@MOLECULE 4-[3-(2,6-dimethyl-4-pyridinyl)phenyl]-7-methyl-8-(trifluoromethyl)-1,3-dihydro-2h-1,5-benzodiazepin-2-one 51 54 0 0 0 SMALL GASTEIGER @ATOM 1 F 6.5110 -1.9431 0.7289 F 1 UNL1111 -0.2037 2 F 7.0879 -0.5636 -0.7437 F 1 UNL1111 -0.2059 3 F 7.1092 -0.0227 1.2987 F 1 UNL1111 -0.2033 4 O -0.3352 -2.6251 -0.4669 O.2 1 UNL1111 -0.4871 5 N 1.6047 -1.6913 0.1381 N.am 1 UNL1111 -0.5574 6 N 1.0205 1.2436 -0.0207 N.2 1 UNL1111 -0.3882 7 N -7.1044 -1.2650 0.5551 N.ar 1 UNL1111 -0.4406 8 C 0.0317 0.7218 -0.6592 C.2 1 UNL1111 0.2530 9 C 2.5980 -0.6905 0.1087 C.ar 1 UNL1111 0.1022 10 C 2.3083 0.6914 0.0003 C.ar 1 UNL1111 0.1362 11 C 0.1455 -0.5198 -1.5068 C.3 1 UNL1111 -0.4340 12 C -1.2987 1.3514 -0.5698 C.ar 1 UNL1111 -0.0538 13 C 4.9665 -0.1698 0.2507 C.ar 1 UNL1111 -0.1532 14 C 4.6930 1.1999 0.1185 C.ar 1 UNL1111 0.0909 15 C 3.9334 -1.1002 0.2417 C.ar 1 UNL1111 -0.1411 16 C 3.3662 1.6110 0.0045 C.ar 1 UNL1111 -0.1822 17 C -3.6787 1.1448 -0.2311 C.ar 1 UNL1111 -0.0297 18 C 0.4215 -1.6895 -0.5967 C.2 1 UNL1111 0.5948 19 C -2.4158 0.5562 -0.3064 C.ar 1 UNL1111 -0.1254 20 C -4.8582 0.3137 0.0417 C.ar 1 UNL1111 0.0807 21 C -1.4360 2.7300 -0.7416 C.ar 1 UNL1111 -0.1031 22 C -3.8201 2.5235 -0.4190 C.ar 1 UNL1111 -0.1212 23 C 6.3802 -0.6615 0.3834 C.3 1 UNL1111 0.5621 24 C 5.7542 2.2434 0.1069 C.3 1 UNL1111 -0.4612 25 C -2.7005 3.3114 -0.6721 C.ar 1 UNL1111 -0.1543 26 C -5.7483 0.6644 1.0574 C.ar 1 UNL1111 -0.3093 27 C -5.0988 -0.8351 -0.7126 C.ar 1 UNL1111 -0.3032 28 C -6.8655 -0.1547 1.2838 C.ar 1 UNL1111 0.2559 29 C -6.2378 -1.6028 -0.4227 C.ar 1 UNL1111 0.2569 30 C -7.8499 0.1705 2.3575 C.3 1 UNL1111 -0.4572 31 C -6.5418 -2.8446 -1.1923 C.3 1 UNL1111 -0.4574 32 H -0.7814 -0.7151 -2.0941 H 1 UNL1111 0.2068 33 H 0.9469 -0.4074 -2.2700 H 1 UNL1111 0.1946 34 H 4.1383 -2.1717 0.3251 H 1 UNL1111 0.1816 35 H 3.1251 2.6751 -0.0717 H 1 UNL1111 0.1833 36 H 1.7909 -2.5115 0.7173 H 1 UNL1111 0.3335 37 H -2.3054 -0.5196 -0.1447 H 1 UNL1111 0.1778 38 H -0.5544 3.3462 -0.9204 H 1 UNL1111 0.1641 39 H -4.8093 2.9783 -0.3689 H 1 UNL1111 0.1584 40 H 6.1630 2.4138 1.1172 H 1 UNL1111 0.1787 41 H 6.5987 1.9942 -0.5519 H 1 UNL1111 0.1738 42 H 5.3813 3.2191 -0.2400 H 1 UNL1111 0.1625 43 H -2.8122 4.3851 -0.8118 H 1 UNL1111 0.1534 44 H -5.5783 1.5432 1.6699 H 1 UNL1111 0.1728 45 H -4.4232 -1.1342 -1.5075 H 1 UNL1111 0.1756 46 H -8.6700 -0.5668 2.3979 H 1 UNL1111 0.1794 47 H -7.3714 0.1771 3.3477 H 1 UNL1111 0.1670 48 H -8.3073 1.1568 2.1965 H 1 UNL1111 0.1638 49 H -5.7242 -3.5760 -1.1077 H 1 UNL1111 0.1699 50 H -7.4587 -3.3382 -0.8283 H 1 UNL1111 0.1787 51 H -6.6920 -2.6275 -2.2592 H 1 UNL1111 0.1642 @BOND 1 1 23 1 2 2 23 1 3 3 23 1 4 4 18 2 5 5 9 1 6 5 18 am 7 5 36 1 8 6 8 2 9 6 10 1 10 7 28 ar 11 7 29 ar 12 8 11 1 13 8 12 1 14 9 10 ar 15 9 15 ar 16 10 16 ar 17 11 18 1 18 11 32 1 19 11 33 1 20 12 19 ar 21 12 21 ar 22 13 14 ar 23 13 15 ar 24 13 23 1 25 14 16 ar 26 14 24 1 27 15 34 1 28 16 35 1 29 17 19 ar 30 17 20 1 31 17 22 ar 32 19 37 1 33 20 26 ar 34 20 27 ar 35 21 25 ar 36 21 38 1 37 22 25 ar 38 22 39 1 39 24 40 1 40 24 41 1 41 24 42 1 42 25 43 1 43 26 28 ar 44 26 44 1 45 27 29 ar 46 27 45 1 47 28 30 1 48 29 31 1 49 30 46 1 50 30 47 1 51 30 48 1 52 31 49 1 53 31 50 1 54 31 51 1