@MOLECULE S-(1,1-dimethylpropyl) (1R,2R)-2-methylcyclopropanecarbothioate 30 30 0 0 0 SMALL USER_CHARGES @ATOM 1 C 3.4391 -0.1728 -0.1686 C.3 1 UNL1 -0.0329 2 H 3.3781 -1.1711 -0.6285 H 1 UNL1 0.0305 3 C 4.6371 -0.0079 0.7232 C.3 1 UNL1 -0.0617 4 C 2.9144 1.0003 -0.9563 C.3 1 UNL1 -0.0392 5 C 2.1211 0.4885 0.2332 C.3 1 UNL1 0.0307 6 H 2.1074 1.0950 1.1479 H 1 UNL1 0.0389 7 C 0.8680 -0.2465 -0.0520 C.2 1 UNL1 0.1932 8 O 0.8200 -1.3185 -0.5889 O.2 1 UNL1 -0.2849 9 S -0.6049 0.6625 0.4720 S.3 1 UNL1 -0.0816 10 C -2.0680 -0.4487 0.0715 C.3 1 UNL1 0.0180 11 C -2.1075 -0.7346 -1.4226 C.3 1 UNL1 -0.0503 12 C -1.9257 -1.7502 0.8576 C.3 1 UNL1 -0.0503 13 C -3.3190 0.3050 0.5558 C.3 1 UNL1 -0.0412 14 C -3.6643 1.5632 -0.2388 C.3 1 UNL1 -0.0640 15 H 4.6971 0.9912 1.1722 H 1 UNL1 0.0233 16 H 4.6198 -0.7341 1.5480 H 1 UNL1 0.0233 17 H 5.5694 -0.1689 0.1644 H 1 UNL1 0.0233 18 H 3.3995 1.9704 -0.8863 H 1 UNL1 0.0275 19 H 2.5317 0.8467 -1.9631 H 1 UNL1 0.0275 20 H -1.2657 -1.3672 -1.7444 H 1 UNL1 0.0243 21 H -3.0263 -1.2716 -1.6931 H 1 UNL1 0.0243 22 H -2.0785 0.1761 -2.0336 H 1 UNL1 0.0243 23 H -1.8731 -1.5891 1.9410 H 1 UNL1 0.0243 24 H -2.7794 -2.4153 0.6716 H 1 UNL1 0.0243 25 H -1.0277 -2.3162 0.5658 H 1 UNL1 0.0243 26 H -4.1807 -0.3957 0.5056 H 1 UNL1 0.0276 27 H -3.2252 0.5591 1.6321 H 1 UNL1 0.0276 28 H -3.8420 1.3407 -1.2970 H 1 UNL1 0.0230 29 H -4.5759 2.0310 0.1525 H 1 UNL1 0.0230 30 H -2.8732 2.3206 -0.1920 H 1 UNL1 0.0230 @BOND 1 1 2 1 2 1 3 1 3 1 4 1 4 4 5 1 5 5 6 1 6 1 5 1 7 5 7 1 8 7 8 2 9 7 9 1 10 9 10 1 11 10 11 1 12 10 12 1 13 10 13 1 14 13 14 1 15 3 15 1 16 3 16 1 17 3 17 1 18 4 18 1 19 4 19 1 20 11 20 1 21 11 21 1 22 11 22 1 23 12 23 1 24 12 24 1 25 12 25 1 26 13 26 1 27 13 27 1 28 14 28 1 29 14 29 1 30 14 30 1