@MOLECULE S-isopentyl (1R,2R)-2-methylcyclopropanecarbothioate 30 30 0 0 0 SMALL USER_CHARGES @ATOM 1 C 3.9356 -0.4832 -0.1086 C.3 1 UNL1111111 -0.0814 2 H 3.7475 -1.4713 -0.5567 H 1 UNL1111111 0.1725 3 C 5.1005 -0.4794 0.8402 C.3 1 UNL1111111 -0.4411 4 C 3.6328 0.7374 -0.9380 C.3 1 UNL1111111 -0.2974 5 C 2.7129 0.3764 0.2165 C.3 1 UNL1111111 -0.3048 6 H 2.7464 0.9964 1.1214 H 1 UNL1111111 0.1880 7 C 1.3819 -0.1664 -0.1268 C.2 1 UNL1111111 0.4428 8 O 1.1880 -1.2084 -0.6900 O.2 1 UNL1111111 -0.4396 9 S 0.0022 0.9040 0.3540 S.3 1 UNL1111111 -0.1165 10 C -1.4331 -0.0740 -0.2534 C.3 1 UNL1111111 -0.2916 11 C -2.7292 0.5857 0.1993 C.3 1 UNL1111111 -0.2863 12 C -3.9499 -0.2209 -0.2983 C.3 1 UNL1111111 -0.0572 13 C -4.1049 -1.5261 0.4895 C.3 1 UNL1111111 -0.4550 14 C -5.2181 0.6294 -0.1526 C.3 1 UNL1111111 -0.4572 15 H 5.2719 0.5024 1.2993 H 1 UNL1111111 0.1497 16 H 4.9480 -1.1985 1.6577 H 1 UNL1111111 0.1561 17 H 6.0290 -0.7615 0.3241 H 1 UNL1111111 0.1548 18 H 4.2558 1.6245 -0.8574 H 1 UNL1111111 0.1631 19 H 3.2797 0.6216 -1.9610 H 1 UNL1111111 0.1663 20 H -1.3828 -0.1470 -1.3561 H 1 UNL1111111 0.1638 21 H -1.3524 -1.1109 0.1276 H 1 UNL1111111 0.1701 22 H -2.7743 0.6731 1.3029 H 1 UNL1111111 0.1513 23 H -2.7983 1.6225 -0.1884 H 1 UNL1111111 0.1478 24 H -3.8059 -0.4656 -1.3784 H 1 UNL1111111 0.1322 25 H -4.9643 -2.1044 0.1323 H 1 UNL1111111 0.1449 26 H -3.2193 -2.1638 0.3924 H 1 UNL1111111 0.1451 27 H -4.2580 -1.3359 1.5572 H 1 UNL1111111 0.1458 28 H -5.1617 1.5415 -0.7562 H 1 UNL1111111 0.1425 29 H -6.1054 0.0757 -0.4789 H 1 UNL1111111 0.1459 30 H -5.3835 0.9291 0.8878 H 1 UNL1111111 0.1457 @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 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 11 22 1 23 11 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