@MOLECULE 2-[(r)-methylsulfinyl]propane 16 15 0 0 0 SMALL USER_CHARGES @ATOM 1 C 1.5202 1.3382 0.3060 C.3 1 UNL111111111 -0.6711 2 S 0.6900 -0.1192 -0.4203 S.O 1 UNL111111111 1.0688 3 O 1.2896 -1.3035 0.2457 O.2 1 UNL111111111 -0.8000 4 C -0.9835 0.0742 0.3810 C.3 1 UNL111111111 -0.2796 5 C -1.6678 1.3376 -0.1205 C.3 1 UNL111111111 -0.4456 6 C -1.8076 -1.1649 0.0566 C.3 1 UNL111111111 -0.4403 7 H 2.6061 1.1934 0.2583 H 1 UNL111111111 0.1813 8 H 1.2714 2.2381 -0.2583 H 1 UNL111111111 0.1647 9 H 1.2730 1.5028 1.3566 H 1 UNL111111111 0.1676 10 H -0.8436 0.1335 1.4848 H 1 UNL111111111 0.1524 11 H -2.6800 1.4187 0.3030 H 1 UNL111111111 0.1524 12 H -1.1379 2.2523 0.1701 H 1 UNL111111111 0.1415 13 H -1.7898 1.3491 -1.2111 H 1 UNL111111111 0.1486 14 H -1.3046 -2.0896 0.3845 H 1 UNL111111111 0.1682 15 H -2.7773 -1.1374 0.5709 H 1 UNL111111111 0.1453 16 H -2.0168 -1.2676 -1.0151 H 1 UNL111111111 0.1459 @BOND 1 13 5 1 2 16 6 1 3 2 3 2 4 2 1 1 5 2 4 1 6 8 1 1 7 5 12 1 8 5 11 1 9 5 4 1 10 6 14 1 11 6 4 1 12 6 15 1 13 7 1 1 14 1 9 1 15 4 10 1