@MOLECULE n-{4-[(3-{2-[(trans-4-aminocyclohexyl)amino]-4-pyrimidinyl}-2-pyridinyl)oxy]-1-naphthyl}benzenesulfonamide 71 76 0 0 0 SMALL GASTEIGER @ATOM 1 C -5.7092 -1.6422 1.5684 C.3 1 UNL111111111 -0.2995 2 C -6.9032 -2.5212 1.1941 C.3 1 UNL111111111 -0.2879 3 C -6.5593 -3.3992 -0.0287 C.3 1 UNL111111111 0.0669 4 N -7.7736 -4.1675 -0.3976 N.3 1 UNL111111111 -0.6777 5 C -6.1629 -2.5112 -1.2272 C.3 1 UNL111111111 -0.2837 6 C -4.9726 -1.6256 -0.8610 C.3 1 UNL111111111 -0.3118 7 C -5.3293 -0.7562 0.3643 C.3 1 UNL111111111 0.1026 8 N -4.1755 0.0710 0.7592 N.pl3 1 UNL111111111 -0.5016 9 C -3.8999 1.2469 0.1131 C.ar 1 UNL111111111 0.5274 10 N -2.6539 1.7796 0.3612 N.ar 1 UNL111111111 -0.5430 11 N -4.8517 1.8448 -0.6780 N.ar 1 UNL111111111 -0.5187 12 C -4.5300 3.0281 -1.2221 C.ar 1 UNL111111111 0.1769 13 C -3.2847 3.6380 -1.0266 C.ar 1 UNL111111111 -0.4279 14 C -2.3591 2.9548 -0.2214 C.ar 1 UNL111111111 0.3277 15 C -1.0091 3.4754 0.0181 C.ar 1 UNL111111111 -0.2029 16 C -0.7839 4.7009 0.6352 C.ar 1 UNL111111111 -0.0124 17 C 0.5258 5.1169 0.8849 C.ar 1 UNL111111111 -0.3050 18 C 1.5850 4.2829 0.5125 C.ar 1 UNL111111111 0.1200 19 N 1.3986 3.0949 -0.0967 N.ar 1 UNL111111111 -0.4667 20 C 0.1293 2.7138 -0.3395 C.ar 1 UNL111111111 0.4247 21 O -0.1305 1.5666 -1.0058 O.3 1 UNL111111111 -0.2737 22 C 0.8997 0.6370 -1.1060 C.ar 1 UNL111111111 0.1604 23 C 1.8536 0.7588 -2.0799 C.ar 1 UNL111111111 -0.1508 24 C 2.8228 -0.2597 -2.1995 C.ar 1 UNL111111111 -0.1823 25 C 0.8092 -0.4791 -0.2291 C.ar 1 UNL111111111 -0.0249 26 C -0.1917 -0.5663 0.7725 C.ar 1 UNL111111111 -0.1328 27 C -0.2405 -1.6542 1.6049 C.ar 1 UNL111111111 -0.1525 28 C 0.7053 -2.6982 1.4615 C.ar 1 UNL111111111 -0.1425 29 C 1.6825 -2.6287 0.5005 C.ar 1 UNL111111111 -0.1637 30 C 1.7667 -1.5075 -0.3674 C.ar 1 UNL111111111 -0.0484 31 C 2.8068 -1.3480 -1.3473 C.ar 1 UNL111111111 0.1623 32 N 3.8798 -2.2697 -1.4257 N.pl3 1 UNL111111111 -0.8481 33 S 5.4432 -1.7250 -0.8323 S.O2 1 UNL111111111 2.3556 34 O 6.0893 -2.9470 -0.4145 O.2 1 UNL111111111 -0.9024 35 O 6.0207 -0.8521 -1.8197 O.2 1 UNL111111111 -0.8689 36 C 4.9799 -0.7825 0.5750 C.ar 1 UNL111111111 -0.4101 37 C 4.8971 -1.3975 1.8234 C.ar 1 UNL111111111 -0.0746 38 C 4.3803 -0.6943 2.9095 C.ar 1 UNL111111111 -0.1817 39 C 3.9507 0.6228 2.7476 C.ar 1 UNL111111111 -0.0947 40 C 4.0718 1.2488 1.5090 C.ar 1 UNL111111111 -0.1652 41 C 4.5989 0.5502 0.4239 C.ar 1 UNL111111111 -0.0554 42 H -5.9604 -1.0061 2.4391 H 1 UNL111111111 0.1513 43 H -4.8533 -2.2675 1.8817 H 1 UNL111111111 0.1413 44 H -7.2007 -3.1521 2.0499 H 1 UNL111111111 0.1342 45 H -7.7910 -1.8991 0.9605 H 1 UNL111111111 0.1627 46 H -5.7043 -4.0741 0.2298 H 1 UNL111111111 0.1044 47 H -7.6427 -4.7102 -1.2336 H 1 UNL111111111 0.2512 48 H -8.0824 -4.7720 0.3434 H 1 UNL111111111 0.2492 49 H -5.9212 -3.1347 -2.1063 H 1 UNL111111111 0.1373 50 H -7.0313 -1.8916 -1.5308 H 1 UNL111111111 0.1626 51 H -4.0761 -2.2385 -0.6577 H 1 UNL111111111 0.1453 52 H -4.7082 -0.9711 -1.7155 H 1 UNL111111111 0.1580 53 H -6.1887 -0.0780 0.1051 H 1 UNL111111111 0.1741 54 H -3.3991 -0.3992 1.2154 H 1 UNL111111111 0.3216 55 H -5.3082 3.4887 -1.8456 H 1 UNL111111111 0.1718 56 H -3.0365 4.5806 -1.4925 H 1 UNL111111111 0.1830 57 H -1.6287 5.3258 0.9325 H 1 UNL111111111 0.1650 58 H 0.7189 6.0693 1.3670 H 1 UNL111111111 0.1700 59 H 2.6309 4.5585 0.6946 H 1 UNL111111111 0.1678 60 H 1.8852 1.6288 -2.7338 H 1 UNL111111111 0.1765 61 H 3.6034 -0.1660 -2.9611 H 1 UNL111111111 0.1921 62 H -0.9132 0.2548 0.8647 H 1 UNL111111111 0.1947 63 H -0.9955 -1.7276 2.3851 H 1 UNL111111111 0.1537 64 H 0.6460 -3.5559 2.1292 H 1 UNL111111111 0.1479 65 H 2.4029 -3.4381 0.4027 H 1 UNL111111111 0.1492 66 H 3.6443 -3.2477 -1.2909 H 1 UNL111111111 0.3176 67 H 5.2286 -2.4318 1.9655 H 1 UNL111111111 0.1689 68 H 4.2999 -1.1770 3.8805 H 1 UNL111111111 0.1513 69 H 3.5186 1.1615 3.5897 H 1 UNL111111111 0.1467 70 H 3.7312 2.2751 1.3756 H 1 UNL111111111 0.1614 71 H 4.6886 1.0604 -0.5429 H 1 UNL111111111 0.1759 @BOND 1 1 2 1 2 1 42 1 3 1 43 1 4 2 44 1 5 2 45 1 6 3 2 1 7 3 4 1 8 3 46 1 9 4 47 1 10 4 48 1 11 5 3 1 12 5 49 1 13 5 50 1 14 6 7 1 15 6 5 1 16 6 51 1 17 6 52 1 18 7 1 1 19 7 53 1 20 8 7 1 21 8 54 1 22 9 10 ar 23 9 8 1 24 11 9 ar 25 12 13 ar 26 12 11 ar 27 12 55 1 28 13 14 ar 29 13 56 1 30 14 15 1 31 14 10 ar 32 15 16 ar 33 16 17 ar 34 16 57 1 35 17 58 1 36 18 17 ar 37 18 59 1 38 19 18 ar 39 20 19 ar 40 20 15 ar 41 21 20 1 42 22 21 1 43 22 23 ar 44 23 60 1 45 24 23 ar 46 24 61 1 47 25 22 ar 48 26 25 ar 49 26 62 1 50 27 26 ar 51 27 63 1 52 28 27 ar 53 28 29 ar 54 28 64 1 55 29 30 ar 56 29 65 1 57 30 25 ar 58 30 31 ar 59 31 24 ar 60 32 31 1 61 32 66 1 62 33 32 1 63 33 36 1 64 34 33 2 65 35 33 2 66 36 37 ar 67 37 38 ar 68 37 67 1 69 38 68 1 70 39 38 ar 71 39 69 1 72 40 39 ar 73 40 70 1 74 41 36 ar 75 41 40 ar 76 41 71 1