@MOLECULE 1-[(3s)-5-{4-[(e)-(ethoxyimino)methyl]phenoxy}-3-methylpentyl]-3-(4-pyridinyl)-2-imidazolidinone 60 62 0 0 0 SMALL GASTEIGER @ATOM 1 C 12.1169 0.4249 -1.1192 C.3 1 UNL1111111111 -0.4678 2 C 10.6505 0.1606 -1.4269 C.3 1 UNL1111111111 -0.0438 3 O 9.9927 0.5342 -0.1949 O.2 1 UNL1111111111 -0.1937 4 N 8.6345 0.3638 -0.3709 N.2 1 UNL1111111111 -0.2143 5 C 7.9633 0.6808 0.6916 C.2 1 UNL1111111111 -0.0292 6 C 6.5031 0.5613 0.6869 C.ar 1 UNL1111111111 -0.1021 7 C 5.7883 0.9545 1.8300 C.ar 1 UNL1111111111 -0.0715 8 C 4.4083 0.8486 1.8665 C.ar 1 UNL1111111111 -0.2598 9 C 5.8136 0.0666 -0.4235 C.ar 1 UNL1111111111 -0.0374 10 C 4.4259 -0.0477 -0.4085 C.ar 1 UNL1111111111 -0.3184 11 C 3.7362 0.3413 0.7402 C.ar 1 UNL1111111111 0.2747 12 O 2.3934 0.2859 0.9092 O.3 1 UNL1111111111 -0.3465 13 C 1.6199 -0.3058 -0.1413 C.3 1 UNL1111111111 -0.0393 14 C 0.2102 -0.3547 0.4511 C.3 1 UNL1111111111 -0.3104 15 C -0.6647 -1.3831 -0.2882 C.3 1 UNL1111111111 -0.0674 16 C -0.2664 -2.8088 0.1103 C.3 1 UNL1111111111 -0.4569 17 C -2.1431 -1.1196 0.0493 C.3 1 UNL1111111111 -0.3332 18 C -3.0710 -1.9267 -0.8759 C.3 1 UNL1111111111 -0.0668 19 N -4.4957 -1.7602 -0.5740 N.am 1 UNL1111111111 -0.4786 20 C -5.0736 -0.4952 -0.8106 C.2 1 UNL1111111111 0.6959 21 O -4.7620 0.2561 -1.7005 O.2 1 UNL1111111111 -0.4943 22 C -5.0168 -2.3437 0.6801 C.3 1 UNL1111111111 -0.1098 23 C -6.1906 -1.4085 1.0891 C.3 1 UNL1111111111 -0.0945 24 N -6.1014 -0.2749 0.1418 N.am 1 UNL1111111111 -0.4985 25 C -7.1451 0.6456 0.0157 C.ar 1 UNL1111111111 0.3041 26 C -7.1599 1.5999 -1.0172 C.ar 1 UNL1111111111 -0.3290 27 C -8.2121 2.5144 -1.0644 C.ar 1 UNL1111111111 0.1037 28 N -9.2186 2.5299 -0.1661 N.ar 1 UNL1111111111 -0.4134 29 C -9.1973 1.6193 0.8235 C.ar 1 UNL1111111111 0.1030 30 C -8.1897 0.6598 0.9599 C.ar 1 UNL1111111111 -0.3638 31 H 12.2862 1.4750 -0.8471 H 1 UNL1111111111 0.1588 32 H 12.4671 -0.1876 -0.2784 H 1 UNL1111111111 0.1577 33 H 12.7468 0.1964 -1.9864 H 1 UNL1111111111 0.1553 34 H 10.2650 0.7832 -2.2515 H 1 UNL1111111111 0.1350 35 H 10.4408 -0.9003 -1.6427 H 1 UNL1111111111 0.1331 36 H 8.4246 1.0423 1.6212 H 1 UNL1111111111 0.1585 37 H 6.3220 1.3459 2.6970 H 1 UNL1111111111 0.1540 38 H 6.3714 -0.2342 -1.3151 H 1 UNL1111111111 0.1697 39 H 3.8377 1.1468 2.7421 H 1 UNL1111111111 0.1733 40 H 3.9097 -0.4288 -1.2817 H 1 UNL1111111111 0.1626 41 H 1.6801 0.3385 -1.0350 H 1 UNL1111111111 0.1312 42 H 2.0175 -1.3102 -0.3676 H 1 UNL1111111111 0.1289 43 H 0.2684 -0.6007 1.5312 H 1 UNL1111111111 0.1629 44 H -0.2460 0.6536 0.4083 H 1 UNL1111111111 0.1569 45 H -0.5207 -1.2557 -1.3891 H 1 UNL1111111111 0.1386 46 H -0.4444 -2.9941 1.1757 H 1 UNL1111111111 0.1471 47 H -0.8272 -3.5603 -0.4547 H 1 UNL1111111111 0.1414 48 H 0.7974 -2.9984 -0.0745 H 1 UNL1111111111 0.1480 49 H -2.3382 -1.3592 1.1093 H 1 UNL1111111111 0.1434 50 H -2.3711 -0.0391 -0.0637 H 1 UNL1111111111 0.1622 51 H -2.9191 -1.6111 -1.9389 H 1 UNL1111111111 0.1691 52 H -2.8394 -3.0140 -0.8260 H 1 UNL1111111111 0.1462 53 H -5.3694 -3.3749 0.4648 H 1 UNL1111111111 0.1583 54 H -4.2500 -2.4077 1.4763 H 1 UNL1111111111 0.1429 55 H -7.1669 -1.9301 1.0075 H 1 UNL1111111111 0.1534 56 H -6.0787 -1.0360 2.1287 H 1 UNL1111111111 0.1553 57 H -6.3721 1.6384 -1.7707 H 1 UNL1111111111 0.2092 58 H -8.2277 -0.0400 1.7838 H 1 UNL1111111111 0.1671 59 H -8.2689 3.2774 -1.8515 H 1 UNL1111111111 0.1730 60 H -10.0319 1.6704 1.5335 H 1 UNL1111111111 0.1661 @BOND 1 1 2 1 2 1 31 1 3 1 32 1 4 1 33 1 5 2 3 1 6 2 34 1 7 2 35 1 8 3 4 1 9 4 5 2 10 5 6 1 11 5 36 1 12 6 7 ar 13 6 9 ar 14 7 8 ar 15 7 37 1 16 8 11 ar 17 8 39 1 18 9 10 ar 19 9 38 1 20 10 11 ar 21 10 40 1 22 11 12 1 23 12 13 1 24 13 14 1 25 13 41 1 26 13 42 1 27 14 15 1 28 14 43 1 29 14 44 1 30 15 16 1 31 15 17 1 32 15 45 1 33 16 46 1 34 16 47 1 35 16 48 1 36 17 18 1 37 17 49 1 38 17 50 1 39 18 19 1 40 18 51 1 41 18 52 1 42 19 20 am 43 19 22 1 44 20 21 2 45 20 24 am 46 22 23 1 47 22 53 1 48 22 54 1 49 23 24 1 50 23 55 1 51 23 56 1 52 24 25 1 53 25 26 ar 54 25 30 ar 55 26 27 ar 56 26 57 1 57 27 28 ar 58 27 59 1 59 28 29 ar 60 29 30 ar 61 29 60 1 62 30 58 1