@MOLECULE 1-[(R)-1,1-dimethylbutylsulfinyl]-1-methyl-cyclopropane 32 32 0 0 0 SMALL USER_CHARGES @ATOM 1 C 3.2076 1.9133 0.0495 C.3 1 UNL11 -0.4420 2 C 2.4131 0.7142 -0.4718 C.3 1 UNL11 -0.2472 3 C 1.6597 0.0334 0.6797 C.3 1 UNL11 -0.2993 4 C 0.7322 -1.1130 0.2630 C.3 1 UNL11 -0.0836 5 C 1.4632 -2.1357 -0.6082 C.3 1 UNL11 -0.4524 6 C 0.2102 -1.8154 1.5150 C.3 1 UNL11 -0.4673 7 S -0.7026 -0.5096 -0.7998 S.O 1 UNL11 0.9929 8 O -1.6902 -1.6241 -0.7301 O.2 1 UNL11 -0.7872 9 C -1.4582 0.8545 0.1632 C.3 1 UNL11 -0.1824 10 C -2.2352 0.4209 1.3690 C.3 1 UNL11 -0.4406 11 C -0.7768 2.2055 0.1718 C.3 1 UNL11 -0.3300 12 C -2.0038 1.9959 -0.6749 C.3 1 UNL11 -0.3042 13 H 3.7508 2.4119 -0.7606 H 1 UNL11 0.1395 14 H 2.5547 2.6596 0.5154 H 1 UNL11 0.1418 15 H 3.9456 1.6103 0.8005 H 1 UNL11 0.1426 16 H 1.7223 1.0446 -1.2682 H 1 UNL11 0.1363 17 H 3.1007 -0.0067 -0.9550 H 1 UNL11 0.1387 18 H 2.4080 -0.3683 1.3969 H 1 UNL11 0.1484 19 H 1.0988 0.7899 1.2640 H 1 UNL11 0.1455 20 H 2.3600 -2.5109 -0.0984 H 1 UNL11 0.1476 21 H 0.8314 -3.0117 -0.8233 H 1 UNL11 0.1657 22 H 1.7919 -1.7281 -1.5711 H 1 UNL11 0.1465 23 H -0.1797 -1.1179 2.2638 H 1 UNL11 0.1434 24 H -0.5994 -2.5271 1.2780 H 1 UNL11 0.1795 25 H 1.0023 -2.3971 2.0032 H 1 UNL11 0.1486 26 H -1.5872 0.2388 2.2366 H 1 UNL11 0.1468 27 H -2.9752 1.1720 1.6781 H 1 UNL11 0.1505 28 H -2.8033 -0.5096 1.1802 H 1 UNL11 0.1827 29 H -0.8372 2.8162 1.0703 H 1 UNL11 0.1590 30 H 0.1890 2.3577 -0.3037 H 1 UNL11 0.1604 31 H -1.9242 1.9839 -1.7593 H 1 UNL11 0.1604 32 H -2.9473 2.4563 -0.3897 H 1 UNL11 0.1593 @BOND 1 31 12 1 2 22 5 1 3 16 2 1 4 17 2 1 5 13 1 1 6 7 8 2 7 7 9 1 8 7 4 1 9 21 5 1 10 12 32 1 11 12 11 1 12 12 9 1 13 5 20 1 14 5 4 1 15 2 1 1 16 2 3 1 17 30 11 1 18 1 14 1 19 1 15 1 20 11 9 1 21 11 29 1 22 9 10 1 23 4 3 1 24 4 6 1 25 3 19 1 26 3 18 1 27 28 10 1 28 24 6 1 29 10 27 1 30 10 26 1 31 6 25 1 32 6 23 1