@MOLECULE S-(3,3-dimethylbutyl) (1S,2S)-2-methylcyclopropanecarbothioate 33 33 0 0 0 SMALL USER_CHARGES @ATOM 1 C 4.2022 -0.4772 -0.1940 C.3 1 UNL11111111 -0.0795 2 H 3.9868 -1.5181 -0.4806 H 1 UNL11111111 0.1715 3 C 5.3625 0.1121 -0.9448 C.3 1 UNL11111111 -0.4417 4 C 3.9323 -0.0719 1.2306 C.3 1 UNL11111111 -0.2948 5 C 3.0040 0.4186 0.1307 C.3 1 UNL11111111 -0.3072 6 H 3.0651 1.4753 -0.1594 H 1 UNL11111111 0.1872 7 C 1.6590 -0.1867 0.0579 C.2 1 UNL11111111 0.4443 8 O 1.4374 -1.3663 0.0255 O.2 1 UNL11111111 -0.4439 9 S 0.3092 1.0190 0.0350 S.3 1 UNL11111111 -0.1204 10 C -1.1599 -0.0788 -0.1160 C.3 1 UNL11111111 -0.2870 11 C -2.4205 0.7361 0.1359 C.3 1 UNL11111111 -0.2977 12 C -3.7146 -0.1011 -0.0404 C.3 1 UNL11111111 0.1312 13 C -3.7384 -1.2752 0.9485 C.3 1 UNL11111111 -0.4673 14 C -4.9124 0.8229 0.2494 C.3 1 UNL11111111 -0.4703 15 C -3.8302 -0.6316 -1.4768 C.3 1 UNL11111111 -0.4674 16 H 6.2784 -0.4705 -0.7736 H 1 UNL11111111 0.1550 17 H 5.1736 0.1145 -2.0278 H 1 UNL11111111 0.1560 18 H 5.5775 1.1469 -0.6510 H 1 UNL11111111 0.1501 19 H 3.5723 -0.8144 1.9413 H 1 UNL11111111 0.1682 20 H 4.5773 0.6448 1.7321 H 1 UNL11111111 0.1622 21 H -1.1650 -0.5333 -1.1244 H 1 UNL11111111 0.1652 22 H -1.0667 -0.9166 0.6026 H 1 UNL11111111 0.1713 23 H -2.4122 1.1594 1.1613 H 1 UNL11111111 0.1500 24 H -2.4710 1.6062 -0.5500 H 1 UNL11111111 0.1486 25 H -3.5976 -0.9336 1.9791 H 1 UNL11111111 0.1458 26 H -4.6938 -1.8093 0.9055 H 1 UNL11111111 0.1471 27 H -2.9515 -2.0054 0.7310 H 1 UNL11111111 0.1479 28 H -4.9374 1.6759 -0.4361 H 1 UNL11111111 0.1444 29 H -5.8611 0.2873 0.1391 H 1 UNL11111111 0.1472 30 H -4.8766 1.2169 1.2699 H 1 UNL11111111 0.1448 31 H -3.0585 -1.3763 -1.6981 H 1 UNL11111111 0.1468 32 H -4.7995 -1.1147 -1.6425 H 1 UNL11111111 0.1472 33 H -3.7344 0.1747 -2.2111 H 1 UNL11111111 0.1453 @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 3 16 1 17 3 17 1 18 3 18 1 19 4 19 1 20 4 20 1 21 10 21 1 22 10 22 1 23 11 23 1 24 11 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 31 15 31 1 32 15 32 1 33 15 33 1