@MOLECULE 2-benzothiazolesulfenamide, n-cyclohexyl 33 35 0 0 0 SMALL GASTEIGER @ATOM 1 S -0.6676 1.4235 0.1596 S.3 1 UNL1111111111 0.3098 2 S 2.4260 1.8246 0.1862 S.2 1 UNL1111111111 0.1432 3 N -1.5803 -0.0932 0.2245 N.3 1 UNL1111111111 -0.6389 4 N 1.2202 -0.4965 -0.0312 N.ar 1 UNL1111111111 -0.3858 5 C -3.0347 0.0227 0.3711 C.3 1 UNL1111111111 0.0929 6 C -3.7431 0.6821 -0.8358 C.3 1 UNL1111111111 -0.3275 7 C -3.5270 -1.4338 0.5729 C.3 1 UNL1111111111 -0.2863 8 C -5.2640 0.6088 -0.6539 C.3 1 UNL1111111111 -0.2613 9 C -5.0465 -1.4761 0.7351 C.3 1 UNL1111111111 -0.2644 10 C -5.7199 -0.8472 -0.4920 C.3 1 UNL1111111111 -0.2670 11 C 0.9575 0.7707 0.1136 C.ar 1 UNL1111111111 0.0026 12 C 3.4260 0.3897 0.0032 C.ar 1 UNL1111111111 -0.1863 13 C 2.5980 -0.7567 -0.0754 C.ar 1 UNL1111111111 0.1191 14 C 4.8058 0.2547 -0.0691 C.ar 1 UNL1111111111 -0.1191 15 C 3.1441 -2.0379 -0.1885 C.ar 1 UNL1111111111 -0.1367 16 C 5.3472 -1.0207 -0.2011 C.ar 1 UNL1111111111 -0.1544 17 C 4.5251 -2.1557 -0.2486 C.ar 1 UNL1111111111 -0.1325 18 H -3.2563 0.6165 1.2976 H 1 UNL1111111111 0.1457 19 H -3.4453 0.1891 -1.7771 H 1 UNL1111111111 0.1450 20 H -3.4296 1.7381 -0.9372 H 1 UNL1111111111 0.1413 21 H -3.0239 -1.8665 1.4595 H 1 UNL1111111111 0.1560 22 H -3.2214 -2.0657 -0.2831 H 1 UNL1111111111 0.1427 23 H -5.7780 1.0728 -1.5137 H 1 UNL1111111111 0.1328 24 H -5.5672 1.1946 0.2345 H 1 UNL1111111111 0.1365 25 H -5.3520 -0.9399 1.6528 H 1 UNL1111111111 0.1375 26 H -5.3880 -2.5204 0.8645 H 1 UNL1111111111 0.1361 27 H -6.8179 -0.8961 -0.3921 H 1 UNL1111111111 0.1318 28 H -5.4688 -1.4267 -1.3999 H 1 UNL1111111111 0.1389 29 H -1.2864 -0.7401 -0.5058 H 1 UNL1111111111 0.2951 30 H 5.4636 1.1192 -0.0242 H 1 UNL1111111111 0.1607 31 H 2.4879 -2.9066 -0.2181 H 1 UNL1111111111 0.1777 32 H 6.4236 -1.1363 -0.2658 H 1 UNL1111111111 0.1564 33 H 4.9799 -3.1429 -0.3323 H 1 UNL1111111111 0.1581 @BOND 1 1 3 1 2 1 11 1 3 2 11 ar 4 2 12 ar 5 3 5 1 6 3 29 1 7 4 11 ar 8 4 13 ar 9 5 6 1 10 5 7 1 11 5 18 1 12 6 8 1 13 6 19 1 14 6 20 1 15 7 9 1 16 7 21 1 17 7 22 1 18 8 10 1 19 8 23 1 20 8 24 1 21 9 10 1 22 9 25 1 23 9 26 1 24 10 27 1 25 10 28 1 26 12 13 ar 27 12 14 ar 28 13 15 ar 29 14 16 ar 30 14 30 1 31 15 17 ar 32 15 31 1 33 16 17 ar 34 16 32 1 35 17 33 1