@MOLECULE 2-{4-[3-(1h-benzimidazol-2-yl)-1h-indazol-6-yl]-1h-pyrazol-1-yl}-n-(3-methylbutyl)acetamide 57 61 0 0 0 SMALL GASTEIGER @ATOM 1 C 10.1064 -1.9883 0.8731 C.3 1 UNL111111111 -0.4560 2 C 9.0059 -1.1275 1.5074 C.3 1 UNL111111111 -0.0574 3 C 9.6351 0.0522 2.2571 C.3 1 UNL111111111 -0.4561 4 C 8.0434 -0.6320 0.4130 C.3 1 UNL111111111 -0.3156 5 C 6.7280 -0.1274 1.0307 C.3 1 UNL111111111 -0.0649 6 N 5.8411 0.3753 -0.0250 N.am 1 UNL111111111 -0.5743 7 C 5.4037 1.6683 -0.0084 C.2 1 UNL111111111 0.5552 8 O 5.7195 2.4725 0.8439 O.2 1 UNL111111111 -0.5249 9 C 4.4935 2.1029 -1.1769 C.3 1 UNL111111111 -0.1746 10 N 3.3541 1.2226 -1.3440 N.ar 1 UNL111111111 -0.0949 11 C 2.0716 1.3813 -0.8646 C.ar 1 UNL111111111 -0.0530 12 N 3.5122 0.0278 -1.9738 N.ar 1 UNL111111111 -0.2883 13 C 2.3102 -0.5916 -1.9277 C.ar 1 UNL111111111 -0.0392 14 C 1.3613 0.2259 -1.2315 C.ar 1 UNL111111111 -0.1706 15 C -0.0221 -0.0824 -0.9554 C.ar 1 UNL111111111 0.1019 16 C -0.4238 -1.4059 -0.8429 C.ar 1 UNL111111111 -0.2451 17 C -0.9470 0.9870 -0.7924 C.ar 1 UNL111111111 -0.2160 18 C -2.2761 0.7598 -0.5048 C.ar 1 UNL111111111 -0.0359 19 C -2.7057 -0.5659 -0.3809 C.ar 1 UNL111111111 -0.1002 20 C -1.7751 -1.6371 -0.5573 C.ar 1 UNL111111111 0.1082 21 N -2.4948 -2.8172 -0.3796 N.ar 1 UNL111111111 -0.2301 22 N -3.7958 -2.5605 -0.1027 N.ar 1 UNL111111111 -0.2110 23 C -3.9598 -1.2151 -0.0950 C.ar 1 UNL111111111 0.0214 24 C -5.2211 -0.5752 0.1731 C.ar 1 UNL111111111 0.2824 25 N -6.4047 -1.3047 0.4044 N.ar 1 UNL111111111 -0.3985 26 C -7.4133 -0.3706 0.6312 C.ar 1 UNL111111111 0.0575 27 C -8.7769 -0.5020 0.9119 C.ar 1 UNL111111111 -0.1890 28 C -9.4953 0.6671 1.0847 C.ar 1 UNL111111111 -0.1241 29 C -8.8885 1.9395 0.9833 C.ar 1 UNL111111111 -0.1806 30 C -7.5426 2.0850 0.7051 C.ar 1 UNL111111111 -0.1094 31 C -6.7871 0.9195 0.5247 C.ar 1 UNL111111111 0.0705 32 N -5.4321 0.7493 0.2395 N.ar 1 UNL111111111 -0.3996 33 H 10.8287 -2.3247 1.6250 H 1 UNL111111111 0.1453 34 H 9.6923 -2.8819 0.3953 H 1 UNL111111111 0.1411 35 H 10.6640 -1.4312 0.1125 H 1 UNL111111111 0.1460 36 H 8.4380 -1.7564 2.2357 H 1 UNL111111111 0.1301 37 H 8.8740 0.6963 2.7128 H 1 UNL111111111 0.1477 38 H 10.2945 -0.2942 3.0603 H 1 UNL111111111 0.1445 39 H 10.2342 0.6805 1.5881 H 1 UNL111111111 0.1473 40 H 8.5197 0.1749 -0.1755 H 1 UNL111111111 0.1540 41 H 7.8358 -1.4453 -0.3067 H 1 UNL111111111 0.1425 42 H 6.2108 -0.9457 1.5807 H 1 UNL111111111 0.1364 43 H 6.9301 0.6832 1.7729 H 1 UNL111111111 0.1729 44 H 5.5481 -0.2786 -0.7414 H 1 UNL111111111 0.3334 45 H 4.1410 3.1463 -0.9805 H 1 UNL111111111 0.1911 46 H 5.0997 2.1361 -2.1175 H 1 UNL111111111 0.1907 47 H 1.7493 2.2456 -0.3159 H 1 UNL111111111 0.1860 48 H 2.1493 -1.5533 -2.3797 H 1 UNL111111111 0.1842 49 H 0.2745 -2.2260 -0.9564 H 1 UNL111111111 0.1642 50 H -0.5866 2.0072 -0.9075 H 1 UNL111111111 0.1597 51 H -2.9951 1.5747 -0.3719 H 1 UNL111111111 0.1898 52 H -2.1855 -3.7653 -0.4198 H 1 UNL111111111 0.3367 53 H -6.4912 -2.2976 0.4102 H 1 UNL111111111 0.3345 54 H -9.2442 -1.4776 0.9893 H 1 UNL111111111 0.1605 55 H -10.5613 0.6169 1.3056 H 1 UNL111111111 0.1517 56 H -9.5085 2.8226 1.1301 H 1 UNL111111111 0.1535 57 H -7.0663 3.0595 0.6247 H 1 UNL111111111 0.1685 @BOND 1 1 2 1 2 1 33 1 3 1 34 1 4 1 35 1 5 2 3 1 6 2 36 1 7 3 37 1 8 3 38 1 9 3 39 1 10 4 2 1 11 4 40 1 12 4 41 1 13 5 4 1 14 5 42 1 15 5 43 1 16 6 7 am 17 6 5 1 18 6 44 1 19 7 8 2 20 9 7 1 21 9 45 1 22 9 46 1 23 10 9 1 24 11 10 ar 25 11 47 1 26 12 10 ar 27 13 14 ar 28 13 12 ar 29 13 48 1 30 14 11 ar 31 15 14 1 32 16 15 ar 33 16 49 1 34 17 15 ar 35 17 50 1 36 18 17 ar 37 18 51 1 38 19 20 ar 39 19 18 ar 40 20 16 ar 41 21 20 ar 42 21 52 1 43 22 23 ar 44 22 21 ar 45 23 19 ar 46 24 32 ar 47 24 23 1 48 25 24 ar 49 25 53 1 50 26 25 ar 51 26 31 ar 52 27 26 ar 53 27 54 1 54 28 27 ar 55 28 29 ar 56 28 55 1 57 29 30 ar 58 29 56 1 59 30 31 ar 60 30 57 1 61 31 32 ar