@MOLECULE 1,1-dimethyl-3-[(S)-[(1R,2R)-2-methylcyclobutyl]sulfinyl]cyclobutane 33 34 0 0 0 SMALL USER_CHARGES @ATOM 1 C -1.6808 -1.0324 -0.3389 C.3 1 UNL111 -0.3033 2 C -3.0221 -0.2841 -0.0285 C.3 1 UNL111 0.1092 3 C -4.1327 -0.5818 -1.0210 C.3 1 UNL111 -0.4687 4 C -3.5011 -0.4613 1.4020 C.3 1 UNL111 -0.4654 5 C -2.2964 1.0751 -0.2910 C.3 1 UNL111 -0.2846 6 C -0.9897 0.3190 -0.6309 C.3 1 UNL111 -0.3366 7 S 0.4064 0.7264 0.4920 S.O 1 UNL111 1.0324 8 O 0.7163 2.1555 0.2263 O.2 1 UNL111 -0.7883 9 C 1.7099 -0.2294 -0.3760 C.3 1 UNL111 -0.3601 10 H 1.6788 -0.0402 -1.4586 H 1 UNL111 0.1584 11 C 3.1385 -0.0331 0.2187 C.3 1 UNL111 -0.0555 12 H 3.1660 0.5894 1.1322 H 1 UNL111 0.1453 13 C 4.1656 0.4628 -0.7797 C.3 1 UNL111 -0.4565 14 C 3.2030 -1.5588 0.5319 C.3 1 UNL111 -0.2968 15 C 1.7598 -1.7316 -0.0112 C.3 1 UNL111 -0.2670 16 H -1.2914 -1.6084 0.5034 H 1 UNL111 0.1419 17 H -1.7304 -1.7043 -1.1999 H 1 UNL111 0.1431 18 H -4.5065 -1.6057 -0.9099 H 1 UNL111 0.1449 19 H -4.9835 0.0954 -0.8789 H 1 UNL111 0.1493 20 H -3.7960 -0.4671 -2.0579 H 1 UNL111 0.1499 21 H -2.7071 -0.2490 2.1283 H 1 UNL111 0.1529 22 H -4.3362 0.2121 1.6281 H 1 UNL111 0.1471 23 H -3.8467 -1.4854 1.5822 H 1 UNL111 0.1427 24 H -2.7032 1.6566 -1.1234 H 1 UNL111 0.1469 25 H -2.2573 1.7451 0.5732 H 1 UNL111 0.1555 26 H -0.6934 0.4442 -1.6829 H 1 UNL111 0.1543 27 H 3.9442 1.4953 -1.0870 H 1 UNL111 0.1619 28 H 5.1735 0.4584 -0.3487 H 1 UNL111 0.1460 29 H 4.1930 -0.1506 -1.6870 H 1 UNL111 0.1452 30 H 3.9653 -2.1041 -0.0276 H 1 UNL111 0.1403 31 H 3.3252 -1.7976 1.5896 H 1 UNL111 0.1370 32 H 1.0423 -2.0733 0.7399 H 1 UNL111 0.1388 33 H 1.6798 -2.4014 -0.8729 H 1 UNL111 0.1400 @BOND 1 1 2 1 2 2 3 1 3 2 4 1 4 2 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 11 13 1 14 11 14 1 15 14 15 1 16 9 15 1 17 1 16 1 18 1 17 1 19 3 18 1 20 3 19 1 21 3 20 1 22 4 21 1 23 4 22 1 24 4 23 1 25 5 24 1 26 5 25 1 27 6 26 1 28 13 27 1 29 13 28 1 30 13 29 1 31 14 30 1 32 14 31 1 33 15 32 1 34 15 33 1