@MOLECULE S-[(1R,2S)-2-methylcyclopropyl] 1-methylcyclobutanecarbothioate 28 29 0 0 0 SMALL USER_CHARGES @ATOM 1 C -2.3814 -0.5010 -1.2687 C.3 1 UNL11111111 -0.2737 2 C -3.6162 0.4112 -1.0543 C.3 1 UNL11111111 -0.2773 3 C -3.2154 0.6134 0.4274 C.3 1 UNL11111111 -0.2721 4 C -1.9817 -0.3265 0.2286 C.3 1 UNL11111111 -0.0263 5 C -2.0309 -1.5942 1.0589 C.3 1 UNL11111111 -0.4485 6 C -0.6774 0.3849 0.4558 C.2 1 UNL11111111 0.4190 7 O -0.5544 1.3872 1.0991 O.2 1 UNL11111111 -0.4277 8 S 0.7718 -0.4137 -0.3074 S.3 1 UNL11111111 -0.0933 9 C 2.1111 0.6821 0.1786 C.3 1 UNL11111111 -0.2311 10 H 1.7792 1.4324 0.9138 H 1 UNL11111111 0.1936 11 C 3.1505 1.0879 -0.8376 C.3 1 UNL11111111 -0.3277 12 C 3.5323 0.1554 0.2919 C.3 1 UNL11111111 -0.1089 13 H 4.1362 0.5669 1.1143 H 1 UNL11111111 0.1555 14 C 3.8767 -1.2801 0.0078 C.3 1 UNL11111111 -0.4363 15 H -2.6157 -1.5313 -1.5486 H 1 UNL11111111 0.1483 16 H -1.6626 -0.1135 -1.9964 H 1 UNL11111111 0.1529 17 H -3.6132 1.3255 -1.6535 H 1 UNL11111111 0.1431 18 H -4.5779 -0.0849 -1.2016 H 1 UNL11111111 0.1383 19 H -2.9587 1.6442 0.6961 H 1 UNL11111111 0.1611 20 H -3.9433 0.2514 1.1560 H 1 UNL11111111 0.1443 21 H -3.0202 -2.0673 1.0003 H 1 UNL11111111 0.1571 22 H -1.3022 -2.3438 0.7229 H 1 UNL11111111 0.1618 23 H -1.8330 -1.3914 2.1202 H 1 UNL11111111 0.1581 24 H 3.1065 0.7145 -1.8581 H 1 UNL11111111 0.1672 25 H 3.5124 2.1135 -0.8450 H 1 UNL11111111 0.1611 26 H 4.9649 -1.4195 -0.0483 H 1 UNL11111111 0.1492 27 H 3.5015 -1.9440 0.7998 H 1 UNL11111111 0.1574 28 H 3.4638 -1.6425 -0.9424 H 1 UNL11111111 0.1547 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 1 4 1 5 4 5 1 6 4 6 1 7 6 7 2 8 6 8 1 9 8 9 1 10 9 10 1 11 9 11 1 12 11 12 1 13 12 13 1 14 9 12 1 15 12 14 1 16 1 15 1 17 1 16 1 18 2 17 1 19 2 18 1 20 3 19 1 21 3 20 1 22 5 21 1 23 5 22 1 24 5 23 1 25 11 24 1 26 11 25 1 27 14 26 1 28 14 27 1 29 14 28 1