@MOLECULE n-[6-(~18~f)fluoro-2-pyridinyl]-n-{2-[4-(2-methoxyphenyl)-1-piperazinyl]ethyl}cyclohexanecarboxamide 65 68 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 F -3.7519 4.4723 -0.1097 F 1 UNL1 -0.1454 2 C 5.2617 -1.0371 1.0812 C.ar 1 UNL1 -0.1993 3 C -5.4530 0.8409 0.3390 C.ar 1 UNL1 -0.2898 4 C 7.0361 0.7318 -0.1620 C.ar 1 UNL1 -0.2672 5 C 6.6424 -1.2227 1.1995 C.ar 1 UNL1 -0.1745 6 C -6.2854 1.9412 0.1708 C.ar 1 UNL1 -0.0216 7 C 7.5227 -0.3467 0.5825 C.ar 1 UNL1 -0.1237 8 C -5.7446 3.2174 0.0094 C.ar 1 UNL1 -0.3305 9 C -0.8504 0.7476 -0.1710 C.3 1 UNL1 -0.1455 10 C -1.7888 0.3368 0.9946 C.3 1 UNL1 -0.0620 11 C 5.9187 2.8208 -1.6718 C.3 1 UNL1 -0.2138 12 C 4.7443 0.0196 0.3335 C.ar 1 UNL1 0.0873 13 C -4.0545 1.0336 0.3272 C.ar 1 UNL1 0.4129 14 C 5.6654 0.9126 -0.2860 C.ar 1 UNL1 0.1881 15 C -4.3503 3.3029 0.0294 C.ar 1 UNL1 0.3868 16 O -4.4717 -1.4681 -0.5992 O.2 1 UNL1 -0.5103 17 C -3.0100 -3.6153 0.6547 C.3 1 UNL1 -0.2626 18 C -1.8925 -2.6912 -1.4153 C.3 1 UNL1 -0.2654 19 C -2.0142 -4.7808 0.6681 C.3 1 UNL1 -0.2633 20 C -0.9012 -3.8603 -1.4027 C.3 1 UNL1 -0.2559 21 C -1.5371 -5.0977 -0.7556 C.3 1 UNL1 -0.2657 22 C 1.3984 1.6856 0.0810 C.3 1 UNL1 -0.1086 23 C 1.1246 -0.6901 -0.3305 C.3 1 UNL1 -0.1162 24 C 2.7878 1.4137 0.7049 C.3 1 UNL1 -0.1071 25 C 2.4993 -0.9699 0.3257 C.3 1 UNL1 -0.1106 26 C -3.4012 -1.2813 -0.0646 C.2 1 UNL1 0.5736 27 O 5.0669 1.9222 -0.9746 O.3 1 UNL1 -0.2858 28 C -2.3551 -2.3777 0.0184 C.3 1 UNL1 -0.1748 29 N 0.5284 0.5069 0.3090 N.3 1 UNL1 -0.4252 30 N 3.3614 0.2038 0.0658 N.pl3 1 UNL1 -0.4071 31 N -3.5042 2.2708 0.1759 N.ar 1 UNL1 -0.4949 32 N -3.1364 -0.0234 0.5139 N.am 1 UNL1 -0.4936 33 H -1.4724 -2.0835 0.6349 H 1 UNL1 0.1646 34 H -3.9201 -3.8957 0.0854 H 1 UNL1 0.1607 35 H -3.3518 -3.3872 1.6805 H 1 UNL1 0.1372 36 H -1.4317 -1.8008 -1.8809 H 1 UNL1 0.1369 37 H -2.7704 -2.9441 -2.0455 H 1 UNL1 0.1612 38 H -1.1491 -4.5370 1.3126 H 1 UNL1 0.1369 39 H -2.4850 -5.6744 1.1171 H 1 UNL1 0.1312 40 H -0.5818 -4.0944 -2.4356 H 1 UNL1 0.1357 41 H 0.0188 -3.5810 -0.8560 H 1 UNL1 0.1349 42 H -0.8135 -5.9320 -0.7374 H 1 UNL1 0.1284 43 H -2.3894 -5.4475 -1.3684 H 1 UNL1 0.1392 44 H -1.1004 0.1894 -1.0944 H 1 UNL1 0.1293 45 H -1.0291 1.8194 -0.4162 H 1 UNL1 0.1673 46 H 0.9390 2.5648 0.5826 H 1 UNL1 0.1439 47 H 1.5174 1.9295 -0.9967 H 1 UNL1 0.1309 48 H 1.2572 -0.5708 -1.4280 H 1 UNL1 0.1324 49 H 0.4550 -1.5584 -0.1588 H 1 UNL1 0.1327 50 H -1.3601 -0.5128 1.5719 H 1 UNL1 0.1551 51 H -1.8680 1.1794 1.7216 H 1 UNL1 0.1697 52 H 3.4532 2.2839 0.5187 H 1 UNL1 0.1507 53 H 2.6936 1.2951 1.8063 H 1 UNL1 0.1309 54 H 2.3631 -1.1748 1.4093 H 1 UNL1 0.1307 55 H 2.9565 -1.8671 -0.1428 H 1 UNL1 0.1393 56 H 4.5938 -1.7295 1.5891 H 1 UNL1 0.1559 57 H -5.8732 -0.1573 0.4679 H 1 UNL1 0.2044 58 H 7.7373 1.4090 -0.6385 H 1 UNL1 0.1607 59 H 7.0206 -2.0592 1.7826 H 1 UNL1 0.1517 60 H -7.3693 1.8065 0.1677 H 1 UNL1 0.1633 61 H 8.5969 -0.4924 0.6745 H 1 UNL1 0.1487 62 H -6.3719 4.0917 -0.1255 H 1 UNL1 0.1868 63 H 5.1936 3.4904 -2.1554 H 1 UNL1 0.1540 64 H 6.5551 3.3784 -0.9788 H 1 UNL1 0.1315 65 H 6.5108 2.2958 -2.4278 H 1 UNL1 0.1350 @BOND 1 40 20 1 2 65 11 1 3 63 11 1 4 37 18 1 5 36 18 1 6 11 64 1 7 11 27 1 8 48 23 1 9 18 20 1 10 18 28 1 11 20 41 1 12 20 21 1 13 43 21 1 14 44 9 1 15 47 22 1 16 27 14 1 17 21 42 1 18 21 19 1 19 58 4 1 20 16 26 2 21 45 9 1 22 23 49 1 23 23 29 1 24 23 25 1 25 14 4 ar 26 14 12 ar 27 9 29 1 28 9 10 1 29 4 7 ar 30 55 25 1 31 62 8 1 32 1 15 1 33 26 28 1 34 26 32 am 35 8 15 ar 36 8 6 ar 37 28 33 1 38 28 17 1 39 15 31 ar 40 30 25 1 41 30 12 1 42 30 24 1 43 22 29 1 44 22 46 1 45 22 24 1 46 34 17 1 47 60 6 1 48 6 3 ar 49 31 13 ar 50 25 54 1 51 13 3 ar 52 13 32 1 53 12 2 ar 54 3 57 1 55 32 10 1 56 52 24 1 57 7 61 1 58 7 5 ar 59 17 19 1 60 17 35 1 61 19 39 1 62 19 38 1 63 24 53 1 64 10 50 1 65 10 51 1 66 2 5 ar 67 2 56 1 68 5 59 1