@MOLECULE 1-benzoyl-4-(2-tolyl)thiosemicarbazide 35 36 0 0 0 SMALL GASTEIGER @ATOM 1 S -2.3136 2.5045 0.2367 S.2 1 UNL1111111111 -0.4561 2 O 1.6488 1.0378 1.4985 O.2 1 UNL1111111111 -0.4640 3 N -1.2701 0.1554 -0.5751 N.am 1 UNL1111111111 -0.4692 4 N 0.1632 2.0531 -0.5373 N.am 1 UNL1111111111 -0.3371 5 N 1.2367 1.1601 -0.7263 N.am 1 UNL1111111111 -0.5060 6 C -2.5142 -0.5173 -0.3459 C.ar 1 UNL1111111111 0.1134 7 C -2.6119 -1.4518 0.6984 C.ar 1 UNL1111111111 0.0200 8 C -3.5967 -0.2526 -1.1891 C.ar 1 UNL1111111111 -0.1262 9 C -3.8207 -2.1282 0.8710 C.ar 1 UNL1111111111 -0.1718 10 C -1.4620 -1.7107 1.6070 C.3 1 UNL1111111111 -0.4545 11 C -4.7929 -0.9354 -0.9936 C.ar 1 UNL1111111111 -0.1564 12 C -4.9032 -1.8717 0.0330 C.ar 1 UNL1111111111 -0.1295 13 C 3.2344 -0.0033 0.0468 C.ar 1 UNL1111111111 -0.1459 14 C -1.1032 1.4692 -0.2704 C.2 1 UNL1111111111 0.4464 15 C 2.0193 0.7753 0.3782 C.2 1 UNL1111111111 0.5453 16 C 4.4053 0.2938 0.7455 C.ar 1 UNL1111111111 -0.0861 17 C 3.2103 -1.0278 -0.8998 C.ar 1 UNL1111111111 -0.1140 18 C 5.5672 -0.4264 0.4757 C.ar 1 UNL1111111111 -0.1574 19 C 4.3738 -1.7470 -1.1611 C.ar 1 UNL1111111111 -0.1562 20 C 5.5513 -1.4434 -0.4775 C.ar 1 UNL1111111111 -0.1099 21 H -3.5056 0.4891 -1.9840 H 1 UNL1111111111 0.1738 22 H -3.9206 -2.8560 1.6746 H 1 UNL1111111111 0.1565 23 H -0.4707 -0.4362 -0.7837 H 1 UNL1111111111 0.3214 24 H -0.6430 -2.2334 1.0937 H 1 UNL1111111111 0.1554 25 H -1.0469 -0.7719 2.0145 H 1 UNL1111111111 0.1791 26 H -1.7390 -2.3254 2.4754 H 1 UNL1111111111 0.1633 27 H -5.6447 -0.7303 -1.6394 H 1 UNL1111111111 0.1563 28 H -5.8423 -2.4012 0.1853 H 1 UNL1111111111 0.1505 29 H 0.4135 2.8345 0.1001 H 1 UNL1111111111 0.3283 30 H 4.4054 1.0805 1.5033 H 1 UNL1111111111 0.1711 31 H 2.2892 -1.2751 -1.4262 H 1 UNL1111111111 0.1557 32 H 1.6229 1.2418 -1.6651 H 1 UNL1111111111 0.3345 33 H 6.4858 -0.1967 1.0144 H 1 UNL1111111111 0.1599 34 H 4.3640 -2.5481 -1.8986 H 1 UNL1111111111 0.1569 35 H 6.4603 -2.0063 -0.6870 H 1 UNL1111111111 0.1528 @BOND 1 1 14 2 2 2 15 2 3 3 6 1 4 3 14 1 5 3 23 1 6 4 5 1 7 4 14 1 8 4 29 1 9 5 15 am 10 5 32 1 11 6 7 ar 12 6 8 ar 13 7 9 ar 14 7 10 1 15 8 11 ar 16 8 21 1 17 9 12 ar 18 9 22 1 19 10 24 1 20 10 25 1 21 10 26 1 22 11 12 ar 23 11 27 1 24 12 28 1 25 13 15 1 26 13 16 ar 27 13 17 ar 28 16 18 ar 29 16 30 1 30 17 19 ar 31 17 31 1 32 18 20 ar 33 18 33 1 34 19 20 ar 35 19 34 1 36 20 35 1