@MOLECULE S-(1-methylcyclopropyl) 1-methylcyclobutanecarbothioate 28 29 0 0 0 SMALL USER_CHARGES @ATOM 1 C -2.4294 0.1396 -1.2187 C.3 1 UNL111 -0.2732 2 C -3.4977 0.9550 -0.4463 C.3 1 UNL111 -0.2768 3 C -2.9037 0.4694 0.8984 C.3 1 UNL111 -0.2728 4 C -1.8379 -0.3771 0.1288 C.3 1 UNL111 -0.0297 5 C -1.9584 -1.8715 0.3509 C.3 1 UNL111 -0.4488 6 C -0.4332 0.0797 0.4102 C.2 1 UNL111 0.4184 7 O -0.1127 0.7380 1.3562 O.2 1 UNL111 -0.4179 8 S 0.7994 -0.4656 -0.8177 S.3 1 UNL111 -0.1303 9 C 2.3501 0.2171 -0.1748 C.3 1 UNL111 -0.0076 10 C 2.5066 1.6834 -0.4422 C.3 1 UNL111 -0.4397 11 C 2.9290 -0.3759 1.0944 C.3 1 UNL111 -0.3079 12 C 3.5542 -0.7028 -0.2362 C.3 1 UNL111 -0.3204 13 H -2.8301 -0.6511 -1.8585 H 1 UNL111 0.1487 14 H -1.7548 0.7488 -1.8264 H 1 UNL111 0.1523 15 H -3.4433 2.0354 -0.6020 H 1 UNL111 0.1426 16 H -4.5275 0.6393 -0.6280 H 1 UNL111 0.1384 17 H -2.4833 1.2628 1.5264 H 1 UNL111 0.1609 18 H -3.5834 -0.1191 1.5177 H 1 UNL111 0.1446 19 H -3.0040 -2.1998 0.2767 H 1 UNL111 0.1577 20 H -1.3934 -2.4522 -0.3907 H 1 UNL111 0.1624 21 H -1.5983 -2.1643 1.3463 H 1 UNL111 0.1570 22 H 1.7538 2.2764 0.1032 H 1 UNL111 0.1687 23 H 3.4892 2.0557 -0.1177 H 1 UNL111 0.1546 24 H 2.4137 1.9286 -1.5100 H 1 UNL111 0.1596 25 H 3.4413 0.2805 1.7954 H 1 UNL111 0.1647 26 H 2.3897 -1.1401 1.6493 H 1 UNL111 0.1668 27 H 3.4718 -1.7082 -0.6433 H 1 UNL111 0.1665 28 H 4.5227 -0.2845 -0.5014 H 1 UNL111 0.1613 @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 9 12 1 14 1 13 1 15 1 14 1 16 2 15 1 17 2 16 1 18 3 17 1 19 3 18 1 20 5 19 1 21 5 20 1 22 5 21 1 23 10 22 1 24 10 23 1 25 10 24 1 26 11 25 1 27 11 26 1 28 12 27 1 29 12 28 1