@MOLECULE n-[2-chloro-5-(1-{3-[4-(6-chloro-3-methyl-2-oxo-2,3-dihydro-1h-benzimidazol-1-yl)-1-piperidinyl]propyl}-6-oxo-1,6-dihydro-3-pyridazinyl)benzyl]benzamide 79 84 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 C 9.5245 -0.8008 0.0114 C.ar 1 UNL1 0.0297 2 C 8.2324 -0.3582 -0.2619 C.ar 1 UNL1 -0.2148 3 CL 10.8231 0.2072 -0.4685 Cl 1 UNL1 -0.0865 4 C 7.2051 -1.1981 0.1382 C.ar 1 UNL1 0.1253 5 CL -7.4692 -0.5340 1.4839 Cl 1 UNL1 -0.0615 6 C 7.4909 -2.4485 0.7978 C.ar 1 UNL1 0.0954 7 C 8.7928 -2.8500 1.0503 C.ar 1 UNL1 -0.1670 8 C 9.8258 -2.0010 0.6439 C.ar 1 UNL1 -0.1740 9 N 6.2601 -3.0599 1.0592 N.ar 1 UNL1 -0.4312 10 C 5.2028 -2.2262 0.6226 C.ar 1 UNL1 0.6790 11 N 5.8122 -1.0929 0.0281 N.ar 1 UNL1 -0.4708 12 C 6.0692 -4.2908 1.8014 C.3 1 UNL1 -0.2031 13 O 4.0247 -2.4627 0.7218 O.2 1 UNL1 -0.5023 14 C 5.0889 0.0540 -0.5242 C.3 1 UNL1 0.1331 15 C 4.1481 -0.3981 -1.6565 C.3 1 UNL1 -0.3181 16 C 3.4315 0.8349 -2.2298 C.3 1 UNL1 -0.1068 17 N 2.6502 1.5027 -1.1582 N.3 1 UNL1 -0.4189 18 C 3.5317 1.9568 -0.0545 C.3 1 UNL1 -0.1031 19 C 4.2485 0.7461 0.5653 C.3 1 UNL1 -0.3206 20 C 1.8618 2.6299 -1.7155 C.3 1 UNL1 -0.1115 21 C 0.7013 2.9399 -0.7522 C.3 1 UNL1 -0.3057 22 C -0.3576 3.7854 -1.4737 C.3 1 UNL1 -0.0646 23 N -1.4029 4.2229 -0.5214 N.ar 1 UNL1 -0.2581 24 N -2.3626 3.3318 -0.3001 N.ar 1 UNL1 -0.1214 25 C -3.3108 3.6054 0.5877 C.ar 1 UNL1 -0.0113 26 C -3.3375 4.8427 1.3232 C.ar 1 UNL1 -0.0797 27 C -2.3528 5.7477 1.1104 C.ar 1 UNL1 -0.2804 28 C -1.2886 5.4722 0.1592 C.ar 1 UNL1 0.5261 29 C -4.3399 2.5781 0.7952 C.ar 1 UNL1 -0.0014 30 C -4.7734 2.2868 2.0932 C.ar 1 UNL1 -0.1354 31 C -5.7493 1.3162 2.2970 C.ar 1 UNL1 -0.1663 32 C -6.2698 0.6462 1.1960 C.ar 1 UNL1 0.0168 33 C -5.8449 0.9041 -0.1047 C.ar 1 UNL1 -0.0630 34 C -4.8707 1.8848 -0.2960 C.ar 1 UNL1 -0.1254 35 O -0.3480 6.1837 -0.1168 O.2 1 UNL1 -0.4903 36 C -6.3956 0.1627 -1.2946 C.3 1 UNL1 -0.0646 37 N -6.1493 -1.2761 -1.1659 N.am 1 UNL1 -0.6002 38 C -7.2207 -2.1551 -1.1321 C.2 1 UNL1 0.5826 39 C -6.8842 -3.5592 -0.7748 C.ar 1 UNL1 -0.1275 40 C -7.2864 -4.5796 -1.6352 C.ar 1 UNL1 -0.0959 41 C -7.0121 -5.9048 -1.3033 C.ar 1 UNL1 -0.1590 42 C -6.3495 -6.2021 -0.1129 C.ar 1 UNL1 -0.1226 43 C -5.9613 -5.1776 0.7498 C.ar 1 UNL1 -0.1539 44 C -6.2277 -3.8503 0.4202 C.ar 1 UNL1 -0.1218 45 O -8.3405 -1.7861 -1.4177 O.2 1 UNL1 -0.5054 46 H 8.0426 0.5895 -0.7595 H 1 UNL1 0.1838 47 H 9.0076 -3.7924 1.5460 H 1 UNL1 0.1692 48 H 10.8614 -2.2888 0.8274 H 1 UNL1 0.1749 49 H 6.4498 -4.1970 2.8353 H 1 UNL1 0.1476 50 H 4.9875 -4.5360 1.8510 H 1 UNL1 0.1773 51 H 6.5898 -5.1291 1.3018 H 1 UNL1 0.1506 52 H 5.8518 0.7719 -0.9299 H 1 UNL1 0.1412 53 H 4.7011 -0.9313 -2.4478 H 1 UNL1 0.1482 54 H 3.3984 -1.1188 -1.2603 H 1 UNL1 0.1871 55 H 4.1644 1.5136 -2.7153 H 1 UNL1 0.1103 56 H 2.7175 0.5039 -3.0171 H 1 UNL1 0.1403 57 H 4.2726 2.7179 -0.3800 H 1 UNL1 0.1120 58 H 2.8918 2.4364 0.7202 H 1 UNL1 0.1456 59 H 3.4985 0.0324 0.9721 H 1 UNL1 0.1841 60 H 4.8751 1.0591 1.4168 H 1 UNL1 0.1477 61 H 2.4697 3.5418 -1.8945 H 1 UNL1 0.1184 62 H 1.4482 2.3192 -2.7008 H 1 UNL1 0.1364 63 H 0.2566 1.9894 -0.3854 H 1 UNL1 0.1805 64 H 1.0696 3.4667 0.1474 H 1 UNL1 0.1535 65 H 0.0983 4.7031 -1.9188 H 1 UNL1 0.1697 66 H -0.8308 3.2036 -2.2983 H 1 UNL1 0.1600 67 H -4.1537 5.0225 2.0243 H 1 UNL1 0.1751 68 H -2.2970 6.7069 1.6241 H 1 UNL1 0.1932 69 H -4.3415 2.8086 2.9467 H 1 UNL1 0.1623 70 H -6.0936 1.0888 3.3067 H 1 UNL1 0.1744 71 H -4.5100 2.1112 -1.3019 H 1 UNL1 0.1744 72 H -7.4979 0.3570 -1.3989 H 1 UNL1 0.1919 73 H -5.9327 0.5195 -2.2465 H 1 UNL1 0.1520 74 H -5.2240 -1.5537 -0.8843 H 1 UNL1 0.3151 75 H -7.8199 -4.3368 -2.5556 H 1 UNL1 0.1657 76 H -7.3204 -6.7070 -1.9711 H 1 UNL1 0.1535 77 H -6.1379 -7.2382 0.1459 H 1 UNL1 0.1483 78 H -5.4525 -5.4137 1.6825 H 1 UNL1 0.1538 79 H -5.9355 -3.0516 1.1007 H 1 UNL1 0.1578 @BOND 1 56 16 1 2 55 16 1 3 62 20 1 4 75 40 1 5 53 15 1 6 66 22 1 7 73 36 1 8 16 15 1 9 16 17 1 10 76 41 1 11 65 22 1 12 61 20 1 13 20 17 1 14 20 21 1 15 15 54 1 16 15 14 1 17 40 41 ar 18 40 39 ar 19 22 21 1 20 22 23 1 21 45 38 2 22 72 36 1 23 41 42 ar 24 71 34 1 25 36 37 1 26 36 33 1 27 37 38 am 28 37 74 1 29 17 18 1 30 38 39 1 31 52 14 1 32 39 44 ar 33 46 2 1 34 21 63 1 35 21 64 1 36 14 11 1 37 14 19 1 38 23 24 ar 39 23 28 ar 40 3 1 1 41 57 18 1 42 24 25 ar 43 34 33 ar 44 34 29 ar 45 2 1 ar 46 2 4 ar 47 35 28 2 48 42 77 1 49 42 43 ar 50 33 32 ar 51 18 19 1 52 18 58 1 53 1 8 ar 54 11 4 ar 55 11 10 ar 56 4 6 ar 57 28 27 ar 58 44 43 ar 59 44 79 1 60 19 59 1 61 19 60 1 62 25 29 1 63 25 26 ar 64 10 13 2 65 10 9 ar 66 8 48 1 67 8 7 ar 68 43 78 1 69 29 30 ar 70 6 7 ar 71 6 9 ar 72 7 47 1 73 9 12 1 74 27 26 ar 75 27 68 1 76 32 5 1 77 32 31 ar 78 51 12 1 79 26 67 1 80 12 50 1 81 12 49 1 82 30 31 ar 83 30 69 1 84 31 70 1