@MOLECULE [(R)-[(1S,2S)-2-methylcyclopropyl]sulfinyl]cyclohexane 30 31 0 0 0 SMALL USER_CHARGES @ATOM 1 C -1.2962 0.5874 -1.0327 C.3 1 UNL111 -0.2676 2 C -2.5682 1.4327 -0.8655 C.3 1 UNL111 -0.2608 3 C -3.7000 0.5871 -0.2683 C.3 1 UNL111 -0.2643 4 C -3.2658 -0.0132 1.0750 C.3 1 UNL111 -0.2630 5 C -1.9930 -0.8585 0.9001 C.3 1 UNL111 -0.2600 6 C -0.8703 0.0029 0.3149 C.3 1 UNL111 -0.3036 7 S 0.6588 -1.0424 0.1591 S.O 1 UNL111 1.0373 8 O 0.5179 -1.7934 -1.1146 O.2 1 UNL111 -0.7838 9 C 1.8358 0.2977 -0.1873 C.3 1 UNL111 -0.4144 10 H 1.7904 0.6127 -1.2359 H 1 UNL111 0.1827 11 C 2.1603 1.3216 0.8696 C.3 1 UNL111 -0.3291 12 C 3.1912 0.2799 0.4898 C.3 1 UNL111 -0.0862 13 H 3.4140 -0.5153 1.2135 H 1 UNL111 0.1546 14 C 4.4036 0.6797 -0.3077 C.3 1 UNL111 -0.4401 15 H -1.4808 -0.2271 -1.7669 H 1 UNL111 0.1663 16 H -0.4961 1.2107 -1.4736 H 1 UNL111 0.1317 17 H -2.3614 2.3028 -0.2161 H 1 UNL111 0.1316 18 H -2.8769 1.8465 -1.8431 H 1 UNL111 0.1338 19 H -4.6080 1.2022 -0.1366 H 1 UNL111 0.1282 20 H -3.9760 -0.2219 -0.9716 H 1 UNL111 0.1414 21 H -3.0883 0.7929 1.8100 H 1 UNL111 0.1314 22 H -4.0770 -0.6359 1.4935 H 1 UNL111 0.1286 23 H -1.7032 -1.2921 1.8757 H 1 UNL111 0.1308 24 H -2.2151 -1.7171 0.2321 H 1 UNL111 0.1548 25 H -0.6327 0.8302 1.0195 H 1 UNL111 0.1483 26 H 2.3048 2.3590 0.5747 H 1 UNL111 0.1611 27 H 1.6934 1.2879 1.8500 H 1 UNL111 0.1544 28 H 5.2339 0.9719 0.3480 H 1 UNL111 0.1475 29 H 4.7534 -0.1545 -0.9336 H 1 UNL111 0.1580 30 H 4.2071 1.5252 -0.9791 H 1 UNL111 0.1504 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 4 5 1 5 5 6 1 6 1 6 1 7 6 7 1 8 7 8 2 9 7 9 1 10 9 10 1 11 9 11 1 12 11 12 1 13 12 13 1 14 9 12 1 15 12 14 1 16 1 15 1 17 1 16 1 18 2 17 1 19 2 18 1 20 3 19 1 21 3 20 1 22 4 21 1 23 4 22 1 24 5 23 1 25 5 24 1 26 6 25 1 27 11 26 1 28 11 27 1 29 14 28 1 30 14 29 1 31 14 30 1