_-2.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/a_-2.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/a_-2.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/a_-2.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/a_-2.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/a_-2.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/a_-2.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/a_-2.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/a_-2.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/a_-2.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/a_-2.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/a_-2.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/a_-2.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/a_-2.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/a_-2.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/a_-2.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/a_-2.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/a_-2.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/a_-2.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/a_-2.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/a_-2.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/a_-2.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/a_-2.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/a_-2.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/a_-2.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/a_-2.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/a_-2.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/a_-2.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/a_-2.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/a_-2.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/a_-2.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/a_-2.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/a_-2.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/a_-2.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/a_-2.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/a_-2.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/a_-2.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/a_-2.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/a_-2.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x a_-2 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp a_-1.inp /home/students/y12/iltarn/gamess-scratch/a_-1.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/a_-1.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/a_-1.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/a_-1.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/a_-1.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/a_-1.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/a_-1.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/a_-1.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/a_-1.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/a_-1.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/a_-1.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/a_-1.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/a_-1.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/a_-1.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/a_-1.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/a_-1.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/a_-1.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/a_-1.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/a_-1.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/a_-1.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/a_-1.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/a_-1.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/a_-1.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/a_-1.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/a_-1.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/a_-1.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/a_-1.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/a_-1.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/a_-1.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/a_-1.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/a_-1.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/a_-1.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/a_-1.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/a_-1.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/a_-1.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/a_-1.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/a_-1.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/a_-1.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/a_-1.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/a_-1.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/a_-1.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/a_-1.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/a_-1.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/a_-1.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/a_-1.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/a_-1.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/a_-1.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/a_-1.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/a_-1.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/a_-1.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/a_-1.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/a_-1.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/a_-1.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/a_-1.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/a_-1.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/a_-1.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/a_-1.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/a_-1.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/a_-1.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/a_-1.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/a_-1.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/a_-1.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/a_-1.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/a_-1.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/a_-1.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/a_-1.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/a_-1.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/a_-1.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/a_-1.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/a_-1.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/a_-1.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/a_-1.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/a_-1.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/a_-1.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/a_-1.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/a_-1.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/a_-1.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/a_-1.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/a_-1.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/a_-1.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/a_-1.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/a_-1.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/a_-1.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/a_-1.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/a_-1.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/a_-1.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/a_-1.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/a_-1.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/a_-1.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/a_-1.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/a_-1.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/a_-1.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/a_-1.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/a_-1.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/a_-1.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/a_-1.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/a_-1.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/a_-1.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/a_-1.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/a_-1.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/a_-1.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/a_-1.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/a_-1.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/a_-1.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/a_-1.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/a_-1.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/a_-1.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/a_-1.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/a_-1.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/a_-1.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/a_-1.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x a_-1 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp a_0.inp /home/students/y12/iltarn/gamess-scratch/a_0.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/a_0.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/a_0.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/a_0.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/a_0.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/a_0.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/a_0.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/a_0.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/a_0.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/a_0.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/a_0.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/a_0.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/a_0.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/a_0.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/a_0.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/a_0.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/a_0.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/a_0.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/a_0.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/a_0.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/a_0.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/a_0.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/a_0.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/a_0.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/a_0.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/a_0.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/a_0.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/a_0.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/a_0.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/a_0.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/a_0.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/a_0.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/a_0.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/a_0.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/a_0.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/a_0.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/a_0.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/a_0.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/a_0.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/a_0.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/a_0.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/a_0.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/a_0.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/a_0.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/a_0.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/a_0.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/a_0.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/a_0.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/a_0.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/a_0.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/a_0.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/a_0.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/a_0.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/a_0.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/a_0.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/a_0.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/a_0.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/a_0.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/a_0.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/a_0.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/a_0.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/a_0.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/a_0.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/a_0.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/a_0.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/a_0.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/a_0.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/a_0.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/a_0.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/a_0.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/a_0.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/a_0.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/a_0.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/a_0.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/a_0.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/a_0.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/a_0.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/a_0.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/a_0.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/a_0.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/a_0.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/a_0.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/a_0.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/a_0.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/a_0.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/a_0.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/a_0.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/a_0.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/a_0.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/a_0.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/a_0.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/a_0.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/a_0.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/a_0.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/a_0.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/a_0.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/a_0.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/a_0.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/a_0.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/a_0.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/a_0.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/a_0.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/a_0.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/a_0.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/a_0.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/a_0.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/a_0.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/a_0.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/a_0.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/a_0.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/a_0.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x a_0 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp a_1.inp /home/students/y12/iltarn/gamess-scratch/a_1.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/a_1.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/a_1.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/a_1.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/a_1.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/a_1.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/a_1.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/a_1.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/a_1.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/a_1.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/a_1.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/a_1.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/a_1.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/a_1.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/a_1.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/a_1.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/a_1.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/a_1.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/a_1.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/a_1.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/a_1.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/a_1.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/a_1.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/a_1.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/a_1.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/a_1.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/a_1.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/a_1.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/a_1.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/a_1.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/a_1.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/a_1.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/a_1.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/a_1.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/a_1.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/a_1.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/a_1.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/a_1.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/a_1.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/a_1.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/a_1.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/a_1.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/a_1.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/a_1.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/a_1.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/a_1.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/a_1.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/a_1.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/a_1.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/a_1.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/a_1.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/a_1.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/a_1.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/a_1.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/a_1.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/a_1.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/a_1.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/a_1.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/a_1.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/a_1.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/a_1.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/a_1.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/a_1.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/a_1.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/a_1.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/a_1.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/a_1.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/a_1.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/a_1.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/a_1.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/a_1.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/a_1.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/a_1.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/a_1.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/a_1.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/a_1.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/a_1.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/a_1.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/a_1.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/a_1.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/a_1.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/a_1.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/a_1.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/a_1.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/a_1.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/a_1.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/a_1.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/a_1.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/a_1.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/a_1.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/a_1.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/a_1.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/a_1.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/a_1.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/a_1.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/a_1.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/a_1.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/a_1.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/a_1.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/a_1.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/a_1.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/a_1.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/a_1.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/a_1.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/a_1.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/a_1.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/a_1.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/a_1.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/a_1.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/a_1.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/a_1.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x a_1 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp a_2.inp /home/students/y12/iltarn/gamess-scratch/a_2.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/a_2.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/a_2.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/a_2.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/a_2.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/a_2.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/a_2.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/a_2.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/a_2.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/a_2.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/a_2.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/a_2.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/a_2.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/a_2.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/a_2.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/a_2.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/a_2.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/a_2.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/a_2.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/a_2.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/a_2.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/a_2.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/a_2.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/a_2.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/a_2.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/a_2.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/a_2.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/a_2.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/a_2.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/a_2.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/a_2.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/a_2.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/a_2.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/a_2.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/a_2.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/a_2.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/a_2.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/a_2.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/a_2.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/a_2.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/a_2.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/a_2.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/a_2.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/a_2.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/a_2.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/a_2.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/a_2.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/a_2.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/a_2.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/a_2.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/a_2.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/a_2.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/a_2.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/a_2.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/a_2.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/a_2.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/a_2.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/a_2.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/a_2.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/a_2.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/a_2.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/a_2.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/a_2.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/a_2.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/a_2.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/a_2.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/a_2.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/a_2.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/a_2.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/a_2.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/a_2.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/a_2.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/a_2.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/a_2.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/a_2.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/a_2.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/a_2.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/a_2.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/a_2.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/a_2.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/a_2.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/a_2.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/a_2.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/a_2.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/a_2.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/a_2.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/a_2.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/a_2.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/a_2.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/a_2.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/a_2.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/a_2.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/a_2.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/a_2.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/a_2.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/a_2.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/a_2.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/a_2.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/a_2.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/a_2.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/a_2.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/a_2.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/a_2.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/a_2.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/a_2.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/a_2.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/a_2.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/a_2.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/a_2.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/a_2.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/a_2.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x a_2 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp a_3.inp /home/students/y12/iltarn/gamess-scratch/a_3.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/a_3.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/a_3.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/a_3.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/a_3.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/a_3.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/a_3.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/a_3.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/a_3.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/a_3.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/a_3.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/a_3.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/a_3.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/a_3.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/a_3.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/a_3.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/a_3.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/a_3.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/a_3.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/a_3.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/a_3.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/a_3.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/a_3.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/a_3.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/a_3.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/a_3.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/a_3.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/a_3.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/a_3.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/a_3.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/a_3.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/a_3.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/a_3.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/a_3.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/a_3.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/a_3.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/a_3.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/a_3.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/a_3.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/a_3.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/a_3.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/a_3.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/a_3.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/a_3.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/a_3.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/a_3.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/a_3.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/a_3.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/a_3.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/a_3.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/a_3.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/a_3.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/a_3.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/a_3.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/a_3.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/a_3.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/a_3.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/a_3.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/a_3.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/a_3.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/a_3.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/a_3.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/a_3.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/a_3.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/a_3.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/a_3.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/a_3.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/a_3.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/a_3.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/a_3.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/a_3.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/a_3.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/a_3.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/a_3.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/a_3.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/a_3.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/a_3.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/a_3.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/a_3.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/a_3.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/a_3.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/a_3.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/a_3.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/a_3.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/a_3.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/a_3.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/a_3.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/a_3.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/a_3.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/a_3.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/a_3.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/a_3.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/a_3.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/a_3.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/a_3.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/a_3.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/a_3.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/a_3.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/a_3.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/a_3.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/a_3.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/a_3.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/a_3.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/a_3.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/a_3.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/a_3.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/a_3.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/a_3.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/a_3.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/a_3.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/a_3.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x a_3 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp a_4.inp /home/students/y12/iltarn/gamess-scratch/a_4.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/a_4.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/a_4.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/a_4.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/a_4.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/a_4.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/a_4.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/a_4.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/a_4.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/a_4.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/a_4.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/a_4.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/a_4.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/a_4.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/a_4.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/a_4.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/a_4.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/a_4.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/a_4.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/a_4.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/a_4.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/a_4.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/a_4.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/a_4.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/a_4.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/a_4.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/a_4.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/a_4.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/a_4.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/a_4.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/a_4.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/a_4.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/a_4.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/a_4.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/a_4.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/a_4.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/a_4.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/a_4.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/a_4.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/a_4.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/a_4.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/a_4.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/a_4.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/a_4.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/a_4.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/a_4.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/a_4.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/a_4.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/a_4.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/a_4.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/a_4.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/a_4.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/a_4.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/a_4.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/a_4.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/a_4.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/a_4.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/a_4.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/a_4.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/a_4.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/a_4.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/a_4.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/a_4.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/a_4.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/a_4.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/a_4.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/a_4.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/a_4.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/a_4.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/a_4.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/a_4.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/a_4.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/a_4.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/a_4.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/a_4.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/a_4.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/a_4.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/a_4.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/a_4.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/a_4.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/a_4.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/a_4.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/a_4.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/a_4.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/a_4.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/a_4.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/a_4.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/a_4.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/a_4.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/a_4.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/a_4.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/a_4.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/a_4.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/a_4.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/a_4.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/a_4.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/a_4.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/a_4.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/a_4.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/a_4.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/a_4.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/a_4.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/a_4.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/a_4.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/a_4.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/a_4.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/a_4.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/a_4.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/a_4.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/a_4.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/a_4.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x a_4 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp a_5.inp /home/students/y12/iltarn/gamess-scratch/a_5.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/a_5.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/a_5.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/a_5.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/a_5.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/a_5.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/a_5.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/a_5.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/a_5.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/a_5.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/a_5.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/a_5.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/a_5.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/a_5.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/a_5.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/a_5.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/a_5.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/a_5.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/a_5.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/a_5.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/a_5.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/a_5.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/a_5.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/a_5.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/a_5.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/a_5.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/a_5.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/a_5.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/a_5.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/a_5.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/a_5.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/a_5.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/a_5.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/a_5.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/a_5.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/a_5.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/a_5.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/a_5.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/a_5.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/a_5.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/a_5.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/a_5.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/a_5.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/a_5.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/a_5.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/a_5.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/a_5.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/a_5.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/a_5.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/a_5.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/a_5.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/a_5.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/a_5.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/a_5.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/a_5.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/a_5.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/a_5.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/a_5.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/a_5.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/a_5.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/a_5.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/a_5.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/a_5.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/a_5.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/a_5.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/a_5.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/a_5.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/a_5.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/a_5.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/a_5.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/a_5.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/a_5.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/a_5.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/a_5.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/a_5.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/a_5.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/a_5.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/a_5.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/a_5.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/a_5.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/a_5.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/a_5.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/a_5.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/a_5.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/a_5.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/a_5.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/a_5.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/a_5.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/a_5.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/a_5.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/a_5.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/a_5.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/a_5.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/a_5.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/a_5.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/a_5.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/a_5.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/a_5.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/a_5.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/a_5.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/a_5.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/a_5.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/a_5.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/a_5.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/a_5.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/a_5.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/a_5.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/a_5.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/a_5.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/a_5.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/a_5.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x a_5 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp a_6.inp /home/students/y12/iltarn/gamess-scratch/a_6.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/a_6.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/a_6.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/a_6.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/a_6.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/a_6.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/a_6.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/a_6.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/a_6.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/a_6.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/a_6.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/a_6.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/a_6.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/a_6.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/a_6.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/a_6.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/a_6.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/a_6.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/a_6.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/a_6.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/a_6.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/a_6.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/a_6.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/a_6.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/a_6.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/a_6.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/a_6.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/a_6.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/a_6.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/a_6.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/a_6.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/a_6.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/a_6.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/a_6.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/a_6.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/a_6.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/a_6.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/a_6.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/a_6.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/a_6.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/a_6.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/a_6.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/a_6.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/a_6.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/a_6.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/a_6.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/a_6.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/a_6.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/a_6.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/a_6.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/a_6.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/a_6.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/a_6.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/a_6.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/a_6.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/a_6.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/a_6.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/a_6.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/a_6.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/a_6.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/a_6.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/a_6.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/a_6.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/a_6.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/a_6.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/a_6.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/a_6.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/a_6.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/a_6.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/a_6.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/a_6.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/a_6.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/a_6.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/a_6.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/a_6.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/a_6.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/a_6.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/a_6.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/a_6.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/a_6.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/a_6.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/a_6.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/a_6.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/a_6.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/a_6.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/a_6.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/a_6.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/a_6.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/a_6.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/a_6.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/a_6.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/a_6.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/a_6.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/a_6.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/a_6.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/a_6.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/a_6.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/a_6.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/a_6.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/a_6.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/a_6.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/a_6.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/a_6.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/a_6.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/a_6.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/a_6.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/a_6.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/a_6.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/a_6.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/a_6.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/a_6.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x a_6 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp a_7.inp /home/students/y12/iltarn/gamess-scratch/a_7.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/a_7.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/a_7.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/a_7.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/a_7.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/a_7.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/a_7.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/a_7.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/a_7.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/a_7.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/a_7.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/a_7.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/a_7.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/a_7.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/a_7.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/a_7.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/a_7.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/a_7.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/a_7.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/a_7.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/a_7.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/a_7.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/a_7.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/a_7.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/a_7.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/a_7.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/a_7.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/a_7.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/a_7.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/a_7.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/a_7.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/a_7.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/a_7.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/a_7.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/a_7.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/a_7.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/a_7.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/a_7.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/a_7.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/a_7.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/a_7.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/a_7.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/a_7.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/a_7.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/a_7.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/a_7.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/a_7.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/a_7.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/a_7.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/a_7.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/a_7.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/a_7.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/a_7.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/a_7.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/a_7.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/a_7.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/a_7.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/a_7.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/a_7.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/a_7.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/a_7.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/a_7.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/a_7.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/a_7.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/a_7.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/a_7.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/a_7.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/a_7.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/a_7.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/a_7.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/a_7.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/a_7.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/a_7.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/a_7.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/a_7.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/a_7.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/a_7.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/a_7.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/a_7.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/a_7.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/a_7.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/a_7.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/a_7.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/a_7.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/a_7.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/a_7.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/a_7.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/a_7.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/a_7.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/a_7.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/a_7.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/a_7.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/a_7.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/a_7.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/a_7.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/a_7.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/a_7.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/a_7.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/a_7.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/a_7.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/a_7.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/a_7.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/a_7.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/a_7.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/a_7.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/a_7.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/a_7.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/a_7.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/a_7.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/a_7.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/a_7.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x a_7 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp a_8.inp /home/students/y12/iltarn/gamess-scratch/a_8.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/a_8.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/a_8.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/a_8.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/a_8.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/a_8.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/a_8.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/a_8.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/a_8.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/a_8.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/a_8.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/a_8.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/a_8.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/a_8.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/a_8.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/a_8.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/a_8.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/a_8.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/a_8.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/a_8.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/a_8.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/a_8.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/a_8.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/a_8.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/a_8.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/a_8.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/a_8.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/a_8.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/a_8.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/a_8.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/a_8.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/a_8.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/a_8.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/a_8.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/a_8.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/a_8.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/a_8.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/a_8.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/a_8.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/a_8.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/a_8.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/a_8.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/a_8.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/a_8.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/a_8.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/a_8.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/a_8.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/a_8.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/a_8.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/a_8.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/a_8.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/a_8.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/a_8.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/a_8.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/a_8.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/a_8.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/a_8.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/a_8.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/a_8.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/a_8.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/a_8.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/a_8.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/a_8.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/a_8.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/a_8.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/a_8.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/a_8.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/a_8.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/a_8.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/a_8.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/a_8.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/a_8.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/a_8.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/a_8.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/a_8.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/a_8.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/a_8.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/a_8.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/a_8.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/a_8.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/a_8.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/a_8.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/a_8.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/a_8.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/a_8.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/a_8.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/a_8.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/a_8.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/a_8.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/a_8.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/a_8.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/a_8.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/a_8.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/a_8.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/a_8.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/a_8.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/a_8.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/a_8.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/a_8.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/a_8.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/a_8.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/a_8.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/a_8.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/a_8.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/a_8.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/a_8.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/a_8.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/a_8.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/a_8.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/a_8.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/a_8.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x a_8 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp a_9.inp /home/students/y12/iltarn/gamess-scratch/a_9.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/a_9.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/a_9.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/a_9.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/a_9.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/a_9.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/a_9.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/a_9.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/a_9.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/a_9.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/a_9.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/a_9.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/a_9.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/a_9.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/a_9.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/a_9.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/a_9.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/a_9.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/a_9.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/a_9.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/a_9.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/a_9.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/a_9.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/a_9.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/a_9.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/a_9.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/a_9.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/a_9.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/a_9.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/a_9.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/a_9.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/a_9.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/a_9.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/a_9.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/a_9.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/a_9.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/a_9.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/a_9.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/a_9.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/a_9.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/a_9.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/a_9.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/a_9.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/a_9.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/a_9.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/a_9.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/a_9.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/a_9.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/a_9.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/a_9.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/a_9.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/a_9.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/a_9.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/a_9.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/a_9.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/a_9.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/a_9.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/a_9.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/a_9.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/a_9.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/a_9.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/a_9.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/a_9.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/a_9.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/a_9.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/a_9.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/a_9.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/a_9.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/a_9.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/a_9.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/a_9.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/a_9.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/a_9.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/a_9.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/a_9.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/a_9.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/a_9.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/a_9.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/a_9.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/a_9.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/a_9.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/a_9.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/a_9.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/a_9.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/a_9.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/a_9.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/a_9.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/a_9.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/a_9.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/a_9.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/a_9.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/a_9.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/a_9.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/a_9.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/a_9.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/a_9.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/a_9.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/a_9.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/a_9.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/a_9.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/a_9.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/a_9.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/a_9.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/a_9.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/a_9.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/a_9.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/a_9.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/a_9.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/a_9.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/a_9.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/a_9.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x a_9 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp a_10.inp /home/students/y12/iltarn/gamess-scratch/a_10.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/a_10.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/a_10.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/a_10.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/a_10.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/a_10.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/a_10.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/a_10.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/a_10.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/a_10.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/a_10.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/a_10.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/a_10.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/a_10.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/a_10.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/a_10.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/a_10.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/a_10.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/a_10.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/a_10.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/a_10.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/a_10.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/a_10.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/a_10.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/a_10.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/a_10.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/a_10.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/a_10.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/a_10.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/a_10.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/a_10.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/a_10.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/a_10.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/a_10.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/a_10.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/a_10.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/a_10.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/a_10.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/a_10.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/a_10.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/a_10.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/a_10.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/a_10.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/a_10.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/a_10.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/a_10.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/a_10.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/a_10.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/a_10.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/a_10.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/a_10.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/a_10.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/a_10.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/a_10.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/a_10.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/a_10.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/a_10.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/a_10.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/a_10.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/a_10.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/a_10.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/a_10.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/a_10.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/a_10.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/a_10.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/a_10.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/a_10.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/a_10.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/a_10.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/a_10.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/a_10.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/a_10.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/a_10.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/a_10.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/a_10.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/a_10.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/a_10.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/a_10.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/a_10.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/a_10.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/a_10.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/a_10.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/a_10.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/a_10.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/a_10.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/a_10.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/a_10.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/a_10.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/a_10.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/a_10.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/a_10.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/a_10.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/a_10.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/a_10.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/a_10.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/a_10.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/a_10.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/a_10.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/a_10.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/a_10.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/a_10.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/a_10.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/a_10.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/a_10.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/a_10.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/a_10.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/a_10.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/a_10.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/a_10.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/a_10.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/a_10.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x a_10 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo
In [59]:
a = np.loadtxt("/home/students/y12/iltarn/Term6/Practice4/hch")
x_o=a[:,0]
y_o=a[:,1]
print "Initial data:", y_o
#function is f(x)=k(b-x)^2 + a
fitfunc = lambda p, x: p[0]*pow(p[1]-x,2) + p[2] # Target function
errfunc = lambda p, x, y: fitfunc(p, x) - y # Error function
p0 = [1,1, -79] # Initial guess for the parameters
p1, success = optimize.leastsq(errfunc, p0[:], args=(x_o, y_o))
print "Optimized params:", p1
#Plot it
plt.plot(x_o, y_o, "ro", x_o,fitfunc(p1,x_o),"r-",c='blue',alpha=0.5)
plt.xlim(108,115)
plt.savefig('hch.png')
plt.show()
Initial data: [-79.76370844 -79.76388439 -79.76404291 -79.76418395 -79.76430746 -79.76441342 -79.76450176 -79.76457244 -79.76462542 -79.76466065 -79.76467808 -79.76467766 -79.76465935 -79.7646231 -79.76456887 -79.76449659 -79.76440623 -79.76429774 -79.76417106 -79.76402616 -79.76386298] Optimized params: [ 2.23091136e-04 1.11289603e+02 -7.97646799e+01]
In [60]:
Image(filename='hch.png')
Out[60]:
И для d3 (-180 - +180, шаг в 12)¶
In [63]:
%%bash
rm -rf ~/gamess-scratch/
cd
cd Term6
cd Practice4
for i in {-15..15}; do
nb=$(echo "scale=5; 0 + $i*12" | bc -l)
sed "s/d3=180/d3=$nb/" et.inp > t_${i}.inp
gms t_${i}.inp 1 > t_${i}.log
echo -n "$nb " >> d3
awk '/TOTAL ENERGY =/{print $4}' t_${i}.log >> d3
done
cp t_-15.inp /home/students/y12/iltarn/gamess-scratch/t_-15.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/t_-15.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/t_-15.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/t_-15.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/t_-15.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/t_-15.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/t_-15.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/t_-15.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/t_-15.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/t_-15.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/t_-15.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/t_-15.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/t_-15.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/t_-15.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/t_-15.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/t_-15.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/t_-15.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/t_-15.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/t_-15.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/t_-15.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/t_-15.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/t_-15.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/t_-15.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/t_-15.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/t_-15.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/t_-15.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/t_-15.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/t_-15.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/t_-15.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/t_-15.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/t_-15.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/t_-15.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/t_-15.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/t_-15.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/t_-15.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/t_-15.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/t_-15.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/t_-15.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/t_-15.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/t_-15.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/t_-15.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/t_-15.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/t_-15.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/t_-15.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/t_-15.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/t_-15.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/t_-15.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/t_-15.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/t_-15.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/t_-15.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/t_-15.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/t_-15.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/t_-15.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/t_-15.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/t_-15.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/t_-15.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/t_-15.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/t_-15.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/t_-15.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/t_-15.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/t_-15.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/t_-15.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/t_-15.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/t_-15.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/t_-15.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/t_-15.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/t_-15.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/t_-15.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/t_-15.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/t_-15.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/t_-15.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/t_-15.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/t_-15.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/t_-15.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/t_-15.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/t_-15.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/t_-15.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/t_-15.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/t_-15.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/t_-15.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/t_-15.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/t_-15.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/t_-15.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/t_-15.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/t_-15.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/t_-15.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/t_-15.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/t_-15.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/t_-15.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/t_-15.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/t_-15.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/t_-15.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/t_-15.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/t_-15.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/t_-15.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/t_-15.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/t_-15.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/t_-15.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/t_-15.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/t_-15.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/t_-15.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/t_-15.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/t_-15.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/t_-15.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/t_-15.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/t_-15.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/t_-15.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/t_-15.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/t_-15.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/t_-15.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/t_-15.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x t_-15 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp t_-14.inp /home/students/y12/iltarn/gamess-scratch/t_-14.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/t_-14.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/t_-14.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/t_-14.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/t_-14.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/t_-14.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/t_-14.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/t_-14.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/t_-14.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/t_-14.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/t_-14.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/t_-14.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/t_-14.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/t_-14.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/t_-14.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/t_-14.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/t_-14.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/t_-14.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/t_-14.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/t_-14.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/t_-14.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/t_-14.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/t_-14.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/t_-14.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/t_-14.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/t_-14.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/t_-14.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/t_-14.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/t_-14.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/t_-14.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/t_-14.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/t_-14.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/t_-14.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/t_-14.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/t_-14.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/t_-14.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/t_-14.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/t_-14.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/t_-14.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/t_-14.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/t_-14.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/t_-14.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/t_-14.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/t_-14.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/t_-14.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/t_-14.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/t_-14.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/t_-14.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/t_-14.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/t_-14.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/t_-14.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/t_-14.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/t_-14.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/t_-14.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/t_-14.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/t_-14.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/t_-14.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/t_-14.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/t_-14.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/t_-14.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/t_-14.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/t_-14.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/t_-14.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/t_-14.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/t_-14.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/t_-14.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/t_-14.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/t_-14.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/t_-14.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/t_-14.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/t_-14.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/t_-14.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/t_-14.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/t_-14.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/t_-14.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/t_-14.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/t_-14.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/t_-14.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/t_-14.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/t_-14.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/t_-14.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/t_-14.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/t_-14.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/t_-14.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/t_-14.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/t_-14.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/t_-14.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/t_-14.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/t_-14.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/t_-14.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/t_-14.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/t_-14.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/t_-14.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/t_-14.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/t_-14.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/t_-14.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/t_-14.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/t_-14.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/t_-14.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/t_-14.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/t_-14.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/t_-14.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/t_-14.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/t_-14.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/t_-14.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/t_-14.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/t_-14.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/t_-14.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/t_-14.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/t_-14.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/t_-14.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x t_-14 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp t_-13.inp /home/students/y12/iltarn/gamess-scratch/t_-13.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/t_-13.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/t_-13.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/t_-13.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/t_-13.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/t_-13.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/t_-13.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/t_-13.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/t_-13.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/t_-13.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/t_-13.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/t_-13.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/t_-13.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/t_-13.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/t_-13.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/t_-13.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/t_-13.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/t_-13.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/t_-13.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/t_-13.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/t_-13.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/t_-13.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/t_-13.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/t_-13.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/t_-13.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/t_-13.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/t_-13.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/t_-13.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/t_-13.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/t_-13.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/t_-13.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/t_-13.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/t_-13.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/t_-13.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/t_-13.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/t_-13.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/t_-13.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/t_-13.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/t_-13.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/t_-13.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/t_-13.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/t_-13.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/t_-13.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/t_-13.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/t_-13.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/t_-13.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/t_-13.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/t_-13.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/t_-13.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/t_-13.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/t_-13.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/t_-13.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/t_-13.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/t_-13.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/t_-13.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/t_-13.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/t_-13.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/t_-13.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/t_-13.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/t_-13.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/t_-13.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/t_-13.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/t_-13.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/t_-13.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/t_-13.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/t_-13.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/t_-13.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/t_-13.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/t_-13.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/t_-13.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/t_-13.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/t_-13.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/t_-13.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/t_-13.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/t_-13.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/t_-13.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/t_-13.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/t_-13.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/t_-13.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/t_-13.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/t_-13.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/t_-13.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/t_-13.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/t_-13.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/t_-13.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/t_-13.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/t_-13.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/t_-13.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/t_-13.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/t_-13.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/t_-13.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/t_-13.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/t_-13.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/t_-13.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/t_-13.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/t_-13.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/t_-13.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/t_-13.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/t_-13.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/t_-13.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/t_-13.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/t_-13.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/t_-13.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/t_-13.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/t_-13.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/t_-13.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/t_-13.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/t_-13.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/t_-13.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/t_-13.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/t_-13.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x t_-13 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp t_-12.inp /home/students/y12/iltarn/gamess-scratch/t_-12.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/t_-12.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/t_-12.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/t_-12.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/t_-12.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/t_-12.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/t_-12.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/t_-12.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/t_-12.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/t_-12.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/t_-12.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/t_-12.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/t_-12.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/t_-12.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/t_-12.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/t_-12.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/t_-12.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/t_-12.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/t_-12.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/t_-12.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/t_-12.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/t_-12.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/t_-12.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/t_-12.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/t_-12.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/t_-12.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/t_-12.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/t_-12.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/t_-12.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/t_-12.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/t_-12.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/t_-12.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/t_-12.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/t_-12.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/t_-12.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/t_-12.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/t_-12.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/t_-12.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/t_-12.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/t_-12.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/t_-12.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/t_-12.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/t_-12.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/t_-12.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/t_-12.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/t_-12.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/t_-12.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/t_-12.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/t_-12.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/t_-12.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/t_-12.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/t_-12.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/t_-12.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/t_-12.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/t_-12.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/t_-12.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/t_-12.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/t_-12.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/t_-12.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/t_-12.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/t_-12.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/t_-12.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/t_-12.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/t_-12.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/t_-12.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/t_-12.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/t_-12.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/t_-12.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/t_-12.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/t_-12.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/t_-12.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/t_-12.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/t_-12.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/t_-12.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/t_-12.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/t_-12.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/t_-12.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/t_-12.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/t_-12.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/t_-12.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/t_-12.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/t_-12.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/t_-12.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/t_-12.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/t_-12.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/t_-12.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/t_-12.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/t_-12.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/t_-12.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/t_-12.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/t_-12.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/t_-12.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/t_-12.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/t_-12.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/t_-12.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/t_-12.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/t_-12.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/t_-12.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/t_-12.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/t_-12.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/t_-12.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/t_-12.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/t_-12.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/t_-12.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/t_-12.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/t_-12.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/t_-12.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/t_-12.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/t_-12.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/t_-12.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/t_-12.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x t_-12 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp t_-11.inp /home/students/y12/iltarn/gamess-scratch/t_-11.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/t_-11.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/t_-11.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/t_-11.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/t_-11.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/t_-11.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/t_-11.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/t_-11.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/t_-11.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/t_-11.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/t_-11.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/t_-11.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/t_-11.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/t_-11.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/t_-11.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/t_-11.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/t_-11.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/t_-11.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/t_-11.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/t_-11.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/t_-11.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/t_-11.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/t_-11.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/t_-11.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/t_-11.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/t_-11.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/t_-11.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/t_-11.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/t_-11.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/t_-11.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/t_-11.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/t_-11.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/t_-11.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/t_-11.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/t_-11.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/t_-11.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/t_-11.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/t_-11.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/t_-11.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/t_-11.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/t_-11.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/t_-11.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/t_-11.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/t_-11.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/t_-11.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/t_-11.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/t_-11.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/t_-11.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/t_-11.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/t_-11.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/t_-11.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/t_-11.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/t_-11.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/t_-11.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/t_-11.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/t_-11.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/t_-11.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/t_-11.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/t_-11.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/t_-11.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/t_-11.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/t_-11.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/t_-11.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/t_-11.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/t_-11.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/t_-11.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/t_-11.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/t_-11.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/t_-11.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/t_-11.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/t_-11.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/t_-11.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/t_-11.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/t_-11.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/t_-11.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/t_-11.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/t_-11.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/t_-11.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/t_-11.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/t_-11.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/t_-11.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/t_-11.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/t_-11.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/t_-11.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/t_-11.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/t_-11.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/t_-11.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/t_-11.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/t_-11.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/t_-11.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/t_-11.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/t_-11.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/t_-11.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/t_-11.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/t_-11.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/t_-11.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/t_-11.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/t_-11.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/t_-11.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/t_-11.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/t_-11.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/t_-11.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/t_-11.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/t_-11.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/t_-11.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/t_-11.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/t_-11.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/t_-11.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/t_-11.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/t_-11.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/t_-11.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x t_-11 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp t_-10.inp /home/students/y12/iltarn/gamess-scratch/t_-10.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/t_-10.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/t_-10.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/t_-10.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/t_-10.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/t_-10.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/t_-10.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/t_-10.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/t_-10.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/t_-10.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/t_-10.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/t_-10.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/t_-10.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/t_-10.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/t_-10.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/t_-10.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/t_-10.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/t_-10.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/t_-10.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/t_-10.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/t_-10.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/t_-10.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/t_-10.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/t_-10.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/t_-10.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/t_-10.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/t_-10.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/t_-10.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/t_-10.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/t_-10.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/t_-10.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/t_-10.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/t_-10.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/t_-10.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/t_-10.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/t_-10.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/t_-10.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/t_-10.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/t_-10.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/t_-10.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/t_-10.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/t_-10.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/t_-10.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/t_-10.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/t_-10.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/t_-10.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/t_-10.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/t_-10.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/t_-10.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/t_-10.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/t_-10.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/t_-10.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/t_-10.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/t_-10.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/t_-10.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/t_-10.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/t_-10.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/t_-10.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/t_-10.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/t_-10.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/t_-10.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/t_-10.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/t_-10.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/t_-10.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/t_-10.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/t_-10.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/t_-10.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/t_-10.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/t_-10.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/t_-10.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/t_-10.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/t_-10.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/t_-10.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/t_-10.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/t_-10.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/t_-10.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/t_-10.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/t_-10.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/t_-10.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/t_-10.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/t_-10.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/t_-10.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/t_-10.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/t_-10.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/t_-10.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/t_-10.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/t_-10.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/t_-10.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/t_-10.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/t_-10.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/t_-10.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/t_-10.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/t_-10.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/t_-10.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/t_-10.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/t_-10.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/t_-10.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/t_-10.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/t_-10.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/t_-10.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/t_-10.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/t_-10.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/t_-10.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/t_-10.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/t_-10.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/t_-10.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/t_-10.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/t_-10.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/t_-10.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/t_-10.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/t_-10.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x t_-10 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp t_-9.inp /home/students/y12/iltarn/gamess-scratch/t_-9.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/t_-9.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/t_-9.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/t_-9.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/t_-9.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/t_-9.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/t_-9.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/t_-9.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/t_-9.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/t_-9.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/t_-9.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/t_-9.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/t_-9.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/t_-9.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/t_-9.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/t_-9.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/t_-9.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/t_-9.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/t_-9.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/t_-9.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/t_-9.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/t_-9.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/t_-9.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/t_-9.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/t_-9.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/t_-9.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/t_-9.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/t_-9.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/t_-9.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/t_-9.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/t_-9.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/t_-9.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/t_-9.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/t_-9.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/t_-9.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/t_-9.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/t_-9.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/t_-9.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/t_-9.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/t_-9.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/t_-9.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/t_-9.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/t_-9.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/t_-9.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/t_-9.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/t_-9.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/t_-9.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/t_-9.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/t_-9.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/t_-9.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/t_-9.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/t_-9.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/t_-9.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/t_-9.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/t_-9.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/t_-9.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/t_-9.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/t_-9.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/t_-9.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/t_-9.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/t_-9.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/t_-9.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/t_-9.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/t_-9.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/t_-9.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/t_-9.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/t_-9.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/t_-9.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/t_-9.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/t_-9.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/t_-9.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/t_-9.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/t_-9.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/t_-9.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/t_-9.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/t_-9.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/t_-9.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/t_-9.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/t_-9.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/t_-9.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/t_-9.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/t_-9.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/t_-9.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/t_-9.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/t_-9.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/t_-9.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/t_-9.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/t_-9.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/t_-9.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/t_-9.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/t_-9.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/t_-9.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/t_-9.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/t_-9.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/t_-9.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/t_-9.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/t_-9.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/t_-9.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/t_-9.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/t_-9.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/t_-9.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/t_-9.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/t_-9.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/t_-9.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/t_-9.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/t_-9.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/t_-9.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/t_-9.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/t_-9.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/t_-9.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/t_-9.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x t_-9 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp t_-8.inp /home/students/y12/iltarn/gamess-scratch/t_-8.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/t_-8.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/t_-8.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/t_-8.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/t_-8.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/t_-8.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/t_-8.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/t_-8.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/t_-8.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/t_-8.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/t_-8.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/t_-8.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/t_-8.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/t_-8.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/t_-8.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/t_-8.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/t_-8.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/t_-8.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/t_-8.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/t_-8.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/t_-8.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/t_-8.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/t_-8.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/t_-8.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/t_-8.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/t_-8.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/t_-8.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/t_-8.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/t_-8.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/t_-8.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/t_-8.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/t_-8.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/t_-8.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/t_-8.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/t_-8.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/t_-8.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/t_-8.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/t_-8.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/t_-8.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/t_-8.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/t_-8.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/t_-8.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/t_-8.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/t_-8.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/t_-8.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/t_-8.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/t_-8.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/t_-8.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/t_-8.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/t_-8.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/t_-8.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/t_-8.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/t_-8.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/t_-8.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/t_-8.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/t_-8.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/t_-8.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/t_-8.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/t_-8.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/t_-8.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/t_-8.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/t_-8.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/t_-8.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/t_-8.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/t_-8.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/t_-8.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/t_-8.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/t_-8.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/t_-8.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/t_-8.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/t_-8.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/t_-8.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/t_-8.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/t_-8.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/t_-8.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/t_-8.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/t_-8.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/t_-8.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/t_-8.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/t_-8.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/t_-8.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/t_-8.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/t_-8.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/t_-8.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/t_-8.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/t_-8.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/t_-8.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/t_-8.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/t_-8.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/t_-8.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/t_-8.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/t_-8.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/t_-8.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/t_-8.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/t_-8.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/t_-8.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/t_-8.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/t_-8.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/t_-8.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/t_-8.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/t_-8.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/t_-8.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/t_-8.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/t_-8.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/t_-8.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/t_-8.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/t_-8.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/t_-8.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/t_-8.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/t_-8.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/t_-8.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x t_-8 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp t_-7.inp /home/students/y12/iltarn/gamess-scratch/t_-7.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/t_-7.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/t_-7.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/t_-7.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/t_-7.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/t_-7.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/t_-7.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/t_-7.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/t_-7.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/t_-7.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/t_-7.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/t_-7.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/t_-7.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/t_-7.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/t_-7.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/t_-7.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/t_-7.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/t_-7.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/t_-7.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/t_-7.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/t_-7.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/t_-7.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/t_-7.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/t_-7.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/t_-7.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/t_-7.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/t_-7.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/t_-7.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/t_-7.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/t_-7.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/t_-7.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/t_-7.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/t_-7.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/t_-7.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/t_-7.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/t_-7.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/t_-7.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/t_-7.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/t_-7.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/t_-7.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/t_-7.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/t_-7.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/t_-7.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/t_-7.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/t_-7.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/t_-7.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/t_-7.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/t_-7.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/t_-7.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/t_-7.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/t_-7.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/t_-7.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/t_-7.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/t_-7.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/t_-7.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/t_-7.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/t_-7.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/t_-7.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/t_-7.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/t_-7.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/t_-7.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/t_-7.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/t_-7.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/t_-7.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/t_-7.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/t_-7.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/t_-7.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/t_-7.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/t_-7.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/t_-7.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/t_-7.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/t_-7.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/t_-7.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/t_-7.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/t_-7.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/t_-7.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/t_-7.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/t_-7.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/t_-7.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/t_-7.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/t_-7.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/t_-7.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/t_-7.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/t_-7.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/t_-7.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/t_-7.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/t_-7.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/t_-7.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/t_-7.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/t_-7.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/t_-7.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/t_-7.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/t_-7.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/t_-7.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/t_-7.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/t_-7.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/t_-7.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/t_-7.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/t_-7.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/t_-7.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/t_-7.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/t_-7.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/t_-7.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/t_-7.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/t_-7.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/t_-7.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/t_-7.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/t_-7.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/t_-7.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/t_-7.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/t_-7.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x t_-7 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp t_-6.inp /home/students/y12/iltarn/gamess-scratch/t_-6.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/t_-6.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/t_-6.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/t_-6.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/t_-6.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/t_-6.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/t_-6.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/t_-6.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/t_-6.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/t_-6.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/t_-6.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/t_-6.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/t_-6.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/t_-6.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/t_-6.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/t_-6.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/t_-6.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/t_-6.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/t_-6.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/t_-6.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/t_-6.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/t_-6.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/t_-6.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/t_-6.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/t_-6.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/t_-6.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/t_-6.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/t_-6.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/t_-6.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/t_-6.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/t_-6.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/t_-6.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/t_-6.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/t_-6.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/t_-6.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/t_-6.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/t_-6.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/t_-6.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/t_-6.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/t_-6.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/t_-6.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/t_-6.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/t_-6.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/t_-6.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/t_-6.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/t_-6.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/t_-6.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/t_-6.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/t_-6.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/t_-6.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/t_-6.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/t_-6.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/t_-6.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/t_-6.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/t_-6.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/t_-6.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/t_-6.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/t_-6.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/t_-6.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/t_-6.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/t_-6.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/t_-6.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/t_-6.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/t_-6.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/t_-6.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/t_-6.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/t_-6.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/t_-6.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/t_-6.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/t_-6.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/t_-6.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/t_-6.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/t_-6.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/t_-6.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/t_-6.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/t_-6.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/t_-6.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/t_-6.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/t_-6.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/t_-6.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/t_-6.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/t_-6.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/t_-6.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/t_-6.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/t_-6.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/t_-6.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/t_-6.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/t_-6.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/t_-6.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/t_-6.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/t_-6.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/t_-6.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/t_-6.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/t_-6.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/t_-6.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/t_-6.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/t_-6.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/t_-6.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/t_-6.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/t_-6.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/t_-6.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/t_-6.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/t_-6.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/t_-6.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/t_-6.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/t_-6.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/t_-6.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/t_-6.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/t_-6.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/t_-6.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/t_-6.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x t_-6 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp t_-5.inp /home/students/y12/iltarn/gamess-scratch/t_-5.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/t_-5.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/t_-5.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/t_-5.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/t_-5.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/t_-5.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/t_-5.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/t_-5.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/t_-5.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/t_-5.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/t_-5.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/t_-5.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/t_-5.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/t_-5.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/t_-5.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/t_-5.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/t_-5.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/t_-5.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/t_-5.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/t_-5.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/t_-5.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/t_-5.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/t_-5.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/t_-5.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/t_-5.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/t_-5.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/t_-5.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/t_-5.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/t_-5.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/t_-5.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/t_-5.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/t_-5.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/t_-5.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/t_-5.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/t_-5.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/t_-5.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/t_-5.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/t_-5.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/t_-5.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/t_-5.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/t_-5.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/t_-5.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/t_-5.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/t_-5.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/t_-5.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/t_-5.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/t_-5.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/t_-5.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/t_-5.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/t_-5.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/t_-5.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/t_-5.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/t_-5.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/t_-5.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/t_-5.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/t_-5.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/t_-5.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/t_-5.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/t_-5.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/t_-5.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/t_-5.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/t_-5.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/t_-5.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/t_-5.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/t_-5.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/t_-5.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/t_-5.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/t_-5.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/t_-5.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/t_-5.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/t_-5.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/t_-5.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/t_-5.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/t_-5.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/t_-5.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/t_-5.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/t_-5.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/t_-5.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/t_-5.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/t_-5.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/t_-5.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/t_-5.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/t_-5.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/t_-5.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/t_-5.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/t_-5.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/t_-5.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/t_-5.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/t_-5.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/t_-5.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/t_-5.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/t_-5.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/t_-5.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/t_-5.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/t_-5.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/t_-5.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/t_-5.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/t_-5.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/t_-5.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/t_-5.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/t_-5.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/t_-5.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/t_-5.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/t_-5.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/t_-5.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/t_-5.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/t_-5.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/t_-5.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/t_-5.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/t_-5.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/t_-5.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x t_-5 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp t_-4.inp /home/students/y12/iltarn/gamess-scratch/t_-4.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/t_-4.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/t_-4.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/t_-4.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/t_-4.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/t_-4.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/t_-4.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/t_-4.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/t_-4.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/t_-4.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/t_-4.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/t_-4.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/t_-4.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/t_-4.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/t_-4.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/t_-4.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/t_-4.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/t_-4.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/t_-4.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/t_-4.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/t_-4.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/t_-4.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/t_-4.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/t_-4.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/t_-4.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/t_-4.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/t_-4.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/t_-4.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/t_-4.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/t_-4.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/t_-4.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/t_-4.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/t_-4.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/t_-4.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/t_-4.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/t_-4.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/t_-4.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/t_-4.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/t_-4.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/t_-4.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/t_-4.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/t_-4.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/t_-4.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/t_-4.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/t_-4.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/t_-4.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/t_-4.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/t_-4.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/t_-4.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/t_-4.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/t_-4.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/t_-4.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/t_-4.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/t_-4.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/t_-4.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/t_-4.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/t_-4.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/t_-4.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/t_-4.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/t_-4.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/t_-4.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/t_-4.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/t_-4.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/t_-4.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/t_-4.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/t_-4.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/t_-4.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/t_-4.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/t_-4.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/t_-4.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/t_-4.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/t_-4.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/t_-4.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/t_-4.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/t_-4.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/t_-4.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/t_-4.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/t_-4.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/t_-4.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/t_-4.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/t_-4.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/t_-4.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/t_-4.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/t_-4.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/t_-4.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/t_-4.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/t_-4.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/t_-4.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/t_-4.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/t_-4.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/t_-4.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/t_-4.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/t_-4.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/t_-4.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/t_-4.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/t_-4.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/t_-4.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/t_-4.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/t_-4.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/t_-4.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/t_-4.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/t_-4.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/t_-4.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/t_-4.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/t_-4.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/t_-4.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/t_-4.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/t_-4.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/t_-4.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/t_-4.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/t_-4.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x t_-4 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp t_-3.inp /home/students/y12/iltarn/gamess-scratch/t_-3.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/t_-3.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/t_-3.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/t_-3.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/t_-3.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/t_-3.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/t_-3.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/t_-3.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/t_-3.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/t_-3.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/t_-3.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/t_-3.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/t_-3.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/t_-3.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/t_-3.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/t_-3.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/t_-3.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/t_-3.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/t_-3.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/t_-3.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/t_-3.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/t_-3.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/t_-3.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/t_-3.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/t_-3.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/t_-3.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/t_-3.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/t_-3.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/t_-3.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/t_-3.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/t_-3.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/t_-3.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/t_-3.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/t_-3.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/t_-3.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/t_-3.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/t_-3.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/t_-3.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/t_-3.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/t_-3.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/t_-3.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/t_-3.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/t_-3.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/t_-3.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/t_-3.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/t_-3.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/t_-3.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/t_-3.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/t_-3.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/t_-3.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/t_-3.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/t_-3.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/t_-3.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/t_-3.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/t_-3.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/t_-3.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/t_-3.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/t_-3.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/t_-3.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/t_-3.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/t_-3.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/t_-3.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/t_-3.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/t_-3.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/t_-3.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/t_-3.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/t_-3.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/t_-3.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/t_-3.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/t_-3.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/t_-3.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/t_-3.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/t_-3.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/t_-3.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/t_-3.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/t_-3.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/t_-3.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/t_-3.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/t_-3.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/t_-3.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/t_-3.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/t_-3.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/t_-3.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/t_-3.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/t_-3.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/t_-3.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/t_-3.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/t_-3.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/t_-3.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/t_-3.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/t_-3.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/t_-3.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/t_-3.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/t_-3.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/t_-3.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/t_-3.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/t_-3.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/t_-3.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/t_-3.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/t_-3.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/t_-3.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/t_-3.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/t_-3.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/t_-3.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/t_-3.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/t_-3.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/t_-3.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/t_-3.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/t_-3.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/t_-3.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/t_-3.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x t_-3 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp t_-2.inp /home/students/y12/iltarn/gamess-scratch/t_-2.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/t_-2.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/t_-2.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/t_-2.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/t_-2.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/t_-2.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/t_-2.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/t_-2.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/t_-2.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/t_-2.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/t_-2.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/t_-2.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/t_-2.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/t_-2.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/t_-2.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/t_-2.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/t_-2.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/t_-2.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/t_-2.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/t_-2.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/t_-2.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/t_-2.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/t_-2.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/t_-2.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/t_-2.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/t_-2.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/t_-2.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/t_-2.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/t_-2.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/t_-2.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/t_-2.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/t_-2.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/t_-2.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/t_-2.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/t_-2.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/t_-2.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/t_-2.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/t_-2.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/t_-2.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/t_-2.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/t_-2.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/t_-2.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/t_-2.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/t_-2.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/t_-2.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/t_-2.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/t_-2.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/t_-2.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/t_-2.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/t_-2.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/t_-2.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/t_-2.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/t_-2.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/t_-2.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/t_-2.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/t_-2.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/t_-2.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/t_-2.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/t_-2.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/t_-2.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/t_-2.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/t_-2.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/t_-2.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/t_-2.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/t_-2.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/t_-2.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/t_-2.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/t_-2.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/t_-2.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/t_-2.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/t_-2.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/t_-2.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/t_-2.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/t_-2.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/t_-2.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/t_-2.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/t_-2.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/t_-2.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/t_-2.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/t_-2.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/t_-2.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/t_-2.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/t_-2.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/t_-2.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/t_-2.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/t_-2.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/t_-2.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/t_-2.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/t_-2.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/t_-2.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/t_-2.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/t_-2.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/t_-2.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/t_-2.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/t_-2.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/t_-2.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/t_-2.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/t_-2.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/t_-2.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/t_-2.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/t_-2.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/t_-2.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/t_-2.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/t_-2.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/t_-2.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/t_-2.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/t_-2.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/t_-2.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/t_-2.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/t_-2.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/t_-2.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x t_-2 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp t_-1.inp /home/students/y12/iltarn/gamess-scratch/t_-1.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/t_-1.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/t_-1.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/t_-1.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/t_-1.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/t_-1.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/t_-1.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/t_-1.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/t_-1.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/t_-1.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/t_-1.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/t_-1.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/t_-1.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/t_-1.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/t_-1.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/t_-1.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/t_-1.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/t_-1.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/t_-1.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/t_-1.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/t_-1.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/t_-1.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/t_-1.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/t_-1.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/t_-1.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/t_-1.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/t_-1.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/t_-1.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/t_-1.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/t_-1.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/t_-1.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/t_-1.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/t_-1.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/t_-1.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/t_-1.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/t_-1.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/t_-1.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/t_-1.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/t_-1.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/t_-1.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/t_-1.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/t_-1.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/t_-1.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/t_-1.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/t_-1.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/t_-1.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/t_-1.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/t_-1.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/t_-1.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/t_-1.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/t_-1.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/t_-1.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/t_-1.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/t_-1.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/t_-1.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/t_-1.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/t_-1.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/t_-1.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/t_-1.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/t_-1.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/t_-1.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/t_-1.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/t_-1.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/t_-1.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/t_-1.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/t_-1.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/t_-1.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/t_-1.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/t_-1.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/t_-1.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/t_-1.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/t_-1.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/t_-1.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/t_-1.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/t_-1.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/t_-1.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/t_-1.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/t_-1.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/t_-1.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/t_-1.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/t_-1.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/t_-1.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/t_-1.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/t_-1.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/t_-1.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/t_-1.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/t_-1.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/t_-1.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/t_-1.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/t_-1.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/t_-1.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/t_-1.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/t_-1.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/t_-1.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/t_-1.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/t_-1.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/t_-1.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/t_-1.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/t_-1.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/t_-1.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/t_-1.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/t_-1.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/t_-1.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/t_-1.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/t_-1.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/t_-1.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/t_-1.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/t_-1.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/t_-1.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/t_-1.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/t_-1.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x t_-1 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp t_0.inp /home/students/y12/iltarn/gamess-scratch/t_0.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/t_0.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/t_0.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/t_0.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/t_0.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/t_0.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/t_0.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/t_0.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/t_0.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/t_0.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/t_0.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/t_0.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/t_0.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/t_0.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/t_0.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/t_0.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/t_0.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/t_0.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/t_0.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/t_0.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/t_0.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/t_0.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/t_0.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/t_0.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/t_0.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/t_0.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/t_0.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/t_0.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/t_0.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/t_0.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/t_0.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/t_0.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/t_0.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/t_0.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/t_0.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/t_0.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/t_0.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/t_0.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/t_0.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/t_0.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/t_0.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/t_0.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/t_0.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/t_0.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/t_0.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/t_0.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/t_0.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/t_0.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/t_0.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/t_0.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/t_0.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/t_0.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/t_0.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/t_0.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/t_0.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/t_0.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/t_0.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/t_0.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/t_0.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/t_0.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/t_0.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/t_0.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/t_0.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/t_0.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/t_0.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/t_0.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/t_0.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/t_0.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/t_0.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/t_0.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/t_0.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/t_0.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/t_0.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/t_0.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/t_0.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/t_0.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/t_0.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/t_0.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/t_0.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/t_0.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/t_0.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/t_0.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/t_0.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/t_0.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/t_0.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/t_0.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/t_0.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/t_0.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/t_0.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/t_0.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/t_0.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/t_0.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/t_0.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/t_0.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/t_0.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/t_0.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/t_0.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/t_0.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/t_0.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/t_0.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/t_0.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/t_0.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/t_0.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/t_0.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/t_0.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/t_0.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/t_0.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/t_0.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/t_0.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/t_0.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/t_0.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x t_0 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp t_1.inp /home/students/y12/iltarn/gamess-scratch/t_1.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/t_1.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/t_1.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/t_1.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/t_1.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/t_1.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/t_1.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/t_1.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/t_1.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/t_1.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/t_1.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/t_1.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/t_1.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/t_1.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/t_1.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/t_1.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/t_1.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/t_1.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/t_1.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/t_1.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/t_1.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/t_1.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/t_1.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/t_1.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/t_1.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/t_1.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/t_1.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/t_1.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/t_1.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/t_1.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/t_1.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/t_1.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/t_1.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/t_1.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/t_1.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/t_1.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/t_1.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/t_1.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/t_1.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/t_1.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/t_1.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/t_1.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/t_1.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/t_1.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/t_1.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/t_1.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/t_1.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/t_1.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/t_1.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/t_1.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/t_1.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/t_1.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/t_1.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/t_1.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/t_1.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/t_1.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/t_1.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/t_1.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/t_1.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/t_1.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/t_1.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/t_1.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/t_1.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/t_1.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/t_1.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/t_1.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/t_1.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/t_1.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/t_1.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/t_1.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/t_1.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/t_1.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/t_1.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/t_1.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/t_1.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/t_1.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/t_1.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/t_1.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/t_1.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/t_1.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/t_1.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/t_1.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/t_1.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/t_1.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/t_1.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/t_1.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/t_1.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/t_1.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/t_1.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/t_1.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/t_1.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/t_1.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/t_1.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/t_1.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/t_1.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/t_1.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/t_1.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/t_1.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/t_1.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/t_1.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/t_1.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/t_1.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/t_1.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/t_1.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/t_1.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/t_1.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/t_1.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/t_1.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/t_1.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/t_1.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/t_1.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x t_1 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp t_2.inp /home/students/y12/iltarn/gamess-scratch/t_2.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/t_2.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/t_2.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/t_2.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/t_2.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/t_2.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/t_2.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/t_2.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/t_2.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/t_2.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/t_2.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/t_2.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/t_2.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/t_2.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/t_2.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/t_2.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/t_2.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/t_2.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/t_2.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/t_2.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/t_2.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/t_2.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/t_2.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/t_2.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/t_2.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/t_2.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/t_2.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/t_2.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/t_2.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/t_2.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/t_2.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/t_2.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/t_2.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/t_2.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/t_2.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/t_2.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/t_2.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/t_2.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/t_2.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/t_2.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/t_2.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/t_2.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/t_2.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/t_2.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/t_2.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/t_2.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/t_2.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/t_2.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/t_2.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/t_2.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/t_2.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/t_2.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/t_2.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/t_2.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/t_2.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/t_2.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/t_2.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/t_2.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/t_2.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/t_2.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/t_2.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/t_2.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/t_2.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/t_2.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/t_2.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/t_2.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/t_2.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/t_2.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/t_2.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/t_2.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/t_2.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/t_2.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/t_2.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/t_2.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/t_2.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/t_2.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/t_2.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/t_2.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/t_2.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/t_2.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/t_2.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/t_2.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/t_2.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/t_2.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/t_2.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/t_2.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/t_2.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/t_2.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/t_2.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/t_2.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/t_2.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/t_2.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/t_2.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/t_2.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/t_2.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/t_2.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/t_2.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/t_2.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/t_2.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/t_2.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/t_2.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/t_2.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/t_2.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/t_2.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/t_2.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/t_2.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/t_2.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/t_2.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/t_2.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/t_2.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/t_2.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x t_2 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp t_3.inp /home/students/y12/iltarn/gamess-scratch/t_3.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/t_3.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/t_3.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/t_3.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/t_3.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/t_3.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/t_3.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/t_3.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/t_3.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/t_3.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/t_3.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/t_3.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/t_3.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/t_3.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/t_3.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/t_3.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/t_3.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/t_3.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/t_3.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/t_3.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/t_3.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/t_3.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/t_3.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/t_3.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/t_3.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/t_3.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/t_3.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/t_3.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/t_3.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/t_3.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/t_3.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/t_3.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/t_3.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/t_3.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/t_3.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/t_3.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/t_3.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/t_3.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/t_3.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/t_3.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/t_3.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/t_3.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/t_3.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/t_3.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/t_3.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/t_3.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/t_3.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/t_3.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/t_3.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/t_3.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/t_3.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/t_3.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/t_3.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/t_3.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/t_3.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/t_3.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/t_3.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/t_3.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/t_3.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/t_3.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/t_3.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/t_3.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/t_3.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/t_3.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/t_3.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/t_3.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/t_3.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/t_3.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/t_3.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/t_3.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/t_3.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/t_3.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/t_3.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/t_3.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/t_3.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/t_3.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/t_3.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/t_3.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/t_3.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/t_3.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/t_3.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/t_3.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/t_3.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/t_3.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/t_3.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/t_3.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/t_3.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/t_3.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/t_3.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/t_3.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/t_3.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/t_3.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/t_3.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/t_3.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/t_3.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/t_3.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/t_3.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/t_3.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/t_3.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/t_3.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/t_3.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/t_3.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/t_3.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/t_3.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/t_3.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/t_3.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/t_3.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/t_3.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/t_3.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/t_3.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/t_3.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x t_3 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp t_4.inp /home/students/y12/iltarn/gamess-scratch/t_4.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/t_4.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/t_4.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/t_4.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/t_4.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/t_4.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/t_4.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/t_4.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/t_4.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/t_4.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/t_4.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/t_4.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/t_4.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/t_4.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/t_4.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/t_4.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/t_4.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/t_4.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/t_4.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/t_4.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/t_4.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/t_4.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/t_4.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/t_4.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/t_4.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/t_4.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/t_4.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/t_4.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/t_4.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/t_4.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/t_4.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/t_4.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/t_4.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/t_4.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/t_4.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/t_4.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/t_4.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/t_4.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/t_4.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/t_4.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/t_4.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/t_4.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/t_4.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/t_4.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/t_4.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/t_4.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/t_4.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/t_4.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/t_4.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/t_4.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/t_4.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/t_4.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/t_4.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/t_4.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/t_4.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/t_4.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/t_4.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/t_4.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/t_4.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/t_4.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/t_4.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/t_4.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/t_4.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/t_4.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/t_4.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/t_4.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/t_4.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/t_4.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/t_4.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/t_4.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/t_4.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/t_4.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/t_4.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/t_4.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/t_4.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/t_4.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/t_4.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/t_4.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/t_4.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/t_4.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/t_4.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/t_4.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/t_4.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/t_4.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/t_4.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/t_4.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/t_4.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/t_4.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/t_4.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/t_4.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/t_4.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/t_4.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/t_4.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/t_4.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/t_4.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/t_4.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/t_4.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/t_4.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/t_4.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/t_4.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/t_4.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/t_4.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/t_4.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/t_4.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/t_4.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/t_4.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/t_4.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/t_4.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/t_4.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/t_4.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/t_4.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x t_4 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp t_5.inp /home/students/y12/iltarn/gamess-scratch/t_5.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/t_5.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/t_5.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/t_5.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/t_5.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/t_5.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/t_5.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/t_5.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/t_5.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/t_5.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/t_5.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/t_5.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/t_5.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/t_5.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/t_5.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/t_5.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/t_5.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/t_5.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/t_5.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/t_5.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/t_5.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/t_5.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/t_5.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/t_5.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/t_5.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/t_5.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/t_5.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/t_5.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/t_5.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/t_5.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/t_5.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/t_5.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/t_5.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/t_5.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/t_5.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/t_5.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/t_5.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/t_5.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/t_5.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/t_5.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/t_5.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/t_5.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/t_5.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/t_5.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/t_5.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/t_5.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/t_5.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/t_5.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/t_5.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/t_5.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/t_5.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/t_5.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/t_5.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/t_5.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/t_5.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/t_5.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/t_5.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/t_5.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/t_5.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/t_5.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/t_5.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/t_5.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/t_5.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/t_5.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/t_5.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/t_5.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/t_5.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/t_5.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/t_5.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/t_5.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/t_5.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/t_5.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/t_5.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/t_5.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/t_5.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/t_5.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/t_5.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/t_5.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/t_5.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/t_5.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/t_5.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/t_5.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/t_5.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/t_5.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/t_5.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/t_5.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/t_5.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/t_5.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/t_5.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/t_5.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/t_5.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/t_5.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/t_5.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/t_5.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/t_5.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/t_5.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/t_5.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/t_5.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/t_5.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/t_5.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/t_5.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/t_5.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/t_5.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/t_5.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/t_5.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/t_5.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/t_5.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/t_5.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/t_5.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/t_5.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/t_5.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x t_5 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp t_6.inp /home/students/y12/iltarn/gamess-scratch/t_6.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/t_6.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/t_6.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/t_6.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/t_6.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/t_6.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/t_6.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/t_6.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/t_6.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/t_6.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/t_6.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/t_6.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/t_6.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/t_6.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/t_6.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/t_6.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/t_6.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/t_6.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/t_6.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/t_6.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/t_6.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/t_6.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/t_6.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/t_6.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/t_6.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/t_6.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/t_6.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/t_6.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/t_6.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/t_6.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/t_6.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/t_6.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/t_6.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/t_6.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/t_6.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/t_6.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/t_6.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/t_6.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/t_6.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/t_6.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/t_6.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/t_6.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/t_6.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/t_6.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/t_6.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/t_6.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/t_6.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/t_6.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/t_6.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/t_6.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/t_6.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/t_6.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/t_6.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/t_6.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/t_6.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/t_6.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/t_6.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/t_6.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/t_6.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/t_6.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/t_6.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/t_6.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/t_6.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/t_6.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/t_6.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/t_6.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/t_6.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/t_6.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/t_6.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/t_6.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/t_6.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/t_6.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/t_6.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/t_6.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/t_6.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/t_6.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/t_6.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/t_6.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/t_6.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/t_6.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/t_6.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/t_6.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/t_6.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/t_6.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/t_6.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/t_6.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/t_6.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/t_6.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/t_6.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/t_6.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/t_6.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/t_6.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/t_6.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/t_6.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/t_6.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/t_6.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/t_6.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/t_6.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/t_6.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/t_6.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/t_6.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/t_6.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/t_6.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/t_6.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/t_6.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/t_6.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/t_6.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/t_6.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/t_6.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/t_6.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/t_6.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x t_6 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp t_7.inp /home/students/y12/iltarn/gamess-scratch/t_7.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/t_7.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/t_7.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/t_7.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/t_7.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/t_7.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/t_7.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/t_7.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/t_7.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/t_7.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/t_7.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/t_7.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/t_7.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/t_7.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/t_7.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/t_7.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/t_7.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/t_7.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/t_7.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/t_7.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/t_7.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/t_7.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/t_7.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/t_7.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/t_7.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/t_7.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/t_7.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/t_7.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/t_7.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/t_7.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/t_7.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/t_7.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/t_7.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/t_7.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/t_7.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/t_7.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/t_7.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/t_7.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/t_7.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/t_7.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/t_7.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/t_7.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/t_7.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/t_7.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/t_7.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/t_7.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/t_7.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/t_7.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/t_7.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/t_7.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/t_7.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/t_7.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/t_7.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/t_7.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/t_7.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/t_7.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/t_7.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/t_7.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/t_7.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/t_7.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/t_7.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/t_7.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/t_7.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/t_7.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/t_7.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/t_7.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/t_7.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/t_7.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/t_7.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/t_7.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/t_7.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/t_7.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/t_7.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/t_7.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/t_7.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/t_7.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/t_7.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/t_7.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/t_7.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/t_7.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/t_7.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/t_7.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/t_7.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/t_7.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/t_7.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/t_7.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/t_7.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/t_7.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/t_7.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/t_7.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/t_7.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/t_7.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/t_7.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/t_7.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/t_7.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/t_7.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/t_7.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/t_7.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/t_7.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/t_7.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/t_7.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/t_7.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/t_7.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/t_7.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/t_7.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/t_7.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/t_7.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/t_7.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/t_7.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/t_7.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/t_7.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x t_7 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp t_8.inp /home/students/y12/iltarn/gamess-scratch/t_8.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/t_8.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/t_8.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/t_8.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/t_8.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/t_8.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/t_8.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/t_8.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/t_8.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/t_8.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/t_8.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/t_8.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/t_8.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/t_8.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/t_8.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/t_8.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/t_8.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/t_8.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/t_8.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/t_8.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/t_8.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/t_8.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/t_8.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/t_8.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/t_8.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/t_8.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/t_8.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/t_8.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/t_8.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/t_8.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/t_8.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/t_8.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/t_8.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/t_8.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/t_8.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/t_8.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/t_8.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/t_8.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/t_8.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/t_8.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/t_8.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/t_8.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/t_8.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/t_8.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/t_8.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/t_8.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/t_8.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/t_8.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/t_8.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/t_8.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/t_8.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/t_8.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/t_8.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/t_8.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/t_8.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/t_8.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/t_8.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/t_8.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/t_8.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/t_8.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/t_8.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/t_8.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/t_8.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/t_8.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/t_8.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/t_8.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/t_8.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/t_8.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/t_8.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/t_8.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/t_8.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/t_8.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/t_8.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/t_8.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/t_8.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/t_8.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/t_8.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/t_8.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/t_8.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/t_8.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/t_8.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/t_8.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/t_8.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/t_8.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/t_8.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/t_8.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/t_8.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/t_8.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/t_8.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/t_8.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/t_8.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/t_8.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/t_8.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/t_8.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/t_8.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/t_8.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/t_8.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/t_8.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/t_8.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/t_8.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/t_8.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/t_8.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/t_8.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/t_8.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/t_8.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/t_8.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/t_8.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/t_8.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/t_8.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/t_8.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/t_8.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x t_8 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp t_9.inp /home/students/y12/iltarn/gamess-scratch/t_9.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/t_9.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/t_9.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/t_9.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/t_9.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/t_9.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/t_9.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/t_9.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/t_9.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/t_9.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/t_9.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/t_9.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/t_9.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/t_9.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/t_9.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/t_9.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/t_9.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/t_9.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/t_9.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/t_9.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/t_9.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/t_9.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/t_9.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/t_9.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/t_9.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/t_9.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/t_9.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/t_9.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/t_9.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/t_9.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/t_9.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/t_9.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/t_9.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/t_9.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/t_9.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/t_9.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/t_9.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/t_9.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/t_9.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/t_9.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/t_9.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/t_9.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/t_9.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/t_9.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/t_9.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/t_9.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/t_9.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/t_9.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/t_9.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/t_9.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/t_9.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/t_9.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/t_9.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/t_9.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/t_9.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/t_9.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/t_9.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/t_9.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/t_9.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/t_9.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/t_9.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/t_9.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/t_9.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/t_9.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/t_9.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/t_9.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/t_9.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/t_9.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/t_9.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/t_9.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/t_9.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/t_9.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/t_9.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/t_9.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/t_9.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/t_9.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/t_9.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/t_9.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/t_9.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/t_9.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/t_9.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/t_9.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/t_9.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/t_9.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/t_9.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/t_9.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/t_9.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/t_9.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/t_9.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/t_9.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/t_9.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/t_9.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/t_9.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/t_9.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/t_9.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/t_9.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/t_9.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/t_9.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/t_9.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/t_9.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/t_9.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/t_9.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/t_9.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/t_9.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/t_9.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/t_9.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/t_9.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/t_9.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/t_9.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/t_9.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/t_9.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x t_9 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp t_10.inp /home/students/y12/iltarn/gamess-scratch/t_10.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/t_10.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/t_10.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/t_10.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/t_10.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/t_10.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/t_10.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/t_10.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/t_10.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/t_10.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/t_10.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/t_10.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/t_10.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/t_10.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/t_10.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/t_10.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/t_10.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/t_10.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/t_10.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/t_10.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/t_10.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/t_10.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/t_10.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/t_10.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/t_10.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/t_10.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/t_10.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/t_10.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/t_10.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/t_10.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/t_10.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/t_10.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/t_10.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/t_10.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/t_10.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/t_10.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/t_10.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/t_10.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/t_10.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/t_10.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/t_10.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/t_10.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/t_10.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/t_10.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/t_10.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/t_10.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/t_10.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/t_10.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/t_10.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/t_10.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/t_10.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/t_10.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/t_10.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/t_10.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/t_10.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/t_10.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/t_10.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/t_10.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/t_10.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/t_10.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/t_10.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/t_10.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/t_10.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/t_10.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/t_10.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/t_10.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/t_10.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/t_10.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/t_10.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/t_10.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/t_10.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/t_10.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/t_10.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/t_10.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/t_10.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/t_10.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/t_10.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/t_10.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/t_10.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/t_10.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/t_10.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/t_10.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/t_10.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/t_10.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/t_10.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/t_10.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/t_10.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/t_10.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/t_10.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/t_10.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/t_10.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/t_10.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/t_10.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/t_10.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/t_10.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/t_10.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/t_10.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/t_10.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/t_10.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/t_10.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/t_10.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/t_10.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/t_10.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/t_10.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/t_10.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/t_10.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/t_10.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/t_10.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/t_10.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/t_10.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/t_10.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x t_10 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp t_11.inp /home/students/y12/iltarn/gamess-scratch/t_11.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/t_11.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/t_11.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/t_11.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/t_11.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/t_11.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/t_11.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/t_11.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/t_11.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/t_11.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/t_11.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/t_11.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/t_11.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/t_11.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/t_11.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/t_11.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/t_11.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/t_11.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/t_11.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/t_11.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/t_11.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/t_11.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/t_11.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/t_11.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/t_11.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/t_11.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/t_11.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/t_11.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/t_11.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/t_11.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/t_11.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/t_11.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/t_11.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/t_11.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/t_11.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/t_11.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/t_11.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/t_11.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/t_11.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/t_11.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/t_11.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/t_11.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/t_11.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/t_11.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/t_11.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/t_11.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/t_11.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/t_11.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/t_11.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/t_11.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/t_11.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/t_11.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/t_11.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/t_11.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/t_11.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/t_11.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/t_11.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/t_11.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/t_11.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/t_11.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/t_11.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/t_11.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/t_11.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/t_11.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/t_11.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/t_11.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/t_11.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/t_11.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/t_11.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/t_11.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/t_11.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/t_11.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/t_11.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/t_11.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/t_11.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/t_11.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/t_11.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/t_11.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/t_11.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/t_11.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/t_11.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/t_11.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/t_11.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/t_11.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/t_11.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/t_11.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/t_11.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/t_11.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/t_11.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/t_11.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/t_11.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/t_11.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/t_11.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/t_11.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/t_11.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/t_11.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/t_11.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/t_11.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/t_11.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/t_11.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/t_11.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/t_11.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/t_11.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/t_11.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/t_11.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/t_11.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/t_11.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/t_11.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/t_11.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/t_11.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/t_11.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x t_11 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp t_12.inp /home/students/y12/iltarn/gamess-scratch/t_12.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/t_12.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/t_12.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/t_12.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/t_12.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/t_12.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/t_12.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/t_12.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/t_12.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/t_12.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/t_12.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/t_12.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/t_12.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/t_12.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/t_12.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/t_12.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/t_12.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/t_12.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/t_12.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/t_12.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/t_12.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/t_12.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/t_12.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/t_12.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/t_12.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/t_12.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/t_12.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/t_12.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/t_12.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/t_12.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/t_12.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/t_12.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/t_12.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/t_12.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/t_12.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/t_12.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/t_12.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/t_12.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/t_12.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/t_12.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/t_12.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/t_12.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/t_12.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/t_12.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/t_12.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/t_12.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/t_12.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/t_12.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/t_12.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/t_12.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/t_12.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/t_12.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/t_12.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/t_12.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/t_12.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/t_12.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/t_12.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/t_12.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/t_12.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/t_12.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/t_12.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/t_12.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/t_12.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/t_12.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/t_12.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/t_12.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/t_12.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/t_12.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/t_12.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/t_12.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/t_12.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/t_12.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/t_12.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/t_12.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/t_12.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/t_12.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/t_12.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/t_12.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/t_12.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/t_12.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/t_12.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/t_12.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/t_12.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/t_12.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/t_12.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/t_12.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/t_12.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/t_12.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/t_12.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/t_12.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/t_12.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/t_12.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/t_12.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/t_12.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/t_12.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/t_12.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/t_12.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/t_12.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/t_12.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/t_12.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/t_12.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/t_12.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/t_12.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/t_12.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/t_12.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/t_12.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/t_12.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/t_12.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/t_12.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/t_12.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/t_12.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x t_12 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp t_13.inp /home/students/y12/iltarn/gamess-scratch/t_13.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/t_13.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/t_13.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/t_13.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/t_13.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/t_13.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/t_13.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/t_13.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/t_13.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/t_13.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/t_13.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/t_13.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/t_13.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/t_13.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/t_13.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/t_13.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/t_13.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/t_13.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/t_13.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/t_13.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/t_13.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/t_13.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/t_13.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/t_13.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/t_13.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/t_13.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/t_13.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/t_13.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/t_13.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/t_13.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/t_13.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/t_13.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/t_13.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/t_13.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/t_13.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/t_13.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/t_13.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/t_13.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/t_13.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/t_13.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/t_13.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/t_13.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/t_13.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/t_13.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/t_13.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/t_13.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/t_13.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/t_13.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/t_13.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/t_13.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/t_13.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/t_13.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/t_13.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/t_13.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/t_13.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/t_13.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/t_13.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/t_13.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/t_13.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/t_13.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/t_13.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/t_13.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/t_13.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/t_13.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/t_13.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/t_13.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/t_13.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/t_13.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/t_13.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/t_13.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/t_13.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/t_13.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/t_13.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/t_13.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/t_13.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/t_13.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/t_13.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/t_13.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/t_13.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/t_13.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/t_13.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/t_13.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/t_13.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/t_13.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/t_13.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/t_13.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/t_13.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/t_13.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/t_13.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/t_13.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/t_13.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/t_13.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/t_13.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/t_13.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/t_13.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/t_13.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/t_13.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/t_13.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/t_13.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/t_13.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/t_13.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/t_13.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/t_13.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/t_13.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/t_13.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/t_13.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/t_13.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/t_13.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/t_13.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/t_13.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/t_13.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x t_13 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp t_14.inp /home/students/y12/iltarn/gamess-scratch/t_14.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/t_14.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/t_14.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/t_14.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/t_14.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/t_14.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/t_14.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/t_14.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/t_14.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/t_14.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/t_14.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/t_14.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/t_14.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/t_14.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/t_14.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/t_14.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/t_14.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/t_14.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/t_14.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/t_14.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/t_14.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/t_14.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/t_14.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/t_14.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/t_14.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/t_14.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/t_14.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/t_14.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/t_14.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/t_14.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/t_14.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/t_14.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/t_14.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/t_14.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/t_14.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/t_14.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/t_14.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/t_14.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/t_14.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/t_14.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/t_14.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/t_14.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/t_14.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/t_14.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/t_14.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/t_14.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/t_14.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/t_14.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/t_14.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/t_14.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/t_14.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/t_14.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/t_14.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/t_14.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/t_14.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/t_14.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/t_14.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/t_14.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/t_14.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/t_14.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/t_14.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/t_14.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/t_14.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/t_14.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/t_14.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/t_14.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/t_14.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/t_14.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/t_14.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/t_14.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/t_14.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/t_14.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/t_14.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/t_14.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/t_14.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/t_14.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/t_14.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/t_14.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/t_14.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/t_14.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/t_14.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/t_14.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/t_14.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/t_14.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/t_14.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/t_14.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/t_14.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/t_14.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/t_14.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/t_14.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/t_14.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/t_14.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/t_14.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/t_14.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/t_14.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/t_14.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/t_14.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/t_14.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/t_14.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/t_14.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/t_14.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/t_14.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/t_14.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/t_14.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/t_14.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/t_14.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/t_14.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/t_14.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/t_14.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/t_14.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/t_14.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x t_14 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo mkdir: cannot create directory `/home/students/y12/iltarn/gamess-scratch': File exists cp t_15.inp /home/students/y12/iltarn/gamess-scratch/t_15.F05 unset echo setenv ERICFMT /usr/lib/gamess/ericfmt.dat setenv MCPPATH /usr/lib/gamess/mcpdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv MAKEFP /home/students/y12/iltarn/gamess-scratch/t_15.efp setenv GAMMA /home/students/y12/iltarn/gamess-scratch/t_15.gamma setenv TRAJECT /home/students/y12/iltarn/gamess-scratch/t_15.trj setenv RESTART /home/students/y12/iltarn/gamess-scratch/t_15.rst setenv INPUT /home/students/y12/iltarn/gamess-scratch/t_15.F05 setenv PUNCH /home/students/y12/iltarn/gamess-scratch/t_15.dat setenv AOINTS /home/students/y12/iltarn/gamess-scratch/t_15.F08 setenv MOINTS /home/students/y12/iltarn/gamess-scratch/t_15.F09 setenv DICTNRY /home/students/y12/iltarn/gamess-scratch/t_15.F10 setenv DRTFILE /home/students/y12/iltarn/gamess-scratch/t_15.F11 setenv CIVECTR /home/students/y12/iltarn/gamess-scratch/t_15.F12 setenv CASINTS /home/students/y12/iltarn/gamess-scratch/t_15.F13 setenv CIINTS /home/students/y12/iltarn/gamess-scratch/t_15.F14 setenv WORK15 /home/students/y12/iltarn/gamess-scratch/t_15.F15 setenv WORK16 /home/students/y12/iltarn/gamess-scratch/t_15.F16 setenv CSFSAVE /home/students/y12/iltarn/gamess-scratch/t_15.F17 setenv FOCKDER /home/students/y12/iltarn/gamess-scratch/t_15.F18 setenv WORK19 /home/students/y12/iltarn/gamess-scratch/t_15.F19 setenv DASORT /home/students/y12/iltarn/gamess-scratch/t_15.F20 setenv DFTINTS /home/students/y12/iltarn/gamess-scratch/t_15.F21 setenv DFTGRID /home/students/y12/iltarn/gamess-scratch/t_15.F22 setenv JKFILE /home/students/y12/iltarn/gamess-scratch/t_15.F23 setenv ORDINT /home/students/y12/iltarn/gamess-scratch/t_15.F24 setenv EFPIND /home/students/y12/iltarn/gamess-scratch/t_15.F25 setenv PCMDATA /home/students/y12/iltarn/gamess-scratch/t_15.F26 setenv PCMINTS /home/students/y12/iltarn/gamess-scratch/t_15.F27 setenv SVPWRK1 /home/students/y12/iltarn/gamess-scratch/t_15.F26 setenv SVPWRK2 /home/students/y12/iltarn/gamess-scratch/t_15.F27 setenv COSCAV /home/students/y12/iltarn/gamess-scratch/t_15.F26 setenv COSDATA /home/students/y12/iltarn/gamess-scratch/t_15.cosmo setenv COSPOT /home/students/y12/iltarn/gamess-scratch/t_15.pot setenv MLTPL /home/students/y12/iltarn/gamess-scratch/t_15.F28 setenv MLTPLT /home/students/y12/iltarn/gamess-scratch/t_15.F29 setenv DAFL30 /home/students/y12/iltarn/gamess-scratch/t_15.F30 setenv SOINTX /home/students/y12/iltarn/gamess-scratch/t_15.F31 setenv SOINTY /home/students/y12/iltarn/gamess-scratch/t_15.F32 setenv SOINTZ /home/students/y12/iltarn/gamess-scratch/t_15.F33 setenv SORESC /home/students/y12/iltarn/gamess-scratch/t_15.F34 setenv GCILIST /home/students/y12/iltarn/gamess-scratch/t_15.F37 setenv HESSIAN /home/students/y12/iltarn/gamess-scratch/t_15.F38 setenv QMMMTEI /home/students/y12/iltarn/gamess-scratch/t_15.F39 setenv SOCCDAT /home/students/y12/iltarn/gamess-scratch/t_15.F40 setenv AABB41 /home/students/y12/iltarn/gamess-scratch/t_15.F41 setenv BBAA42 /home/students/y12/iltarn/gamess-scratch/t_15.F42 setenv BBBB43 /home/students/y12/iltarn/gamess-scratch/t_15.F43 setenv MCQD50 /home/students/y12/iltarn/gamess-scratch/t_15.F50 setenv MCQD51 /home/students/y12/iltarn/gamess-scratch/t_15.F51 setenv MCQD52 /home/students/y12/iltarn/gamess-scratch/t_15.F52 setenv MCQD53 /home/students/y12/iltarn/gamess-scratch/t_15.F53 setenv MCQD54 /home/students/y12/iltarn/gamess-scratch/t_15.F54 setenv MCQD55 /home/students/y12/iltarn/gamess-scratch/t_15.F55 setenv MCQD56 /home/students/y12/iltarn/gamess-scratch/t_15.F56 setenv MCQD57 /home/students/y12/iltarn/gamess-scratch/t_15.F57 setenv MCQD58 /home/students/y12/iltarn/gamess-scratch/t_15.F58 setenv MCQD59 /home/students/y12/iltarn/gamess-scratch/t_15.F59 setenv MCQD60 /home/students/y12/iltarn/gamess-scratch/t_15.F60 setenv MCQD61 /home/students/y12/iltarn/gamess-scratch/t_15.F61 setenv MCQD62 /home/students/y12/iltarn/gamess-scratch/t_15.F62 setenv MCQD63 /home/students/y12/iltarn/gamess-scratch/t_15.F63 setenv MCQD64 /home/students/y12/iltarn/gamess-scratch/t_15.F64 setenv NMRINT1 /home/students/y12/iltarn/gamess-scratch/t_15.F61 setenv NMRINT2 /home/students/y12/iltarn/gamess-scratch/t_15.F62 setenv NMRINT3 /home/students/y12/iltarn/gamess-scratch/t_15.F63 setenv NMRINT4 /home/students/y12/iltarn/gamess-scratch/t_15.F64 setenv NMRINT5 /home/students/y12/iltarn/gamess-scratch/t_15.F65 setenv NMRINT6 /home/students/y12/iltarn/gamess-scratch/t_15.F66 setenv DCPHFH2 /home/students/y12/iltarn/gamess-scratch/t_15.F67 setenv DCPHF21 /home/students/y12/iltarn/gamess-scratch/t_15.F68 setenv ELNUINT /home/students/y12/iltarn/gamess-scratch/t_15.F67 setenv NUNUINT /home/students/y12/iltarn/gamess-scratch/t_15.F68 setenv GVVPT /home/students/y12/iltarn/gamess-scratch/t_15.F69 setenv NUMOIN /home/students/y12/iltarn/gamess-scratch/t_15.F69 setenv NUMOCAS /home/students/y12/iltarn/gamess-scratch/t_15.F70 setenv NUELMO /home/students/y12/iltarn/gamess-scratch/t_15.F71 setenv NUELCAS /home/students/y12/iltarn/gamess-scratch/t_15.F72 setenv RIVMAT /home/students/y12/iltarn/gamess-scratch/t_15.F51 setenv RIT2A /home/students/y12/iltarn/gamess-scratch/t_15.F52 setenv RIT3A /home/students/y12/iltarn/gamess-scratch/t_15.F53 setenv RIT2B /home/students/y12/iltarn/gamess-scratch/t_15.F54 setenv RIT3B /home/students/y12/iltarn/gamess-scratch/t_15.F55 setenv GMCREF /home/students/y12/iltarn/gamess-scratch/t_15.F70 setenv GMCO2R /home/students/y12/iltarn/gamess-scratch/t_15.F71 setenv GMCROC /home/students/y12/iltarn/gamess-scratch/t_15.F72 setenv GMCOOC /home/students/y12/iltarn/gamess-scratch/t_15.F73 setenv GMCCC0 /home/students/y12/iltarn/gamess-scratch/t_15.F74 setenv GMCHMA /home/students/y12/iltarn/gamess-scratch/t_15.F75 setenv GMCEI1 /home/students/y12/iltarn/gamess-scratch/t_15.F76 setenv GMCEI2 /home/students/y12/iltarn/gamess-scratch/t_15.F77 setenv GMCEOB /home/students/y12/iltarn/gamess-scratch/t_15.F78 setenv GMCEDT /home/students/y12/iltarn/gamess-scratch/t_15.F79 setenv GMCERF /home/students/y12/iltarn/gamess-scratch/t_15.F80 setenv GMCHCR /home/students/y12/iltarn/gamess-scratch/t_15.F81 setenv GMCGJK /home/students/y12/iltarn/gamess-scratch/t_15.F82 setenv GMCGAI /home/students/y12/iltarn/gamess-scratch/t_15.F83 setenv GMCGEO /home/students/y12/iltarn/gamess-scratch/t_15.F84 setenv GMCTE1 /home/students/y12/iltarn/gamess-scratch/t_15.F85 setenv GMCTE2 /home/students/y12/iltarn/gamess-scratch/t_15.F86 setenv GMCHEF /home/students/y12/iltarn/gamess-scratch/t_15.F87 setenv GMCMOL /home/students/y12/iltarn/gamess-scratch/t_15.F88 setenv GMCMOS /home/students/y12/iltarn/gamess-scratch/t_15.F89 setenv GMCWGT /home/students/y12/iltarn/gamess-scratch/t_15.F90 setenv GMCRM2 /home/students/y12/iltarn/gamess-scratch/t_15.F91 setenv GMCRM1 /home/students/y12/iltarn/gamess-scratch/t_15.F92 setenv GMCR00 /home/students/y12/iltarn/gamess-scratch/t_15.F93 setenv GMCRP1 /home/students/y12/iltarn/gamess-scratch/t_15.F94 setenv GMCRP2 /home/students/y12/iltarn/gamess-scratch/t_15.F95 setenv GMCVEF /home/students/y12/iltarn/gamess-scratch/t_15.F96 setenv GMCDIN /home/students/y12/iltarn/gamess-scratch/t_15.F97 setenv GMC2SZ /home/students/y12/iltarn/gamess-scratch/t_15.F98 setenv GMCCCS /home/students/y12/iltarn/gamess-scratch/t_15.F99 unset echo /usr/lib/gamess/ddikick.x /usr/lib/gamess/gamess.00.x t_15 -ddi 1 1 kodomo.fbb.msu.ru -scr /home/students/y12/iltarn/gamess-scratch unset echo
In [72]:
a = np.loadtxt("/home/students/y12/iltarn/Term6/Practice4/d3")
x_o=a[:,0]
y_o=a[:,1]
print "Initial data:", y_o
#Plot it
plt.plot(x_o, y_o, "ro")
plt.xlim(-180,180)
plt.savefig('d3.png')
plt.show()
Initial data: [-79.76467808 -79.76423369 -79.76306284 -79.76161482 -79.76044078 -79.75998276 -79.76044078 -79.76161482 -79.76306284 -79.76423369 -79.76467808 -79.76423369 -79.76306284 -79.76161482 -79.76044078 -79.75998276 -79.76044078 -79.76161482 -79.76306284 -79.76423369 -79.76467808 -79.76423369 -79.76306284 -79.76161482 -79.76044078 -79.75998276 -79.76044078 -79.76161482 -79.76306284 -79.76423369 -79.76467808]
In [73]:
Image(filename='d3.png')
Out[73]:
Вроде как 4 минимума у функции...
Вычисление точечных зарядов для молекулярной механики (этан)¶
In [76]:
%%bash
cd
cd Term6
cd Practice4
export PATH=${PATH}:/home/preps/golovin/progs/bin
echo 'CC Ethane' > ethane.smi
obgen ethane.smi > ethane.mol
babel -imol ethane.mol -omop ethane_opt.mop -xk "PM6"
MOPAC2009.exe ethane_opt.mop
A T O M T Y P E S
IDX TYPE
1 1
2 1
3 5
4 5
5 5
6 5
7 5
8 5
F O R M A L C H A R G E S
IDX CHARGE
1 0.000000
2 0.000000
3 0.000000
4 0.000000
5 0.000000
6 0.000000
7 0.000000
8 0.000000
P A R T I A L C H A R G E S
IDX CHARGE
1 0.000000
2 0.000000
3 0.000000
4 0.000000
5 0.000000
6 0.000000
7 0.000000
8 0.000000
S E T T I N G U P C A L C U L A T I O N S
SETTING UP BOND CALCULATIONS...
SETTING UP ANGLE & STRETCH-BEND CALCULATIONS...
SETTING UP TORSION CALCULATIONS...
SETTING UP OOP CALCULATIONS...
SETTING UP VAN DER WAALS CALCULATIONS...
SETTING UP ELECTROSTATIC CALCULATIONS...
S T E E P E S T D E S C E N T
STEPS = 500
STEP n E(n) E(n-1)
------------------------------------
0 -2.275 ----
10 -4.68504 -4.67773
STEEPEST DESCENT HAS CONVERGED
W E I G H T E D R O T O R S E A R C H
NUMBER OF ROTATABLE BONDS: 0
NUMBER OF POSSIBLE ROTAMERS: 1
GENERATED ONLY ONE CONFORMER
S T E E P E S T D E S C E N T
STEPS = 500
STEP n E(n) E(n-1)
------------------------------------
0 -4.734 ----
10 -4.73329 -4.73394
20 -4.73367 -4.73304
30 -4.73390 -4.73354
40 -4.73404 -4.73383
50 -4.73412 -4.73400
60 -4.73343 -4.73411
70 -4.73378 -4.73308
80 -4.73399 -4.73358
90 -4.73411 -4.73387
100 -4.73419 -4.73405
110 -4.73330 -4.73416
120 -4.73371 -4.73422
130 -4.73396 -4.73343
140 -4.73411 -4.73379
150 -4.73420 -4.73401
160 -4.73426 -4.73414
170 -4.73353 -4.73422
180 -4.73386 -4.73427
190 -4.73405 -4.73362
200 -4.73417 -4.73391
210 -4.73424 -4.73409
220 -4.73322 -4.73419
230 -4.73368 -4.73426
240 -4.73395 -4.73334
250 -4.73411 -4.73375
260 -4.73421 -4.73399
270 -4.73427 -4.73414
280 -4.73341 -4.73423
290 -4.73379 -4.73428
300 -4.73402 -4.73350
310 -4.73415 -4.73384
320 -4.73424 -4.73405
330 -4.73429 -4.73418
340 -4.73355 -4.73425
350 -4.73388 -4.73430
360 -4.73407 -4.73363
370 -4.73419 -4.73393
380 -4.73426 -4.73410
390 -4.73322 -4.73421
400 -4.73368 -4.73427
410 -4.73395 -4.73334
420 -4.73412 -4.73375
430 -4.73422 -4.73399
440 -4.73428 -4.73414
450 -4.73340 -4.73423
460 -4.73379 -4.73428
470 -4.73402 -4.73350
480 -4.73416 -4.73384
490 -4.73424 -4.73405
500 -4.73429 -4.73418
1 molecule converted
19 audit log messages
The MOPAC executable must be put into a directory named "/opt/mopac"
(If it cannot be put there, use environmental variable MOPAC_LICENSE to re-def
ine the directory)
For more information, see: HTTP://OpenMOPAC.net/Manual/trouble_shooting.html#default location
In [80]:
%%bash
cd
cd Term6
cd Practice4
babel -imopout ethane_opt.out -opdb ethane_opt.pdb
export PATH=${PATH}:/home/preps/golovin/progs/bin
Ante_RED-1.5.pl ethane_opt.pdb
[H[2J **************************************************************************** ** Ante_R.E.D. program (version 1.5) ** ** http://q4md-forcefieldtools.org/RED/ ** ** ** ** Distributed under the GNU General Public License ** ** ** ** Ante_R.E.D. developments were initiated in Prof. D.A. Case's lab. by ** ** R. Lelong,(1,2) P. Cieplak,(3) & F.-Y. Dupradeau (1,2) ** ** ** ** Ante_R.E.D. 1.x were developed in Amiens by ** ** F.-Y. Dupradeau(4) & P. Cieplak,(3) ** ** ** ** Ante_R.E.D. 2.0 is currently developed in Amiens by ** ** G. Klimerak,(4) P. Cieplak(3) & F.-Y. Dupradeau(4) ** **************************************************************************** ** (1) DMAG EA-3901 & Faculte de Pharmacie, UPJV, Amiens, France ** ** (2) The Scripps Research Institute, La Jolla, CA, USA ** ** (3) Sanford|Burnham Institute for Medical Research, La Jolla, CA, USA ** ** (4) UMR CNRS 6219 & UFR de Pharmacie, UPJV, Amiens, France ** **************************************************************************** Replace atom names by names used by R.E.D.-III.x/IV... [Done] Use 'CT' for C atoms connected to 2 or 3 H atoms... [Done] Add a number to each new atom name... [Done] Sort atoms by numbers... [Done] Sort atoms by atom names... [Done] Establish new connectivities between atoms... [Done] Create the P2N output file: ethane_opt-out.p2n... [Done] Create a new PDB output file: ethane_opt-out.pdb... [Done] Create a GAMESS-US input file: ethane_opt-gam.inp... [Done] Create a PC-GAMESS input file: ethane_opt-pcg.inp... [Done] Create a GAUSSIAN input file: ethane_opt-gau.com... [Done] Create the information output file: ethane_opt-info.txt... [Done] QM program inputs generated by Ante_R.E.D. only provides starting points: They should be manually adapted to consider the specificity of each case... **************************************************************************** ** Do you need a new feature which is not yet implemented in Ante_R.E.D.? ** ** contact the q4md force field tools team @ ** ** contact@q4md-forcefieldtools.org ** ** Regularly look for bug fixes at the R.E.D. Home Page ** ** ---- ** ** Visit R.E.D. Server @ http://q4md-forcefieldtools.org/REDS/ as well ** ** ---- ** ** Please, submit your force field library(ies) to R.E.DD.B. @ ** ** http://q4md-forcefieldtools.org/REDDB/ ** ** to freely share your results with the scientific community ** ** ---- ** ** Do you need help about the q4md force field tools? ** ** Please, use the q4md-forcefieldtools.org mailing list @ ** ** http://lists.q4md-forcefieldtools.org/ ** **************************************************************************** ** We thank you for using Ante_R.E.D. ** ****************************************************************************
1 molecule converted 19 audit log messages
In [87]:
%%bash
cd
cd Term6
cd Practice4
cp ethane_opt-out.p2n Mol_red1.p2n
export PATH=${PATH}:/home/preps/golovin/progs/bin
RED-vIII.51.pl
---------------------------
* Welcome to R.E.D. III.51 *
RESP ESP charge Derive
http://q4md-forcefieldtools.org/RED/
CHARGE TYPE = RESP-A1
---------------------------
Distributed under the GNU General Public License
---------------------------
Date: Tue May 3 20:23:12 MSK 2016
Machine: kodomo.fbb.msu.ru
---------------------------
Number of cpu(s) used in the QM jobs(s): 1
---------------------------
* Operating system *
Linux kodomo.fbb.msu.ru 3.8-2-amd64 #1 SMP Debian 3.8.13-1 x86_64 GNU/Linux
DID YOU PREPARE YOUR P2N INPUT FILES USING ANTE_R.E.D. 2.0/R.E.D SERVER?
WE STRONGLY RECOMMAND YOU TO USE ANTE_R.E.D. 2.0/R.E.D SERVER TO PREPARE YOUR P2N FILES...
Charge correction will be carried out at 1.10-4 e.
===========================================================================
======================= Single molecule ===========================
The molecule TITLE is "MOLECULE"
The TOTAL CHARGE value of the molecule is "0"
The SPIN MULTIPLICITY value of the molecule is "1"
===========================================================================
* 1 conformation(s) selected *
WARNING:
A 2nd column of atom names is detected
This 2nd column will be used in the PDB (& Tripos) file(s)
WARNING:
No three atom based re-orientation found in the P2N file
Re-orientation will be done according to the GAMESS Algorithm!
* Selected QM Software *
GAMESS
* Software checking *
gamess.00.x [ OK ]
rungms [ OK ]
ddikick.x [ OK ]
resp [ OK ]
The Scratch directory defined for GAMESS is /home/students/y12/iltarn/gamess-scratch
Scratch directory for GAMESS [ OK ]
The punch file directory defined for GAMESS is $SCR/$JOB.dat
Geometry optimization(s) is/are being computed for molecule 1 ... [ OK ]
See the file(s) "JOB1-gam_m1-1.log"
MEP(s) is/are being computed for molecule 1 ... [ OK ]
See the file(s) "JOB2-gam_m1-1-(X).log"
The RESP-A1 charges are being derived for molecule 1 ... [ OK ]
See the "punch2_m1" file(s)
The following Tripos mol2 file(s) has/have been created.
Mol_m1-o1.mol2
Charge values & force field libraries are available in
the "Data-RED" directory.
Execution time: 0 h 0 m 16 s
*************************************************************************
R.E.D. I was developed @ the "Faculte de Pharmacie" in Amiens by:
A.Pigache,(1) P.Cieplak(2) & F.-Y.Dupradeau(1)
R.E.D. II was developed in D.A.Case's laboratory at "TSRI" by:
T.Zaffran,(1,3) P.Cieplak(2) & F.-Y.Dupradeau(1,3)
R.E.D. III.x developments were initiated in D.A.Case's laboratory @ TSRI
& are now carried out @ the "UFR de Pharmacie" in Amiens by:
F.Wang,(5) E.Garcia,(5) N.Grivel,(1,3) P.Cieplak(4) & F.-Y.Dupradeau(1,3,5)
R.E.D. IV is developed @ the "UFR de Pharmacie" in Amiens by:
F.Wang,(5) W.Rozanski,(5) E.Garcia,(5) D.Lelong,(5) P.Cieplak(4)
& F.-Y.Dupradeau(5)
(1) DMAG EA 3901 & Faculte de Pharmacie, Amiens, France
(2) Accelrys Inc., San Diego, USA
(3) D.A.Case's lab., The Scripps Research Institute, La Jolla, CA, USA
(4) Sanford|Burnham Institute for Medical Research, La Jolla, CA, USA
(5) CNRS UMR 6219 & UFR de Pharmacie, Amiens, France
*************************************************************************
R.E.D. III.5 is distributed under the GNU General Public License
*************************************************************************
Do you need a new feature which is not yet implemented in R.E.D.-III.5?
contact the q4md force field tools team @
contact@q4md-forcefieldtools.org
Regularly look for bug fixes at the R.E.D. home page
To use R.E.D. IV, see R.E.D. Server @
http://q4md-forcefieldtools.org/REDS/
----
Please, submit your force field library(ies) to R.E.DD.B. @
http://q4md-forcefieldtools.org/REDDB/
to freely review & share your results within the scientific community
----
Do you need help about the q4md force field tools?
Please, use the q4md-forcefieldtools.org mailing list @
http://lists.q4md-forcefieldtools.org/
*************************************************************************
In [89]:
%%bash
cd Term6
cd Practice4
grep "<TRIPOS>ATOM" Data-RED/Mol_m1-o1.mol2 -A 8
@<TRIPOS>ATOM 1 C -0.763688 -0.000000 0.000000 C 1 LIG -0.0098 **** 2 H -1.156406 -0.709178 0.722053 H 1 LIG 0.0033 **** 3 H -1.156406 -0.270727 -0.975193 H 1 LIG 0.0033 **** 4 H -1.156406 0.979905 0.253140 H 1 LIG 0.0033 **** 5 C 0.763688 0.000000 0.000000 C 1 LIG -0.0097 **** 6 H 1.156406 -0.979890 -0.253200 H 1 LIG 0.0032 **** 7 H 1.156407 0.270667 0.975209 H 1 LIG 0.0032 **** 8 H 1.156406 0.709223 -0.722009 H 1 LIG 0.0032 ****
Здесь представлены координаты атомов и их заряды (последний столбец).
In [94]:
%%bash
cd
cd Term6/Practice4/Data-RED/
grep "TOTAL MULLIKEN AND LOWDIN ATOMIC POPULATIONS" JOB2*.log -A 10
TOTAL MULLIKEN AND LOWDIN ATOMIC POPULATIONS
ATOM MULL.POP. CHARGE LOW.POP. CHARGE
1 C 6.475593 -0.475593 6.442144 -0.442144
2 H 0.841469 0.158531 0.851557 0.148443
3 H 0.841469 0.158531 0.853117 0.146883
4 H 0.841469 0.158531 0.853183 0.146817
5 C 6.475593 -0.475593 6.442144 -0.442144
6 H 0.841469 0.158531 0.853183 0.146817
7 H 0.841469 0.158531 0.853117 0.146883
8 H 0.841469 0.158531 0.851557 0.148443
В выдаче RED заряды раз в 40 меньше, чем здесь. Кроме того, RED сравнял значения зарядов атомов водорода.