@MOLECULE (3e)-1-[(1s)-1-(4-fluorphenyl)ethyl]-3-[3-methoxy-4-(4-methyl-1h-imidazol-1-yl)benzyliden]piperidin-2-on 57 60 0 0 0 SMALL GASTEIGER @ATOM 1 F -8.0504 2.6875 0.8046 F 1 UNL1111111111 -0.1741 2 O -2.3022 -1.0599 -2.1944 O.2 1 UNL1111111111 -0.5631 3 O 4.5825 -1.7865 0.4518 O.3 1 UNL1111111111 -0.3413 4 N -3.1290 -1.0225 -0.1073 N.am 1 UNL1111111111 -0.5087 5 N 5.6312 0.8006 -0.0786 N.ar 1 UNL1111111111 -0.2477 6 N 7.4085 2.0053 0.5698 N.ar 1 UNL1111111111 -0.3893 7 C -2.9909 -0.7134 1.3206 C.3 1 UNL1111111111 -0.0585 8 C -1.5482 -0.9448 1.7910 C.3 1 UNL1111111111 -0.2925 9 C -4.4712 -1.3753 -0.6069 C.3 1 UNL1111111111 0.1040 10 C -0.5941 -0.1194 0.9257 C.3 1 UNL1111111111 -0.2693 11 C -0.7363 -0.5076 -0.5077 C.2 1 UNL1111111111 -0.0929 12 C -2.0953 -0.8703 -1.0048 C.2 1 UNL1111111111 0.5764 13 C -5.4593 -0.3040 -0.1943 C.ar 1 UNL1111111111 -0.0819 14 C -4.8575 -2.7878 -0.1452 C.3 1 UNL1111111111 -0.4704 15 C 0.2779 -0.5417 -1.3835 C.2 1 UNL1111111111 -0.1249 16 C 1.6601 -0.2085 -1.0406 C.ar 1 UNL1111111111 0.0146 17 C -5.4674 0.8891 -0.9260 C.ar 1 UNL1111111111 -0.1068 18 C -6.3345 -0.4704 0.8778 C.ar 1 UNL1111111111 -0.1159 19 C 2.4681 -1.1459 -0.3971 C.ar 1 UNL1111111111 -0.1943 20 C 2.1700 1.0507 -1.3720 C.ar 1 UNL1111111111 -0.1504 21 C -6.3436 1.9174 -0.5961 C.ar 1 UNL1111111111 -0.2179 22 C -7.2255 0.5432 1.2279 C.ar 1 UNL1111111111 -0.2254 23 C 4.3048 0.4576 -0.4027 C.ar 1 UNL1111111111 0.0695 24 C 3.7818 -0.8088 -0.0804 C.ar 1 UNL1111111111 0.1700 25 C -7.2086 1.7175 0.4796 C.ar 1 UNL1111111111 0.2013 26 C 3.4822 1.3839 -1.0584 C.ar 1 UNL1111111111 -0.1602 27 C 6.7383 -0.0540 -0.1283 C.ar 1 UNL1111111111 -0.1488 28 C 6.0896 2.0549 0.3511 C.ar 1 UNL1111111111 0.0721 29 C 7.8330 0.7107 0.2749 C.ar 1 UNL1111111111 0.0888 30 C 4.7264 -1.6825 1.8673 C.3 1 UNL1111111111 -0.1954 31 C 9.2465 0.3110 0.3927 C.3 1 UNL1111111111 -0.4208 32 H -3.6915 -1.3505 1.9051 H 1 UNL1111111111 0.1409 33 H -3.2936 0.3458 1.4996 H 1 UNL1111111111 0.1407 34 H -1.2897 -2.0199 1.7252 H 1 UNL1111111111 0.1557 35 H -1.4495 -0.6710 2.8572 H 1 UNL1111111111 0.1479 36 H -4.4226 -1.3955 -1.7428 H 1 UNL1111111111 0.1883 37 H 0.4517 -0.2503 1.2761 H 1 UNL1111111111 0.1599 38 H -0.8063 0.9666 1.0424 H 1 UNL1111111111 0.1596 39 H -4.8288 -2.9045 0.9418 H 1 UNL1111111111 0.1463 40 H -4.1617 -3.5280 -0.5644 H 1 UNL1111111111 0.1637 41 H -5.8645 -3.0473 -0.4922 H 1 UNL1111111111 0.1587 42 H 0.1129 -0.8249 -2.4333 H 1 UNL1111111111 0.1952 43 H -4.7761 1.0144 -1.7639 H 1 UNL1111111111 0.1700 44 H -6.3358 -1.3963 1.4519 H 1 UNL1111111111 0.1570 45 H 2.0919 -2.1379 -0.1471 H 1 UNL1111111111 0.1817 46 H 1.5330 1.7737 -1.8839 H 1 UNL1111111111 0.1708 47 H -6.3539 2.8469 -1.1632 H 1 UNL1111111111 0.1765 48 H -7.9121 0.4146 2.0616 H 1 UNL1111111111 0.1723 49 H 3.8780 2.3616 -1.3356 H 1 UNL1111111111 0.1703 50 H 6.6657 -1.0774 -0.4350 H 1 UNL1111111111 0.1940 51 H 5.4525 2.9093 0.4892 H 1 UNL1111111111 0.1871 52 H 5.2251 -0.7477 2.1424 H 1 UNL1111111111 0.1390 53 H 5.3666 -2.5435 2.1014 H 1 UNL1111111111 0.1557 54 H 3.7544 -1.7739 2.3595 H 1 UNL1111111111 0.1304 55 H 9.7679 0.4079 -0.5738 H 1 UNL1111111111 0.1644 56 H 9.7868 0.9537 1.1089 H 1 UNL1111111111 0.1730 57 H 9.3547 -0.7291 0.7297 H 1 UNL1111111111 0.1546 @BOND 1 1 25 1 2 2 12 2 3 3 24 1 4 3 30 1 5 4 7 1 6 4 9 1 7 4 12 am 8 5 23 1 9 5 27 ar 10 5 28 ar 11 6 28 ar 12 6 29 ar 13 7 8 1 14 7 32 1 15 7 33 1 16 8 10 1 17 8 34 1 18 8 35 1 19 9 13 1 20 9 14 1 21 9 36 1 22 10 11 1 23 10 37 1 24 10 38 1 25 11 12 1 26 11 15 2 27 13 17 ar 28 13 18 ar 29 14 39 1 30 14 40 1 31 14 41 1 32 15 16 1 33 15 42 1 34 16 19 ar 35 16 20 ar 36 17 21 ar 37 17 43 1 38 18 22 ar 39 18 44 1 40 19 24 ar 41 19 45 1 42 20 26 ar 43 20 46 1 44 21 25 ar 45 21 47 1 46 22 25 ar 47 22 48 1 48 23 24 ar 49 23 26 ar 50 26 49 1 51 27 29 ar 52 27 50 1 53 28 51 1 54 29 31 1 55 30 52 1 56 30 53 1 57 30 54 1 58 31 55 1 59 31 56 1 60 31 57 1