@MOLECULE (1R,2R)-1-[(R)-1,1-dimethylpropylsulfinyl]-2-methyl-cyclobutane 32 32 0 0 0 SMALL USER_CHARGES @ATOM 1 C 3.4059 0.9469 0.8828 C.3 1 UNL1111111 -0.4382 2 C 2.9464 -0.3139 0.1498 C.3 1 UNL1111111 -0.2630 3 C 1.6018 -0.1875 -0.5877 C.3 1 UNL1111111 -0.0884 4 C 1.5889 1.0138 -1.5267 C.3 1 UNL1111111 -0.4594 5 C 1.3548 -1.4759 -1.3701 C.3 1 UNL1111111 -0.4690 6 S 0.2691 0.0217 0.7233 S.O 1 UNL1111111 0.9841 7 O 0.1315 -1.3283 1.3394 O.2 1 UNL1111111 -0.7946 8 C -1.2164 0.2472 -0.3283 C.3 1 UNL1111111 -0.3553 9 H -1.0605 -0.1351 -1.3457 H 1 UNL1111111 0.1542 10 C -2.5295 -0.2915 0.3164 C.3 1 UNL1111111 -0.0584 11 H -2.3920 -0.7071 1.3343 H 1 UNL1111111 0.1591 12 C -3.2878 -1.2797 -0.5478 C.3 1 UNL1111111 -0.4556 13 C -3.1049 1.1570 0.3253 C.3 1 UNL1111111 -0.2961 14 C -1.7828 1.6872 -0.2893 C.3 1 UNL1111111 -0.2676 15 H 3.5276 1.7938 0.2001 H 1 UNL1111111 0.1384 16 H 2.7105 1.2504 1.6731 H 1 UNL1111111 0.1510 17 H 4.3757 0.7781 1.3666 H 1 UNL1111111 0.1392 18 H 3.7263 -0.6021 -0.5859 H 1 UNL1111111 0.1375 19 H 2.9032 -1.1645 0.8658 H 1 UNL1111111 0.1583 20 H 2.4515 0.9761 -2.2075 H 1 UNL1111111 0.1549 21 H 0.6955 1.0468 -2.1613 H 1 UNL1111111 0.1443 22 H 1.6542 1.9716 -0.9962 H 1 UNL1111111 0.1493 23 H 1.2523 -2.3462 -0.6992 H 1 UNL1111111 0.1769 24 H 0.4486 -1.4391 -1.9845 H 1 UNL1111111 0.1432 25 H 2.1864 -1.6949 -2.0512 H 1 UNL1111111 0.1492 26 H -2.7493 -2.2357 -0.6107 H 1 UNL1111111 0.1572 27 H -4.2789 -1.4909 -0.1278 H 1 UNL1111111 0.1486 28 H -3.4334 -0.9137 -1.5697 H 1 UNL1111111 0.1427 29 H -3.9863 1.2996 -0.3017 H 1 UNL1111111 0.1394 30 H -3.3310 1.5425 1.3212 H 1 UNL1111111 0.1392 31 H -1.2495 2.4007 0.3453 H 1 UNL1111111 0.1422 32 H -1.8976 2.1452 -1.2759 H 1 UNL1111111 0.1367 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 3 5 1 5 3 6 1 6 6 7 2 7 6 8 1 8 8 9 1 9 8 10 1 10 10 11 1 11 10 12 1 12 10 13 1 13 13 14 1 14 8 14 1 15 1 15 1 16 1 16 1 17 1 17 1 18 2 18 1 19 2 19 1 20 4 20 1 21 4 21 1 22 4 22 1 23 5 23 1 24 5 24 1 25 5 25 1 26 12 26 1 27 12 27 1 28 12 28 1 29 13 29 1 30 13 30 1 31 14 31 1 32 14 32 1