@MOLECULE S-(2,2-dimethylpropyl) (1R,2S)-2-methylcyclopropanecarbothioate 30 30 0 0 0 SMALL USER_CHARGES @ATOM 1 C -3.5329 0.3519 0.2170 C.3 1 UNL11111111 -0.0792 2 H -4.1753 1.0008 0.8276 H 1 UNL11111111 0.1549 3 C -3.5336 0.7417 -1.2345 C.3 1 UNL11111111 -0.4481 4 C -3.4066 -1.0976 0.6086 C.3 1 UNL11111111 -0.3018 5 C -2.2500 -0.1534 0.8811 C.3 1 UNL11111111 -0.3029 6 H -2.0600 0.1422 1.9218 H 1 UNL11111111 0.1862 7 C -1.0311 -0.2862 0.0548 C.2 1 UNL11111111 0.4513 8 O -0.8264 -1.1623 -0.7386 O.2 1 UNL11111111 -0.4400 9 S 0.1652 1.0506 0.3223 S.3 1 UNL11111111 -0.1171 10 C 1.5599 0.5666 -0.7616 C.3 1 UNL11111111 -0.3301 11 C 2.7309 -0.1243 -0.0366 C.3 1 UNL11111111 0.1420 12 C 2.2710 -1.4000 0.6808 C.3 1 UNL11111111 -0.4696 13 C 3.7621 -0.5089 -1.1191 C.3 1 UNL11111111 -0.4714 14 C 3.3977 0.8297 0.9643 C.3 1 UNL11111111 -0.4690 15 H -4.5503 0.7154 -1.6494 H 1 UNL11111111 0.1547 16 H -3.1451 1.7600 -1.3761 H 1 UNL11111111 0.1580 17 H -2.9195 0.0711 -1.8533 H 1 UNL11111111 0.1638 18 H -3.9782 -1.4957 1.4415 H 1 UNL11111111 0.1584 19 H -3.2924 -1.8586 -0.1647 H 1 UNL11111111 0.1774 20 H 1.1763 -0.0960 -1.5658 H 1 UNL11111111 0.1785 21 H 1.9100 1.4922 -1.2568 H 1 UNL11111111 0.1637 22 H 1.6343 -2.0183 0.0354 H 1 UNL11111111 0.1576 23 H 3.1261 -2.0146 0.9825 H 1 UNL11111111 0.1457 24 H 1.7034 -1.1809 1.5912 H 1 UNL11111111 0.1510 25 H 4.1018 0.3649 -1.6827 H 1 UNL11111111 0.1433 26 H 4.6475 -0.9728 -0.6715 H 1 UNL11111111 0.1493 27 H 3.3435 -1.2281 -1.8314 H 1 UNL11111111 0.1497 28 H 2.7290 1.0912 1.7918 H 1 UNL11111111 0.1552 29 H 4.2877 0.3714 1.4095 H 1 UNL11111111 0.1458 30 H 3.7132 1.7622 0.4863 H 1 UNL11111111 0.1427 @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 11 12 1 13 11 13 1 14 11 14 1 15 3 15 1 16 3 16 1 17 3 17 1 18 4 18 1 19 4 19 1 20 10 20 1 21 10 21 1 22 12 22 1 23 12 23 1 24 12 24 1 25 13 25 1 26 13 26 1 27 13 27 1 28 14 28 1 29 14 29 1 30 14 30 1