@MOLECULE methyl 2-{4-[4,4-bis(4-fluorophenyl)butyl]-1-piperazinyl}nicotinate 63 66 0 0 0 SMALL GASTEIGER @ATOM 1 F 3.1813 4.7667 2.1305 F 1 UNL1111111111 -0.1776 2 F 6.9499 -3.6137 0.9917 F 1 UNL1111111111 -0.1767 3 O -6.5527 1.4388 -0.2736 O.3 1 UNL1111111111 -0.4205 4 O -5.2783 0.2931 -1.7242 O.2 1 UNL1111111111 -0.4518 5 N -0.8109 -0.4606 -1.5644 N.3 1 UNL1111111111 -0.4210 6 N -3.2136 -0.8142 -0.1275 N.pl3 1 UNL1111111111 -0.4446 7 N -4.0705 -1.9331 1.8179 N.ar 1 UNL1111111111 -0.4516 8 C -1.7796 -1.5255 -1.9277 C.3 1 UNL1111111111 -0.1213 9 C -1.5222 0.6942 -0.9604 C.3 1 UNL1111111111 -0.1162 10 C -0.0334 -0.0423 -2.7578 C.3 1 UNL1111111111 -0.1199 11 C -2.4962 -2.0025 -0.6407 C.3 1 UNL1111111111 -0.0879 12 C -2.2434 0.2119 0.3220 C.3 1 UNL1111111111 -0.0937 13 C 1.2847 0.6147 -2.3131 C.3 1 UNL1111111111 -0.2732 14 C 2.1258 -0.3780 -1.5026 C.3 1 UNL1111111111 -0.2657 15 C 3.4879 0.2280 -1.1246 C.3 1 UNL1111111111 -0.1316 16 C -4.2647 -1.0742 0.7894 C.ar 1 UNL1111111111 0.3902 17 C 3.3945 1.4187 -0.2033 C.ar 1 UNL1111111111 -0.0176 18 C 4.4011 -0.7962 -0.4989 C.ar 1 UNL1111111111 -0.0246 19 C -5.5111 -0.4442 0.5693 C.ar 1 UNL1111111111 -0.2464 20 C 4.3814 2.4045 -0.2965 C.ar 1 UNL1111111111 -0.1401 21 C 5.7794 -0.6764 -0.7069 C.ar 1 UNL1111111111 -0.1368 22 C 2.3620 1.5598 0.7264 C.ar 1 UNL1111111111 -0.1203 23 C 3.9038 -1.8552 0.2632 C.ar 1 UNL1111111111 -0.1216 24 C -6.5484 -0.6833 1.4705 C.ar 1 UNL1111111111 -0.0056 25 C 4.3274 3.5483 0.4973 C.ar 1 UNL1111111111 -0.2124 26 C 6.6612 -1.6229 -0.1995 C.ar 1 UNL1111111111 -0.2117 27 C 2.2809 2.6958 1.5278 C.ar 1 UNL1111111111 -0.2134 28 C 4.7639 -2.8205 0.7775 C.ar 1 UNL1111111111 -0.2156 29 C -5.0872 -2.1703 2.6648 C.ar 1 UNL1111111111 0.1135 30 C -5.7114 0.4132 -0.6107 C.2 1 UNL1111111111 0.6121 31 C -6.3395 -1.5543 2.5368 C.ar 1 UNL1111111111 -0.2870 32 C 3.2627 3.6724 1.3863 C.ar 1 UNL1111111111 0.1842 33 C 6.1270 -2.6863 0.5233 C.ar 1 UNL1111111111 0.1892 34 C -6.8570 2.3467 -1.3307 C.3 1 UNL1111111111 -0.1647 35 H -2.5394 -1.1828 -2.6668 H 1 UNL1111111111 0.1397 36 H -1.2248 -2.3739 -2.3771 H 1 UNL1111111111 0.1343 37 H -0.7826 1.4773 -0.6977 H 1 UNL1111111111 0.1398 38 H -2.2691 1.1491 -1.6504 H 1 UNL1111111111 0.1361 39 H -0.5999 0.6481 -3.4179 H 1 UNL1111111111 0.1159 40 H 0.2004 -0.9435 -3.3692 H 1 UNL1111111111 0.1357 41 H -3.2246 -2.8029 -0.8804 H 1 UNL1111111111 0.1415 42 H -1.7654 -2.4139 0.0876 H 1 UNL1111111111 0.1444 43 H -1.5087 -0.1932 1.0525 H 1 UNL1111111111 0.1439 44 H -2.7757 1.0540 0.8054 H 1 UNL1111111111 0.1362 45 H 1.8391 0.9652 -3.2026 H 1 UNL1111111111 0.1327 46 H 1.0845 1.5151 -1.7005 H 1 UNL1111111111 0.1463 47 H 1.5485 -0.6873 -0.6060 H 1 UNL1111111111 0.1660 48 H 2.2832 -1.3104 -2.0795 H 1 UNL1111111111 0.1444 49 H 3.9562 0.5710 -2.0906 H 1 UNL1111111111 0.1540 50 H 5.2089 2.2856 -0.9946 H 1 UNL1111111111 0.1530 51 H 6.1725 0.1699 -1.2717 H 1 UNL1111111111 0.1538 52 H 1.6048 0.7803 0.8241 H 1 UNL1111111111 0.1684 53 H 2.8329 -1.9373 0.4622 H 1 UNL1111111111 0.1659 54 H -7.5163 -0.1925 1.3331 H 1 UNL1111111111 0.1741 55 H 5.0940 4.3163 0.4190 H 1 UNL1111111111 0.1711 56 H 7.7328 -1.5326 -0.3673 H 1 UNL1111111111 0.1720 57 H 1.4687 2.8114 2.2427 H 1 UNL1111111111 0.1735 58 H 4.3775 -3.6563 1.3562 H 1 UNL1111111111 0.1722 59 H -4.8718 -2.8781 3.4762 H 1 UNL1111111111 0.1724 60 H -7.1265 -1.7554 3.2584 H 1 UNL1111111111 0.1743 61 H -7.5981 3.0165 -0.8801 H 1 UNL1111111111 0.1413 62 H -7.2739 1.8093 -2.1893 H 1 UNL1111111111 0.1399 63 H -5.9512 2.8889 -1.6220 H 1 UNL1111111111 0.1386 @BOND 1 1 32 1 2 2 33 1 3 3 30 1 4 3 34 1 5 4 30 2 6 5 8 1 7 5 9 1 8 5 10 1 9 6 11 1 10 6 12 1 11 6 16 1 12 7 16 ar 13 7 29 ar 14 8 11 1 15 8 35 1 16 8 36 1 17 9 12 1 18 9 37 1 19 9 38 1 20 10 13 1 21 10 39 1 22 10 40 1 23 11 41 1 24 11 42 1 25 12 43 1 26 12 44 1 27 13 14 1 28 13 45 1 29 13 46 1 30 14 15 1 31 14 47 1 32 14 48 1 33 15 17 1 34 15 18 1 35 15 49 1 36 16 19 ar 37 17 20 ar 38 17 22 ar 39 18 21 ar 40 18 23 ar 41 19 24 ar 42 19 30 1 43 20 25 ar 44 20 50 1 45 21 26 ar 46 21 51 1 47 22 27 ar 48 22 52 1 49 23 28 ar 50 23 53 1 51 24 31 ar 52 24 54 1 53 25 32 ar 54 25 55 1 55 26 33 ar 56 26 56 1 57 27 32 ar 58 27 57 1 59 28 33 ar 60 28 58 1 61 29 31 ar 62 29 59 1 63 31 60 1 64 34 61 1 65 34 62 1 66 34 63 1