@MOLECULE (4R)-4-methylnonane-5-thione 31 30 0 0 0 SMALL USER_CHARGES @ATOM 1 C 5.1258 -0.3814 0.4025 C.3 1 UNL1111111 -0.4383 2 C 3.7577 -1.0477 0.2574 C.3 1 UNL1111111 -0.2539 3 C 2.6495 0.0106 0.1520 C.3 1 UNL1111111 -0.2572 4 C 1.2753 -0.6662 0.0768 C.3 1 UNL1111111 -0.3225 5 C 0.1033 0.2443 -0.1137 C.2 1 UNL1111111 0.1009 6 S 0.1777 1.8426 -0.0236 S.2 1 UNL1111111 -0.2121 7 C -1.1732 -0.5084 -0.4225 C.3 1 UNL1111111 -0.1351 8 H -1.0582 -1.5789 -0.1065 H 1 UNL1111111 0.1447 9 C -1.3896 -0.4794 -1.9433 C.3 1 UNL1111111 -0.4393 10 C -2.3937 0.0630 0.3233 C.3 1 UNL1111111 -0.2734 11 C -3.5513 -0.9455 0.3500 C.3 1 UNL1111111 -0.2511 12 C -4.7969 -0.3156 0.9735 C.3 1 UNL1111111 -0.4388 13 H 5.2070 0.1623 1.3506 H 1 UNL1111111 0.1443 14 H 5.9336 -1.1207 0.3772 H 1 UNL1111111 0.1392 15 H 5.3112 0.3367 -0.4047 H 1 UNL1111111 0.1455 16 H 3.7485 -1.6979 -0.6375 H 1 UNL1111111 0.1318 17 H 3.5709 -1.7132 1.1208 H 1 UNL1111111 0.1324 18 H 2.7017 0.6948 1.0214 H 1 UNL1111111 0.1540 19 H 2.8223 0.6428 -0.7404 H 1 UNL1111111 0.1503 20 H 1.2923 -1.4192 -0.7456 H 1 UNL1111111 0.1616 21 H 1.1158 -1.2614 1.0071 H 1 UNL1111111 0.1653 22 H -1.5974 0.5361 -2.3042 H 1 UNL1111111 0.1603 23 H -0.5138 -0.8514 -2.4856 H 1 UNL1111111 0.1446 24 H -2.2450 -1.1021 -2.2297 H 1 UNL1111111 0.1493 25 H -2.1192 0.3299 1.3620 H 1 UNL1111111 0.1447 26 H -2.7283 1.0070 -0.1494 H 1 UNL1111111 0.1576 27 H -3.7822 -1.2931 -0.6744 H 1 UNL1111111 0.1343 28 H -3.2577 -1.8473 0.9188 H 1 UNL1111111 0.1314 29 H -5.6192 -1.0367 1.0344 H 1 UNL1111111 0.1397 30 H -4.5994 0.0458 1.9891 H 1 UNL1111111 0.1448 31 H -5.1505 0.5376 0.3828 H 1 UNL1111111 0.1447 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 4 5 1 5 5 6 2 6 5 7 1 7 7 8 1 8 7 9 1 9 7 10 1 10 10 11 1 11 11 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 9 22 1 22 9 23 1 23 9 24 1 24 10 25 1 25 10 26 1 26 11 27 1 27 11 28 1 28 12 29 1 29 12 30 1 30 12 31 1