@MOLECULE N-oxo-3-[(3S)-3-(phenylsulfanylmethyl)-1,2-dihydrotriazol-5-yl]benzamide 37 39 0 0 0 SMALL GASTEIGER @ATOM 1 S -3.6923 -1.0120 0.3456 S.3 1 UNL111111111 -0.0764 2 O 4.6577 -0.6402 0.5286 O.2 1 UNL111111111 -0.3974 3 O 3.8677 -1.4027 -2.1977 O.2 1 UNL111111111 -0.0348 4 N -2.8921 1.0921 -1.3701 N.pl3 1 UNL111111111 -0.2216 5 N -1.8758 2.2797 0.3610 N.pl3 1 UNL111111111 -0.3515 6 N -3.0968 2.1052 -0.3741 N.3 1 UNL111111111 -0.1558 7 N 3.2899 -1.3984 -1.1693 N.am 1 UNL111111111 -0.0440 8 C -0.8731 1.5516 -0.3847 C.2 1 UNL111111111 0.0447 9 C -1.4688 0.8663 -1.3965 C.2 1 UNL111111111 -0.1028 10 C 0.5223 1.6578 -0.0131 C.ar 1 UNL111111111 -0.0364 11 C -3.6918 -0.1367 -1.2889 C.3 1 UNL111111111 -0.1997 12 C 1.3884 0.5923 -0.2756 C.ar 1 UNL111111111 -0.0910 13 C 1.0073 2.8147 0.6094 C.ar 1 UNL111111111 -0.0762 14 C 2.7263 0.6812 0.1062 C.ar 1 UNL111111111 -0.1520 15 C 2.3439 2.8944 0.9908 C.ar 1 UNL111111111 -0.1714 16 C 3.2048 1.8267 0.7490 C.ar 1 UNL111111111 -0.0693 17 C -2.0170 -1.5413 0.5881 C.ar 1 UNL111111111 -0.0929 18 C -1.3187 -2.2418 -0.3930 C.ar 1 UNL111111111 -0.1511 19 C -1.4299 -1.2707 1.8233 C.ar 1 UNL111111111 -0.1504 20 C 3.6726 -0.4226 -0.1278 C.2 1 UNL111111111 0.4295 21 C -0.0159 -2.6661 -0.1368 C.ar 1 UNL111111111 -0.1384 22 C -0.1274 -1.6997 2.0732 C.ar 1 UNL111111111 -0.1390 23 C 0.5790 -2.3962 1.0947 C.ar 1 UNL111111111 -0.1283 24 H -1.0491 0.2758 -2.1880 H 1 UNL111111111 0.1844 25 H -1.9072 2.0240 1.3539 H 1 UNL111111111 0.2498 26 H -3.8895 1.8892 0.2558 H 1 UNL111111111 0.2356 27 H -3.3815 -0.8242 -2.1027 H 1 UNL111111111 0.1697 28 H -4.7595 0.1275 -1.4759 H 1 UNL111111111 0.1809 29 H 1.0047 -0.3111 -0.7567 H 1 UNL111111111 0.1736 30 H 0.3303 3.6558 0.7851 H 1 UNL111111111 0.1765 31 H 2.7151 3.7930 1.4819 H 1 UNL111111111 0.1613 32 H 4.2507 1.8782 1.0607 H 1 UNL111111111 0.1682 33 H -1.7753 -2.4756 -1.3543 H 1 UNL111111111 0.1567 34 H -1.9719 -0.7339 2.6016 H 1 UNL111111111 0.1593 35 H 0.5383 -3.2135 -0.9000 H 1 UNL111111111 0.1659 36 H 0.3383 -1.4882 3.0357 H 1 UNL111111111 0.1603 37 H 1.5977 -2.7322 1.2928 H 1 UNL111111111 0.1641 @BOND 1 1 11 1 2 1 17 1 3 2 20 2 4 3 7 2 5 4 6 1 6 4 9 1 7 4 11 1 8 5 6 1 9 5 8 1 10 5 25 1 11 6 26 1 12 7 20 1 13 8 9 2 14 8 10 1 15 9 24 1 16 10 12 ar 17 10 13 ar 18 11 27 1 19 11 28 1 20 12 14 ar 21 12 29 1 22 13 15 ar 23 13 30 1 24 14 16 ar 25 14 20 1 26 15 16 ar 27 15 31 1 28 16 32 1 29 17 18 ar 30 17 19 ar 31 18 21 ar 32 18 33 1 33 19 22 ar 34 19 34 1 35 21 23 ar 36 21 35 1 37 22 23 ar 38 22 36 1 39 23 37 1