@MOLECULE S-[(1R)-2,2-dimethylcyclopropyl] (1S,2R)-2-methylcyclobutanecarbothioate 31 32 0 0 0 SMALL USER_CHARGES @ATOM 1 C -3.0899 0.8618 -0.2386 C.3 1 UNL1 -0.0335 2 H -3.3725 1.5470 -1.0576 H 1 UNL1 0.0305 3 C -2.5762 1.6391 0.9532 C.3 1 UNL1 -0.0617 4 C -4.2064 -0.1710 0.0968 C.3 1 UNL1 -0.0491 5 C -3.3031 -1.3241 -0.4016 C.3 1 UNL1 -0.0422 6 C -2.1805 -0.3086 -0.7643 C.3 1 UNL1 0.0304 7 H -2.0058 -0.2437 -1.8543 H 1 UNL1 0.0389 8 C -0.9203 -0.5116 0.0033 C.2 1 UNL1 0.1930 9 O -0.8106 -1.1728 0.9960 O.2 1 UNL1 -0.2849 10 S 0.5241 0.3364 -0.7155 S.3 1 UNL1 -0.0839 11 C 1.8230 -0.0722 0.4551 C.3 1 UNL1 0.0182 12 H 1.5136 -0.8855 1.1311 H 1 UNL1 0.0422 13 C 2.7122 1.0124 1.0119 C.3 1 UNL1 -0.0340 14 C 3.2924 -0.0072 0.0502 C.3 1 UNL1 -0.0216 15 C 4.1948 -1.0844 0.6026 C.3 1 UNL1 -0.0588 16 C 3.6977 0.4338 -1.3317 C.3 1 UNL1 -0.0588 17 H -2.2523 0.9795 1.7706 H 1 UNL1 0.0233 18 H -1.7235 2.2776 0.6888 H 1 UNL1 0.0233 19 H -3.3565 2.2938 1.3614 H 1 UNL1 0.0233 20 H -4.4650 -0.2294 1.1575 H 1 UNL1 0.0268 21 H -5.1310 -0.0356 -0.4668 H 1 UNL1 0.0268 22 H -3.0234 -2.0430 0.3789 H 1 UNL1 0.0272 23 H -3.6961 -1.8818 -1.2541 H 1 UNL1 0.0272 24 H 2.5930 2.0458 0.6976 H 1 UNL1 0.0282 25 H 2.9826 0.9862 2.0647 H 1 UNL1 0.0282 26 H 3.8884 -1.4196 1.6014 H 1 UNL1 0.0235 27 H 4.1976 -1.9681 -0.0495 H 1 UNL1 0.0235 28 H 5.2303 -0.7287 0.6846 H 1 UNL1 0.0235 29 H 4.7752 0.6430 -1.3785 H 1 UNL1 0.0235 30 H 3.4831 -0.3455 -2.0761 H 1 UNL1 0.0235 31 H 3.1862 1.3475 -1.6591 H 1 UNL1 0.0235 @BOND 1 1 2 1 2 1 3 1 3 1 4 1 4 4 5 1 5 5 6 1 6 6 7 1 7 1 6 1 8 6 8 1 9 8 9 2 10 8 10 1 11 10 11 1 12 11 12 1 13 11 13 1 14 13 14 1 15 11 14 1 16 14 15 1 17 14 16 1 18 3 17 1 19 3 18 1 20 3 19 1 21 4 20 1 22 4 21 1 23 5 22 1 24 5 23 1 25 13 24 1 26 13 25 1 27 15 26 1 28 15 27 1 29 15 28 1 30 16 29 1 31 16 30 1 32 16 31 1