@MOLECULE 1-(2,2-dimethylbutylsulfanyl)-1-methyl-cyclobutane 34 34 0 0 0 SMALL USER_CHARGES @ATOM 1 C 4.4983 0.4541 -0.6741 C.3 1 UNL11111111 -0.4325 2 C 3.0414 0.2191 -1.0702 C.3 1 UNL11111111 -0.2793 3 C 2.0772 0.0101 0.1339 C.3 1 UNL11111111 0.1252 4 C 2.5063 -1.2248 0.9362 C.3 1 UNL11111111 -0.4633 5 C 2.0843 1.2519 1.0332 C.3 1 UNL11111111 -0.4629 6 C 0.6802 -0.2053 -0.4900 C.3 1 UNL11111111 -0.3431 7 S -0.6356 -0.4581 0.7722 S.3 1 UNL11111111 -0.0957 8 C -2.1654 -0.3016 -0.2375 C.3 1 UNL11111111 0.0439 9 C -2.2884 -1.4253 -1.2403 C.3 1 UNL11111111 -0.4650 10 C -3.4051 -0.1200 0.6880 C.3 1 UNL11111111 -0.2872 11 C -3.6542 1.2844 0.0789 C.3 1 UNL11111111 -0.2693 12 C -2.4101 1.1168 -0.8322 C.3 1 UNL11111111 -0.3012 13 H 4.6124 1.3541 -0.0597 H 1 UNL11111111 0.1437 14 H 4.9060 -0.3897 -0.1060 H 1 UNL11111111 0.1438 15 H 5.1271 0.5834 -1.5627 H 1 UNL11111111 0.1386 16 H 2.6874 1.0775 -1.6730 H 1 UNL11111111 0.1345 17 H 2.9855 -0.6659 -1.7326 H 1 UNL11111111 0.1342 18 H 3.5303 -1.1177 1.3110 H 1 UNL11111111 0.1457 19 H 1.8692 -1.3901 1.8128 H 1 UNL11111111 0.1565 20 H 2.4688 -2.1341 0.3274 H 1 UNL11111111 0.1446 21 H 1.7416 2.1419 0.4961 H 1 UNL11111111 0.1437 22 H 1.4381 1.1287 1.9105 H 1 UNL11111111 0.1582 23 H 3.0904 1.4593 1.4139 H 1 UNL11111111 0.1456 24 H 0.4089 0.6660 -1.1121 H 1 UNL11111111 0.1515 25 H 0.6975 -1.0871 -1.1549 H 1 UNL11111111 0.1529 26 H -2.2483 -2.4145 -0.7614 H 1 UNL11111111 0.1618 27 H -3.2467 -1.3749 -1.7772 H 1 UNL11111111 0.1533 28 H -1.4983 -1.3961 -2.0014 H 1 UNL11111111 0.1502 29 H -4.2041 -0.8447 0.5082 H 1 UNL11111111 0.1445 30 H -3.2088 -0.1143 1.7648 H 1 UNL11111111 0.1543 31 H -4.5999 1.3850 -0.4577 H 1 UNL11111111 0.1371 32 H -3.5793 2.1063 0.7957 H 1 UNL11111111 0.1429 33 H -1.6236 1.8543 -0.6517 H 1 UNL11111111 0.1501 34 H -2.6282 1.1198 -1.9034 H 1 UNL11111111 0.1427 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 3 5 1 5 3 6 1 6 6 7 1 7 7 8 1 8 8 9 1 9 8 10 1 10 10 11 1 11 11 12 1 12 8 12 1 13 1 13 1 14 1 14 1 15 1 15 1 16 2 16 1 17 2 17 1 18 4 18 1 19 4 19 1 20 4 20 1 21 5 21 1 22 5 22 1 23 5 23 1 24 6 24 1 25 6 25 1 26 9 26 1 27 9 27 1 28 9 28 1 29 10 29 1 30 10 30 1 31 11 31 1 32 11 32 1 33 12 33 1 34 12 34 1