@MOLECULE S-(3,3-dimethylbutyl) (1R)-2,2-dimethylcyclopropanecarbothioate 36 36 0 0 0 SMALL USER_CHARGES @ATOM 1 C 3.7885 0.0310 0.1304 C.3 1 UNL111 0.1055 2 C 3.5447 0.0482 1.6164 C.3 1 UNL111 -0.4578 3 C 4.8246 1.0325 -0.3121 C.3 1 UNL111 -0.4501 4 C 3.6701 -1.2747 -0.6186 C.3 1 UNL111 -0.3180 5 C 2.6036 -0.2146 -0.8183 C.3 1 UNL111 -0.3240 6 H 2.5903 0.3297 -1.7722 H 1 UNL111 0.1887 7 C 1.2656 -0.4494 -0.2410 C.2 1 UNL111 0.4538 8 O 0.8791 -1.4870 0.2195 O.2 1 UNL111 -0.4368 9 S 0.2182 1.0330 -0.2539 S.3 1 UNL111 -0.1334 10 C -1.3596 0.4315 0.4692 C.3 1 UNL111 -0.2903 11 C -2.4520 0.3559 -0.5895 C.3 1 UNL111 -0.2950 12 C -3.8226 -0.0765 -0.0077 C.3 1 UNL111 0.1288 13 C -4.3166 0.9411 1.0314 C.3 1 UNL111 -0.4679 14 C -4.8302 -0.1287 -1.1718 C.3 1 UNL111 -0.4692 15 C -3.7287 -1.4679 0.6340 C.3 1 UNL111 -0.4663 16 H 3.1663 1.0249 1.9493 H 1 UNL111 0.1601 17 H 2.8138 -0.7090 1.9336 H 1 UNL111 0.1629 18 H 4.4710 -0.1525 2.1712 H 1 UNL111 0.1565 19 H 5.7935 0.8340 0.1651 H 1 UNL111 0.1550 20 H 4.9893 1.0182 -1.3961 H 1 UNL111 0.1508 21 H 4.5281 2.0555 -0.0426 H 1 UNL111 0.1582 22 H 4.3496 -1.5067 -1.4327 H 1 UNL111 0.1608 23 H 3.4108 -2.1865 -0.0800 H 1 UNL111 0.1763 24 H -1.1987 -0.5607 0.9406 H 1 UNL111 0.1796 25 H -1.6328 1.1303 1.2818 H 1 UNL111 0.1621 26 H -2.5762 1.3348 -1.0949 H 1 UNL111 0.1471 27 H -2.1669 -0.3588 -1.3883 H 1 UNL111 0.1515 28 H -4.3242 1.9571 0.6237 H 1 UNL111 0.1444 29 H -5.3368 0.7090 1.3561 H 1 UNL111 0.1469 30 H -3.6871 0.9460 1.9267 H 1 UNL111 0.1431 31 H -4.5253 -0.8535 -1.9333 H 1 UNL111 0.1460 32 H -5.8254 -0.4221 -0.8215 H 1 UNL111 0.1462 33 H -4.9297 0.8457 -1.6602 H 1 UNL111 0.1434 34 H -3.1087 -1.4598 1.5362 H 1 UNL111 0.1454 35 H -4.7178 -1.8375 0.9247 H 1 UNL111 0.1461 36 H -3.2925 -2.1979 -0.0567 H 1 UNL111 0.1499 @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 12 13 1 14 12 14 1 15 12 15 1 16 2 16 1 17 2 17 1 18 2 18 1 19 3 19 1 20 3 20 1 21 3 21 1 22 4 22 1 23 4 23 1 24 10 24 1 25 10 25 1 26 11 26 1 27 11 27 1 28 13 28 1 29 13 29 1 30 13 30 1 31 14 31 1 32 14 32 1 33 14 33 1 34 15 34 1 35 15 35 1 36 15 36 1