@MOLECULE n-[(1r)-1-(2,4-dichlorophenyl)-2-(1h-1,2,4-triazol-1-yl)ethyl]-4-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide 53 57 0 0 0 SMALL GASTEIGER @ATOM 1 C 5.1565 0.9354 0.7972 C.ar 1 UNL111111111 0.0336 2 C 5.7848 2.1510 0.5524 C.ar 1 UNL111111111 -0.1944 3 C 5.3981 2.8472 -0.5853 C.ar 1 UNL111111111 0.0438 4 C 4.4340 2.3674 -1.4636 C.ar 1 UNL111111111 -0.1828 5 C 3.8231 1.1475 -1.1833 C.ar 1 UNL111111111 -0.0880 6 C 4.1696 0.4193 -0.0401 C.ar 1 UNL111111111 -0.0650 7 C 3.4847 -0.8906 0.2743 C.3 1 UNL111111111 0.0821 8 C 4.2682 -2.0067 -0.4856 C.3 1 UNL111111111 -0.1046 9 N 3.6393 -3.3093 -0.3354 N.ar 1 UNL111111111 -0.1686 10 N 3.7399 -3.9990 0.8320 N.ar 1 UNL111111111 -0.2562 11 C 2.9643 -5.0977 0.6620 C.ar 1 UNL111111111 0.0726 12 N 2.3628 -5.1051 -0.5928 N.ar 1 UNL111111111 -0.3933 13 C 2.7832 -3.9866 -1.2065 C.ar 1 UNL111111111 0.0571 14 N 2.0758 -0.8705 -0.1560 N.am 1 UNL111111111 -0.6325 15 C 1.2243 0.0728 0.4210 C.2 1 UNL111111111 0.5717 16 O 1.6641 0.9439 1.1365 O.2 1 UNL111111111 -0.4733 17 C -0.2103 -0.0402 0.0456 C.ar 1 UNL111111111 -0.1019 18 C -1.1626 0.1703 1.0433 C.ar 1 UNL111111111 -0.0955 19 C -2.5164 0.1132 0.7258 C.ar 1 UNL111111111 -0.1233 20 C -0.5951 -0.3000 -1.2693 C.ar 1 UNL111111111 -0.1249 21 C -1.9472 -0.3584 -1.5911 C.ar 1 UNL111111111 -0.1119 22 C -2.9057 -0.1491 -0.5924 C.ar 1 UNL111111111 -0.0177 23 C -4.3041 -0.1982 -0.9411 C.ar 1 UNL111111111 0.2048 24 O -5.2209 0.2518 0.0052 O.2 1 UNL111111111 -0.2617 25 N -4.9574 -0.5918 -2.0339 N.ar 1 UNL111111111 -0.2006 26 N -6.2832 -0.4111 -1.8316 N.ar 1 UNL111111111 -0.2119 27 C -6.4598 0.0968 -0.6103 C.ar 1 UNL111111111 0.2322 28 C -7.6295 0.4905 0.1329 C.ar 1 UNL111111111 -0.0636 29 C -8.8949 0.3134 -0.4396 C.ar 1 UNL111111111 -0.0920 30 C -10.0301 0.6930 0.2706 C.ar 1 UNL111111111 -0.1582 31 C -9.9054 1.2452 1.5448 C.ar 1 UNL111111111 -0.1069 32 C -8.6439 1.4211 2.1137 C.ar 1 UNL111111111 -0.1577 33 C -7.5026 1.0463 1.4113 C.ar 1 UNL111111111 -0.1053 34 CL 5.6504 0.0585 2.1738 Cl 1 UNL111111111 -0.0520 35 CL 6.1395 4.3486 -0.9159 Cl 1 UNL111111111 -0.0654 36 H 6.5451 2.5448 1.2304 H 1 UNL111111111 0.1925 37 H 4.1482 2.9337 -2.3506 H 1 UNL111111111 0.1775 38 H 3.0517 0.7649 -1.8553 H 1 UNL111111111 0.1710 39 H 3.5101 -1.1083 1.3835 H 1 UNL111111111 0.1869 40 H 4.3442 -1.7636 -1.5707 H 1 UNL111111111 0.1673 41 H 5.3128 -2.0470 -0.0798 H 1 UNL111111111 0.1917 42 H 2.8224 -5.8772 1.3933 H 1 UNL111111111 0.2079 43 H 2.5421 -3.6707 -2.2058 H 1 UNL111111111 0.1994 44 H 1.7139 -1.7374 -0.5205 H 1 UNL111111111 0.3141 45 H -0.8427 0.3917 2.0651 H 1 UNL111111111 0.1782 46 H -3.2678 0.2761 1.5001 H 1 UNL111111111 0.1722 47 H 0.1537 -0.4434 -2.0483 H 1 UNL111111111 0.1621 48 H -2.2656 -0.5644 -2.6166 H 1 UNL111111111 0.1802 49 H -8.9844 -0.1206 -1.4391 H 1 UNL111111111 0.1773 50 H -11.0163 0.5575 -0.1717 H 1 UNL111111111 0.1590 51 H -10.7959 1.5408 2.0984 H 1 UNL111111111 0.1515 52 H -8.5508 1.8532 3.1092 H 1 UNL111111111 0.1581 53 H -6.5162 1.1865 1.8546 H 1 UNL111111111 0.1647 @BOND 1 1 34 1 2 2 1 ar 3 2 36 1 4 3 2 ar 5 4 5 ar 6 4 3 ar 7 4 37 1 8 5 6 ar 9 5 38 1 10 6 7 1 11 6 1 ar 12 7 39 1 13 8 7 1 14 8 9 1 15 8 40 1 16 8 41 1 17 9 10 ar 18 10 11 ar 19 11 42 1 20 12 11 ar 21 13 9 ar 22 13 12 ar 23 13 43 1 24 14 15 am 25 14 7 1 26 14 44 1 27 15 16 2 28 17 18 ar 29 17 15 1 30 18 45 1 31 19 18 ar 32 19 46 1 33 20 17 ar 34 20 47 1 35 21 22 ar 36 21 20 ar 37 21 48 1 38 22 19 ar 39 23 24 ar 40 23 22 1 41 25 23 ar 42 26 25 ar 43 26 27 ar 44 27 28 1 45 27 24 ar 46 28 29 ar 47 29 30 ar 48 29 49 1 49 30 50 1 50 31 30 ar 51 31 51 1 52 32 31 ar 53 32 52 1 54 33 32 ar 55 33 28 ar 56 33 53 1 57 35 3 1