@MOLECULE (4R,6R)-4,6-dimethylnonane-5-thione 34 33 0 0 0 SMALL USER_CHARGES @ATOM 1 C -1.2019 0.5044 0.3752 C.3 1 UNL111 -0.1343 2 H -1.1208 1.5044 -0.1296 H 1 UNL111 0.1480 3 C -1.1620 0.7271 1.8954 C.3 1 UNL111 -0.4394 4 C -2.5393 -0.1217 -0.0593 C.3 1 UNL111 -0.2739 5 C -3.6719 0.9149 -0.0416 C.3 1 UNL111 -0.2507 6 C -4.9909 0.2721 -0.4714 C.3 1 UNL111 -0.4388 7 C -0.0010 -0.3331 0.0031 C.2 1 UNL111 0.0864 8 S -0.0028 -1.9351 0.0166 S.2 1 UNL111 -0.2102 9 C 1.2021 0.4941 -0.3845 C.3 1 UNL111 -0.1343 10 H 1.1189 1.5076 0.0925 H 1 UNL111 0.1478 11 C 1.1701 0.6758 -1.9104 C.3 1 UNL111 -0.4394 12 C 2.5368 -0.1204 0.0746 C.3 1 UNL111 -0.2737 13 C 3.6715 0.9127 0.0201 C.3 1 UNL111 -0.2507 14 C 4.9922 0.2834 0.4636 C.3 1 UNL111 -0.4388 15 H -1.3276 -0.2082 2.4445 H 1 UNL111 0.1590 16 H -0.1998 1.1377 2.2208 H 1 UNL111 0.1455 17 H -1.9442 1.4280 2.2091 H 1 UNL111 0.1502 18 H -2.4506 -0.5457 -1.0782 H 1 UNL111 0.1460 19 H -2.8012 -0.9732 0.5983 H 1 UNL111 0.1567 20 H -3.7771 1.3496 0.9701 H 1 UNL111 0.1341 21 H -3.4287 1.7598 -0.7128 H 1 UNL111 0.1312 22 H -4.9375 -0.1041 -1.4996 H 1 UNL111 0.1442 23 H -5.2539 -0.5740 0.1741 H 1 UNL111 0.1450 24 H -5.8165 0.9905 -0.4256 H 1 UNL111 0.1392 25 H 0.2079 1.0725 -2.2522 H 1 UNL111 0.1455 26 H 1.9497 1.3732 -2.2381 H 1 UNL111 0.1501 27 H 1.3442 -0.2730 -2.4337 H 1 UNL111 0.1592 28 H 2.4449 -0.5063 1.1082 H 1 UNL111 0.1456 29 H 2.7972 -0.9963 -0.5507 H 1 UNL111 0.1570 30 H 3.7739 1.3144 -1.0055 H 1 UNL111 0.1342 31 H 3.4306 1.7789 0.6643 H 1 UNL111 0.1311 32 H 4.9415 -0.0678 1.5005 H 1 UNL111 0.1442 33 H 5.2552 -0.5776 -0.1620 H 1 UNL111 0.1449 34 H 5.8168 1.0013 0.3979 H 1 UNL111 0.1392 @BOND 1 1 2 1 2 1 3 1 3 1 4 1 4 4 5 1 5 5 6 1 6 1 7 1 7 7 8 2 8 7 9 1 9 9 10 1 10 9 11 1 11 9 12 1 12 12 13 1 13 13 14 1 14 3 15 1 15 3 16 1 16 3 17 1 17 4 18 1 18 4 19 1 19 5 20 1 20 5 21 1 21 6 22 1 22 6 23 1 23 6 24 1 24 11 25 1 25 11 26 1 26 11 27 1 27 12 28 1 28 12 29 1 29 13 30 1 30 13 31 1 31 14 32 1 32 14 33 1 33 14 34 1