@MOLECULE (2s)-1-{2-[(4-amino-2,6-dichlorophenyl)amino]-2-oxoethyl}-4-[5,5-bis(4-fluorophenyl)pentyl]-2-piperazinecarboxamide 74 77 0 0 0 SMALL GASTEIGER @ATOM 1 CL -8.4739 2.0847 1.1378 Cl 1 UNL111111111 -0.0623 2 CL -6.0611 -2.4890 -0.2783 Cl 1 UNL111111111 -0.0376 3 F 7.8665 -5.2486 0.7877 F 1 UNL111111111 -0.1741 4 F 10.6001 3.5450 0.5569 F 1 UNL111111111 -0.1736 5 O -2.6389 3.2069 -1.5866 O.2 1 UNL111111111 -0.4595 6 O -5.2364 0.1775 -1.3343 O.2 1 UNL111111111 -0.4158 7 N 0.1298 -0.0554 -0.1236 N.3 1 UNL111111111 -0.4279 8 N -2.6394 0.7760 -0.2089 N.3 1 UNL111111111 -0.3635 9 N -1.3819 4.2151 -0.0326 N.am 1 UNL111111111 -0.7193 10 N -6.1114 0.3254 0.7593 N.am 1 UNL111111111 -0.6075 11 N -11.1015 -2.0435 -0.1808 N.pl3 1 UNL111111111 -0.6149 12 C -1.5412 1.7453 0.0265 C.3 1 UNL111111111 -0.0562 13 C -0.2631 1.2507 -0.7065 C.3 1 UNL111111111 -0.1260 14 C -0.9601 -1.0306 -0.3920 C.3 1 UNL111111111 -0.1252 15 C -2.2518 -0.5569 0.3135 C.3 1 UNL111111111 -0.1229 16 C 1.4107 -0.5390 -0.7025 C.3 1 UNL111111111 -0.1194 17 C 2.5946 0.1858 -0.0332 C.3 1 UNL111111111 -0.2767 18 C 3.9162 -0.3164 -0.6281 C.3 1 UNL111111111 -0.2752 19 C -3.8950 1.2450 0.4174 C.3 1 UNL111111111 -0.2136 20 C 5.1017 0.3760 0.0550 C.3 1 UNL111111111 -0.2697 21 C -1.9197 3.0798 -0.6241 C.2 1 UNL111111111 0.5459 22 C 6.4466 -0.0216 -0.5903 C.3 1 UNL111111111 -0.1272 23 C -5.0948 0.5188 -0.1933 C.2 1 UNL111111111 0.5873 24 C 6.8269 -1.4240 -0.1876 C.ar 1 UNL111111111 -0.0248 25 C 7.5550 0.9416 -0.2454 C.ar 1 UNL111111111 -0.0320 26 C 7.5511 -1.6725 0.9810 C.ar 1 UNL111111111 -0.1245 27 C 8.6220 1.0710 -1.1395 C.ar 1 UNL111111111 -0.1277 28 C 6.4415 -2.4862 -1.0082 C.ar 1 UNL111111111 -0.1373 29 C 7.5452 1.6879 0.9349 C.ar 1 UNL111111111 -0.1348 30 C -7.3591 -0.2463 0.4234 C.ar 1 UNL111111111 0.0494 31 C 7.9081 -2.9729 1.3292 C.ar 1 UNL111111111 -0.2112 32 C 9.6686 1.9500 -0.8777 C.ar 1 UNL111111111 -0.2073 33 C 6.7790 -3.7957 -0.6828 C.ar 1 UNL111111111 -0.2133 34 C 8.5767 2.5802 1.2186 C.ar 1 UNL111111111 -0.2134 35 C 7.5172 -4.0077 0.4809 C.ar 1 UNL111111111 0.1898 36 C 9.6173 2.6942 0.3008 C.ar 1 UNL111111111 0.1896 37 C -8.5537 0.4622 0.6120 C.ar 1 UNL111111111 0.0652 38 C -7.4701 -1.5632 -0.0452 C.ar 1 UNL111111111 0.0931 39 C -9.7996 -0.0982 0.4152 C.ar 1 UNL111111111 -0.3238 40 C -8.6904 -2.1648 -0.2904 C.ar 1 UNL111111111 -0.3262 41 C -9.8693 -1.4345 -0.0337 C.ar 1 UNL111111111 0.2976 42 H -1.3147 1.8630 1.1169 H 1 UNL111111111 0.1412 43 H -0.4640 1.1875 -1.8008 H 1 UNL111111111 0.1511 44 H 0.5596 1.9768 -0.5551 H 1 UNL111111111 0.1358 45 H -0.6644 -2.0189 0.0163 H 1 UNL111111111 0.1373 46 H -1.1588 -1.1575 -1.4812 H 1 UNL111111111 0.1403 47 H -2.1014 -0.5669 1.4157 H 1 UNL111111111 0.1240 48 H -3.0785 -1.2647 0.0729 H 1 UNL111111111 0.1590 49 H 1.4554 -0.4128 -1.8037 H 1 UNL111111111 0.1200 50 H 1.5007 -1.6299 -0.5005 H 1 UNL111111111 0.1396 51 H 2.5049 1.2794 -0.1625 H 1 UNL111111111 0.1386 52 H 2.5636 0.0120 1.0593 H 1 UNL111111111 0.1524 53 H 3.9989 -1.4123 -0.5038 H 1 UNL111111111 0.1447 54 H 3.9367 -0.1275 -1.7185 H 1 UNL111111111 0.1374 55 H -4.0529 2.3284 0.1698 H 1 UNL111111111 0.1883 56 H -3.8794 1.1630 1.5258 H 1 UNL111111111 0.1305 57 H 4.9773 1.4742 -0.0122 H 1 UNL111111111 0.1460 58 H 5.1091 0.1253 1.1328 H 1 UNL111111111 0.1462 59 H 6.3038 0.0118 -1.7066 H 1 UNL111111111 0.1579 60 H -1.5594 5.1108 -0.4445 H 1 UNL111111111 0.3142 61 H -0.7428 4.1800 0.7278 H 1 UNL111111111 0.2994 62 H -6.0395 0.7072 1.6926 H 1 UNL111111111 0.3170 63 H 7.8510 -0.8472 1.6292 H 1 UNL111111111 0.1642 64 H 8.6433 0.4747 -2.0515 H 1 UNL111111111 0.1597 65 H 5.8703 -2.2934 -1.9160 H 1 UNL111111111 0.1563 66 H 6.7291 1.5831 1.6480 H 1 UNL111111111 0.1589 67 H 8.4801 -3.1713 2.2337 H 1 UNL111111111 0.1746 68 H 10.4982 2.0552 -1.5717 H 1 UNL111111111 0.1740 69 H 6.4801 -4.6242 -1.3191 H 1 UNL111111111 0.1720 70 H 8.5641 3.1706 2.1344 H 1 UNL111111111 0.1725 71 H -10.7077 0.4650 0.6000 H 1 UNL111111111 0.1834 72 H -8.7481 -3.1864 -0.6608 H 1 UNL111111111 0.1845 73 H -11.1680 -2.9338 -0.6161 H 1 UNL111111111 0.3029 74 H -11.9332 -1.5005 -0.1362 H 1 UNL111111111 0.3025 @BOND 1 1 37 1 2 2 38 1 3 3 35 1 4 4 36 1 5 5 21 2 6 6 23 2 7 7 13 1 8 7 14 1 9 7 16 1 10 8 12 1 11 8 15 1 12 8 19 1 13 9 21 am 14 9 60 1 15 9 61 1 16 10 23 am 17 10 30 1 18 10 62 1 19 11 41 1 20 11 73 1 21 11 74 1 22 12 13 1 23 12 21 1 24 12 42 1 25 13 43 1 26 13 44 1 27 14 15 1 28 14 45 1 29 14 46 1 30 15 47 1 31 15 48 1 32 16 17 1 33 16 49 1 34 16 50 1 35 17 18 1 36 17 51 1 37 17 52 1 38 18 20 1 39 18 53 1 40 18 54 1 41 19 23 1 42 19 55 1 43 19 56 1 44 20 22 1 45 20 57 1 46 20 58 1 47 22 24 1 48 22 25 1 49 22 59 1 50 24 26 ar 51 24 28 ar 52 25 27 ar 53 25 29 ar 54 26 31 ar 55 26 63 1 56 27 32 ar 57 27 64 1 58 28 33 ar 59 28 65 1 60 29 34 ar 61 29 66 1 62 30 37 ar 63 30 38 ar 64 31 35 ar 65 31 67 1 66 32 36 ar 67 32 68 1 68 33 35 ar 69 33 69 1 70 34 36 ar 71 34 70 1 72 37 39 ar 73 38 40 ar 74 39 41 ar 75 39 71 1 76 40 41 ar 77 40 72 1