@MOLECULE 2,2-dimethylnonane-4-thione 34 33 0 0 0 SMALL USER_CHARGES @ATOM 1 C 5.8690 -0.6627 -0.0043 C.3 1 UNL11111111 -0.4416 2 C 4.6137 0.1900 -0.1874 C.3 1 UNL11111111 -0.2485 3 C 3.3466 -0.6345 0.0769 C.3 1 UNL11111111 -0.2767 4 C 2.0989 0.2554 -0.0169 C.3 1 UNL11111111 -0.2575 5 C 0.8300 -0.5942 0.1241 C.3 1 UNL11111111 -0.3235 6 C -0.4681 0.1586 0.2039 C.2 1 UNL11111111 0.1351 7 S -0.5621 1.7497 0.0259 S.2 1 UNL11111111 -0.2285 8 C -1.6102 -0.7538 0.5359 C.3 1 UNL11111111 -0.3579 9 C -3.0220 -0.4733 -0.0499 C.3 1 UNL11111111 0.1563 10 C -2.9638 -0.1902 -1.5551 C.3 1 UNL11111111 -0.4702 11 C -3.8566 -1.7570 0.1743 C.3 1 UNL11111111 -0.4757 12 C -3.7215 0.6734 0.6889 C.3 1 UNL11111111 -0.4712 13 H 6.7745 -0.0901 -0.2336 H 1 UNL11111111 0.1412 14 H 5.9612 -1.0243 1.0258 H 1 UNL11111111 0.1418 15 H 5.8592 -1.5381 -0.6616 H 1 UNL11111111 0.1415 16 H 4.6478 1.0624 0.4927 H 1 UNL11111111 0.1369 17 H 4.5851 0.6069 -1.2122 H 1 UNL11111111 0.1356 18 H 3.2834 -1.4665 -0.6483 H 1 UNL11111111 0.1345 19 H 3.4048 -1.1041 1.0763 H 1 UNL11111111 0.1352 20 H 2.1414 1.0336 0.7703 H 1 UNL11111111 0.1529 21 H 2.0947 0.8006 -0.9806 H 1 UNL11111111 0.1518 22 H 0.7790 -1.3055 -0.7330 H 1 UNL11111111 0.1640 23 H 0.9320 -1.2382 1.0284 H 1 UNL11111111 0.1604 24 H -1.3445 -1.7974 0.2465 H 1 UNL11111111 0.1562 25 H -1.7043 -0.7865 1.6475 H 1 UNL11111111 0.1703 26 H -2.3179 -0.9020 -2.0773 H 1 UNL11111111 0.1422 27 H -3.9607 -0.2555 -2.0058 H 1 UNL11111111 0.1471 28 H -2.5916 0.8171 -1.7717 H 1 UNL11111111 0.1598 29 H -3.8796 -2.0417 1.2302 H 1 UNL11111111 0.1427 30 H -4.8942 -1.6091 -0.1440 H 1 UNL11111111 0.1488 31 H -3.4608 -2.6019 -0.3964 H 1 UNL11111111 0.1425 32 H -3.2343 1.6390 0.5138 H 1 UNL11111111 0.1680 33 H -4.7589 0.7826 0.3546 H 1 UNL11111111 0.1444 34 H -3.7361 0.5082 1.7700 H 1 UNL11111111 0.1419 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 4 5 1 5 5 6 1 6 6 7 2 7 6 8 1 8 8 9 1 9 9 10 1 10 9 11 1 11 9 12 1 12 1 13 1 13 1 14 1 14 1 15 1 15 2 16 1 16 2 17 1 17 3 18 1 18 3 19 1 19 4 20 1 20 4 21 1 21 5 22 1 22 5 23 1 23 8 24 1 24 8 25 1 25 10 26 1 26 10 27 1 27 10 28 1 28 11 29 1 29 11 30 1 30 11 31 1 31 12 32 1 32 12 33 1 33 12 34 1