@MOLECULE 1-[(R)-2,2-dimethylpropylsulfinyl]-1-methyl-cyclobutane 32 32 0 0 0 SMALL USER_CHARGES @ATOM 1 C -2.9422 -0.1199 -1.2628 C.3 1 UNL11111111 -0.4704 2 C -2.4544 -0.1231 0.1947 C.3 1 UNL11111111 0.1609 3 C -2.6202 1.2747 0.8025 C.3 1 UNL11111111 -0.4776 4 C -3.3225 -1.1168 1.0003 C.3 1 UNL11111111 -0.4716 5 C -0.9958 -0.6051 0.3053 C.3 1 UNL11111111 -0.5174 6 S 0.1919 0.2974 -0.7748 S.O 1 UNL11111111 1.0235 7 O 0.2342 1.7082 -0.3081 O.2 1 UNL11111111 -0.7942 8 C 1.7528 -0.4851 -0.1540 C.3 1 UNL11111111 -0.1480 9 C 1.8130 -1.9310 -0.5919 C.3 1 UNL11111111 -0.4555 10 C 3.0110 0.3445 -0.5436 C.3 1 UNL11111111 -0.2756 11 C 3.3635 0.5219 0.9561 C.3 1 UNL11111111 -0.2661 12 C 2.0808 -0.2576 1.3479 C.3 1 UNL11111111 -0.2880 13 H -2.5135 0.7106 -1.8362 H 1 UNL11111111 0.1569 14 H -2.6945 -1.0523 -1.7775 H 1 UNL11111111 0.1397 15 H -4.0302 0.0016 -1.3099 H 1 UNL11111111 0.1435 16 H -3.6571 1.6169 0.7392 H 1 UNL11111111 0.1410 17 H -2.3237 1.2981 1.8558 H 1 UNL11111111 0.1458 18 H -1.9990 2.0253 0.2889 H 1 UNL11111111 0.1821 19 H -3.2791 -2.1239 0.5770 H 1 UNL11111111 0.1383 20 H -2.9981 -1.1752 2.0439 H 1 UNL11111111 0.1445 21 H -4.3724 -0.8068 1.0043 H 1 UNL11111111 0.1452 22 H -0.6757 -0.5339 1.3594 H 1 UNL11111111 0.1632 23 H -0.9380 -1.6715 0.0292 H 1 UNL11111111 0.1568 24 H 1.7197 -2.0464 -1.6801 H 1 UNL11111111 0.1521 25 H 2.7802 -2.3803 -0.3178 H 1 UNL11111111 0.1570 26 H 1.0453 -2.5539 -0.1163 H 1 UNL11111111 0.1448 27 H 3.7522 -0.2051 -1.1276 H 1 UNL11111111 0.1362 28 H 2.8135 1.2923 -1.0595 H 1 UNL11111111 0.1593 29 H 4.2969 0.0495 1.2652 H 1 UNL11111111 0.1334 30 H 3.3752 1.5630 1.2931 H 1 UNL11111111 0.1490 31 H 1.3590 0.3529 1.9025 H 1 UNL11111111 0.1532 32 H 2.2581 -1.1717 1.9183 H 1 UNL11111111 0.1382 @BOND 1 13 1 1 2 14 1 1 3 24 9 1 4 15 1 1 5 1 2 1 6 28 10 1 7 27 10 1 8 6 7 2 9 6 8 1 10 6 5 1 11 10 8 1 12 10 11 1 13 9 25 1 14 9 8 1 15 9 26 1 16 8 12 1 17 23 5 1 18 18 3 1 19 2 5 1 20 2 3 1 21 2 4 1 22 5 22 1 23 16 3 1 24 3 17 1 25 19 4 1 26 11 30 1 27 11 29 1 28 11 12 1 29 21 4 1 30 4 20 1 31 12 31 1 32 12 32 1