@MOLECULE (6s)-6-hydroxy-8-{4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl}-8-azaspiro[4.5]decane-7,9-dione 60 63 0 0 0 SMALL GASTEIGER @ATOM 1 O -5.8049 1.1670 -1.7929 O.3 1 UNL1111111111 -0.5272 2 O -3.5282 2.2718 -0.8619 O.2 1 UNL1111111111 -0.4898 3 O -3.2122 -0.6954 2.5389 O.2 1 UNL1111111111 -0.4726 4 N -3.3994 0.8895 0.9366 N.am 1 UNL1111111111 -0.5477 5 N 2.7156 0.8584 -0.2605 N.3 1 UNL1111111111 -0.4208 6 N 5.5912 1.0182 -0.1511 N.pl3 1 UNL1111111111 -0.3629 7 N 6.9003 -0.5824 -1.3056 N.ar 1 UNL1111111111 -0.5219 8 N 6.8380 -0.5438 1.1165 N.ar 1 UNL1111111111 -0.5206 9 C -5.7047 -0.4897 -0.0895 C.3 1 UNL1111111111 0.0619 10 C -7.1700 -0.9156 -0.3108 C.3 1 UNL1111111111 -0.2771 11 C -4.9014 -1.4247 -1.0158 C.3 1 UNL1111111111 -0.2856 12 C -5.5010 0.9971 -0.4303 C.3 1 UNL1111111111 0.0308 13 C -7.1274 -2.4230 -0.6171 C.3 1 UNL1111111111 -0.2615 14 C -5.6836 -2.7485 -1.0513 C.3 1 UNL1111111111 -0.2568 15 C -5.3003 -0.6709 1.3807 C.3 1 UNL1111111111 -0.4025 16 C -4.0621 1.4402 -0.1623 C.2 1 UNL1111111111 0.5302 17 C -3.9014 -0.2040 1.6784 C.2 1 UNL1111111111 0.5947 18 C -2.0044 1.3153 1.1844 C.3 1 UNL1111111111 -0.0549 19 C -1.0250 0.5007 0.3229 C.3 1 UNL1111111111 -0.3027 20 C 0.4023 1.0010 0.5498 C.3 1 UNL1111111111 -0.2773 21 C 1.3903 0.1917 -0.3131 C.3 1 UNL1111111111 -0.1104 22 C 3.4385 0.5138 0.9882 C.3 1 UNL1111111111 -0.1512 23 C 3.5299 0.5063 -1.4500 C.3 1 UNL1111111111 -0.1529 24 C 4.7645 1.3091 1.0355 C.3 1 UNL1111111111 -0.0933 25 C 4.8570 1.3002 -1.3985 C.3 1 UNL1111111111 -0.0907 26 C 6.4287 -0.0809 -0.1137 C.ar 1 UNL1111111111 0.4948 27 C 7.8446 -1.5321 -1.2471 C.ar 1 UNL1111111111 0.1645 28 C 7.7849 -1.4924 1.1375 C.ar 1 UNL1111111111 0.1648 29 C 8.3366 -2.0279 -0.0331 C.ar 1 UNL1111111111 -0.4173 30 H -7.8137 -0.6850 0.5489 H 1 UNL1111111111 0.1340 31 H -7.5930 -0.3625 -1.1736 H 1 UNL1111111111 0.1648 32 H -4.8432 -0.9863 -2.0322 H 1 UNL1111111111 0.1663 33 H -3.8644 -1.5677 -0.6800 H 1 UNL1111111111 0.1388 34 H -6.2048 1.6487 0.1438 H 1 UNL1111111111 0.1560 35 H -6.0077 -0.1450 2.0570 H 1 UNL1111111111 0.1809 36 H -5.3882 -1.7466 1.6612 H 1 UNL1111111111 0.1986 37 H -7.4142 -3.0154 0.2664 H 1 UNL1111111111 0.1308 38 H -7.8491 -2.6844 -1.4073 H 1 UNL1111111111 0.1345 39 H -5.6600 -3.1937 -2.0587 H 1 UNL1111111111 0.1368 40 H -5.2298 -3.4926 -0.3763 H 1 UNL1111111111 0.1341 41 H -1.9166 2.4026 0.9525 H 1 UNL1111111111 0.1600 42 H -1.7766 1.1849 2.2678 H 1 UNL1111111111 0.1610 43 H -5.2506 1.8885 -2.1833 H 1 UNL1111111111 0.3424 44 H -1.3001 0.5950 -0.7462 H 1 UNL1111111111 0.1534 45 H -1.1047 -0.5743 0.5741 H 1 UNL1111111111 0.1506 46 H 0.6736 0.9289 1.6186 H 1 UNL1111111111 0.1407 47 H 0.4876 2.0752 0.2868 H 1 UNL1111111111 0.1598 48 H 1.4221 -0.8659 0.0214 H 1 UNL1111111111 0.1193 49 H 1.0311 0.1844 -1.3659 H 1 UNL1111111111 0.1381 50 H 3.6461 -0.5727 1.0872 H 1 UNL1111111111 0.1273 51 H 2.8053 0.8067 1.8533 H 1 UNL1111111111 0.1516 52 H 3.7431 -0.5803 -1.5291 H 1 UNL1111111111 0.1276 53 H 2.9655 0.8013 -2.3611 H 1 UNL1111111111 0.1499 54 H 5.3246 1.0789 1.9705 H 1 UNL1111111111 0.1745 55 H 4.5579 2.4046 1.0341 H 1 UNL1111111111 0.1615 56 H 4.6511 2.3960 -1.4195 H 1 UNL1111111111 0.1621 57 H 5.4858 1.0635 -2.2868 H 1 UNL1111111111 0.1739 58 H 8.2031 -1.9036 -2.2166 H 1 UNL1111111111 0.1731 59 H 8.0950 -1.8294 2.1361 H 1 UNL1111111111 0.1734 60 H 9.1004 -2.7913 -0.0012 H 1 UNL1111111111 0.1801 @BOND 1 1 12 1 2 1 43 1 3 2 16 2 4 3 17 2 5 4 16 am 6 4 17 am 7 4 18 1 8 5 21 1 9 5 22 1 10 5 23 1 11 6 24 1 12 6 25 1 13 6 26 1 14 7 26 ar 15 7 27 ar 16 8 26 ar 17 8 28 ar 18 9 10 1 19 9 11 1 20 9 12 1 21 9 15 1 22 10 13 1 23 10 30 1 24 10 31 1 25 11 14 1 26 11 32 1 27 11 33 1 28 12 16 1 29 12 34 1 30 13 14 1 31 13 37 1 32 13 38 1 33 14 39 1 34 14 40 1 35 15 17 1 36 15 35 1 37 15 36 1 38 18 19 1 39 18 41 1 40 18 42 1 41 19 20 1 42 19 44 1 43 19 45 1 44 20 21 1 45 20 46 1 46 20 47 1 47 21 48 1 48 21 49 1 49 22 24 1 50 22 50 1 51 22 51 1 52 23 25 1 53 23 52 1 54 23 53 1 55 24 54 1 56 24 55 1 57 25 56 1 58 25 57 1 59 27 29 ar 60 27 58 1 61 28 29 ar 62 28 59 1 63 29 60 1