HET P48 A 401 66 HETNAM P48 N,1,4,4-TETRAMETHYL-8-{[4-(4-METHYLPIPERAZIN-1-YL) HETNAM 2 P48 PHENYL]AMINO}-4,5-DIHYDRO-1H-PYRAZOLO[4,3- HETNAM 3 P48 H]QUINAZOLINE-3-CARBOXAMIDE FORMUL 2 P48 C25 H32 N8 O HETATM 4562 O1 P48 A 401 1.376 -2.948 -1.921 1.00 17.51 O ANISOU 4562 O1 P48 A 401 2639 2157 1855 155 112 164 O HETATM 4563 C2 P48 A 401 2.102 -3.835 -2.348 1.00 13.01 C ANISOU 4563 C2 P48 A 401 1436 1878 1630 411 -50 -213 C HETATM 4564 N3 P48 A 401 1.694 -5.040 -2.694 1.00 14.52 N ANISOU 4564 N3 P48 A 401 2231 1219 2068 -299 -145 -226 N HETATM 4565 C4 P48 A 401 0.304 -5.482 -2.690 1.00 17.64 C ANISOU 4565 C4 P48 A 401 2941 1689 2070 -1007 27 -302 C HETATM 4566 C5 P48 A 401 3.534 -3.595 -2.407 1.00 14.39 C ANISOU 4566 C5 P48 A 401 2222 1996 1249 747 10 -346 C HETATM 4567 N6 P48 A 401 4.433 -4.579 -2.476 1.00 14.08 N ANISOU 4567 N6 P48 A 401 2059 2015 1276 456 166 -72 N HETATM 4568 N7 P48 A 401 5.676 -4.018 -2.513 1.00 14.81 N ANISOU 4568 N7 P48 A 401 2445 1735 1448 292 4 25 N HETATM 4569 C8 P48 A 401 6.784 -4.980 -2.627 1.00 14.17 C ANISOU 4569 C8 P48 A 401 2419 1259 1705 -44 -288 -205 C HETATM 4570 C9 P48 A 401 5.626 -2.686 -2.508 1.00 11.34 C ANISOU 4570 C9 P48 A 401 2015 1193 1100 214 473 15 C HETATM 4571 C10 P48 A 401 4.211 -2.283 -2.425 1.00 12.57 C ANISOU 4571 C10 P48 A 401 2283 1381 1114 803 -109 -387 C HETATM 4572 C11 P48 A 401 6.717 -1.701 -2.432 1.00 13.07 C ANISOU 4572 C11 P48 A 401 2117 1640 1207 237 -255 185 C HETATM 4573 C12 P48 A 401 6.372 -0.344 -2.553 1.00 11.42 C ANISOU 4573 C12 P48 A 401 1769 1237 1331 -399 515 414 C HETATM 4574 C13 P48 A 401 4.946 0.081 -2.919 1.00 15.00 C ANISOU 4574 C13 P48 A 401 2429 1913 1357 -99 -16 201 C HETATM 4575 C14 P48 A 401 3.831 -0.799 -2.343 1.00 11.94 C ANISOU 4575 C14 P48 A 401 2059 1261 1217 -201 -437 -235 C HETATM 4576 C15 P48 A 401 3.594 -0.413 -0.894 1.00 14.31 C ANISOU 4576 C15 P48 A 401 2102 1576 1761 288 -300 -935 C HETATM 4577 C16 P48 A 401 2.643 -0.487 -3.232 1.00 15.26 C ANISOU 4577 C16 P48 A 401 3006 1510 1282 -142 -673 -386 C HETATM 4578 N17 P48 A 401 7.978 -2.094 -2.122 1.00 11.26 N ANISOU 4578 N17 P48 A 401 1389 1726 1165 -101 -415 98 N HETATM 4579 C18 P48 A 401 8.967 -1.187 -1.969 1.00 13.61 C ANISOU 4579 C18 P48 A 401 1712 2234 1225 -179 -277 377 C HETATM 4580 N19 P48 A 401 8.652 0.132 -2.120 1.00 11.87 N ANISOU 4580 N19 P48 A 401 1637 1770 1103 265 -59 261 N HETATM 4581 C20 P48 A 401 7.406 0.568 -2.392 1.00 12.93 C ANISOU 4581 C20 P48 A 401 1935 1777 1202 -92 253 228 C HETATM 4582 N21 P48 A 401 10.250 -1.520 -1.686 1.00 15.06 N ANISOU 4582 N21 P48 A 401 1520 2713 1491 -184 42 1 N HETATM 4583 C22 P48 A 401 10.899 -2.736 -1.677 1.00 13.65 C ANISOU 4583 C22 P48 A 401 1544 2229 1413 247 381 -18 C HETATM 4584 C23 P48 A 401 12.306 -2.790 -1.754 1.00 14.23 C ANISOU 4584 C23 P48 A 401 1423 2531 1451 224 77 167 C HETATM 4585 C24 P48 A 401 12.994 -3.988 -1.746 1.00 16.61 C ANISOU 4585 C24 P48 A 401 2111 2659 1542 401 664 197 C HETATM 4586 C25 P48 A 401 12.317 -5.216 -1.688 1.00 16.25 C ANISOU 4586 C25 P48 A 401 1929 2449 1796 64 110 -91 C HETATM 4587 C26 P48 A 401 10.888 -5.195 -1.609 1.00 14.67 C ANISOU 4587 C26 P48 A 401 1931 2314 1327 557 -177 377 C HETATM 4588 C27 P48 A 401 10.185 -3.966 -1.591 1.00 12.83 C ANISOU 4588 C27 P48 A 401 1640 1865 1371 406 76 21 C HETATM 4589 N28 P48 A 401 13.053 -6.427 -1.696 1.00 20.73 N ANISOU 4589 N28 P48 A 401 2139 2313 3425 539 368 -287 N HETATM 4590 C29 P48 A 401 12.393 -7.743 -1.703 1.00 31.25 C ANISOU 4590 C29 P48 A 401 4125 3715 4036 1016 324 -772 C HETATM 4591 C30 P48 A 401 12.911 -8.295 -3.014 1.00 36.59 C ANISOU 4591 C30 P48 A 401 5274 4279 4348 1145 129 -895 C HETATM 4592 N31 P48 A 401 14.331 -8.567 -2.773 1.00 33.72 N ANISOU 4592 N31 P48 A 401 4796 3417 4601 2152 -26 -976 N HETATM 4593 C32 P48 A 401 14.832 -9.932 -2.899 1.00 37.01 C ANISOU 4593 C32 P48 A 401 5666 3649 4746 2119 385 -1257 C HETATM 4594 C33 P48 A 401 15.147 -7.679 -1.951 1.00 30.25 C ANISOU 4594 C33 P48 A 401 3744 3352 4398 974 294 -890 C HETATM 4595 C34 P48 A 401 14.481 -6.313 -2.093 1.00 27.38 C ANISOU 4595 C34 P48 A 401 3541 2910 3954 441 708 -530 C HETATM 4596 H3 P48 A 401 2.293 -5.562 -3.151 1.00 17.42 H HETATM 4597 H41C P48 A 401 -0.235 -4.871 -3.238 1.00 21.16 H HETATM 4598 H42C P48 A 401 0.248 -6.391 -3.062 1.00 21.16 H HETATM 4599 H43C P48 A 401 -0.037 -5.483 -1.770 1.00 21.16 H HETATM 4600 H81C P48 A 401 7.301 -4.985 -1.792 1.00 17.00 H HETATM 4601 H82C P48 A 401 7.369 -4.719 -3.373 1.00 17.00 H HETATM 4602 H83C P48 A 401 6.423 -5.877 -2.793 1.00 17.00 H HETATM 4603 H131 P48 A 401 4.866 0.076 -3.899 1.00 18.00 H HETATM 4604 H132 P48 A 401 4.808 1.000 -2.600 1.00 18.00 H HETATM 4605 H20 P48 A 401 7.239 1.526 -2.521 1.00 15.52 H HETATM 4606 H151 P48 A 401 3.588 0.566 -0.812 1.00 17.18 H HETATM 4607 H152 P48 A 401 4.312 -0.784 -0.335 1.00 17.18 H HETATM 4608 H153 P48 A 401 2.730 -0.772 -0.597 1.00 17.18 H HETATM 4609 H161 P48 A 401 1.877 -1.044 -2.963 1.00 18.31 H HETATM 4610 H162 P48 A 401 2.874 -0.679 -4.168 1.00 18.31 H HETATM 4611 H163 P48 A 401 2.405 0.463 -3.140 1.00 18.31 H HETATM 4612 H21 P48 A 401 10.783 -0.807 -1.460 1.00 18.08 H HETATM 4613 H23 P48 A 401 12.811 -1.952 -1.805 1.00 17.07 H HETATM 4614 H27 P48 A 401 9.204 -3.962 -1.549 1.00 15.40 H HETATM 4615 H24 P48 A 401 13.973 -3.981 -1.811 1.00 19.94 H HETATM 4616 H26 P48 A 401 10.391 -6.039 -1.555 1.00 17.60 H HETATM 4617 H291 P48 A 401 11.414 -7.650 -1.718 1.00 37.51 H HETATM 4618 H292 P48 A 401 12.689 -8.293 -0.944 1.00 37.51 H HETATM 4619 H341 P48 A 401 14.934 -5.664 -1.510 1.00 32.86 H HETATM 4620 H342 P48 A 401 14.540 -6.014 -3.029 1.00 32.86 H HETATM 4621 H301 P48 A 401 12.438 -9.125 -3.247 1.00 43.90 H HETATM 4622 H302 P48 A 401 12.807 -7.629 -3.730 1.00 43.90 H HETATM 4623 H321 P48 A 401 14.286 -10.535 -2.346 1.00 44.41 H HETATM 4624 H322 P48 A 401 15.767 -9.967 -2.598 1.00 44.41 H HETATM 4625 H323 P48 A 401 14.780 -10.214 -3.840 1.00 44.41 H HETATM 4626 H331 P48 A 401 15.135 -7.971 -1.013 1.00 36.30 H HETATM 4627 H332 P48 A 401 16.069 -7.647 -2.291 1.00 36.30 H