@MOLECULE (1R,2R)-1-[(S)-1,1-dimethylbutylsulfinyl]-2-methyl-cyclobutane 35 35 0 0 0 SMALL USER_CHARGES @ATOM 1 C 4.5516 -0.9243 -0.5288 C.3 1 UNL11111111 -0.4419 2 C 3.1829 -0.7086 0.1193 C.3 1 UNL11111111 -0.2585 3 C 2.5568 0.6008 -0.3808 C.3 1 UNL11111111 -0.2797 4 C 1.1565 0.9094 0.1795 C.3 1 UNL11111111 -0.0872 5 C 1.1275 0.7964 1.6971 C.3 1 UNL11111111 -0.4632 6 C 0.7707 2.3273 -0.2501 C.3 1 UNL11111111 -0.4673 7 S -0.0503 -0.3020 -0.6071 S.O 1 UNL11111111 0.9797 8 O 0.2031 -1.6074 0.0660 O.2 1 UNL11111111 -0.7951 9 C -1.6511 0.3033 0.0428 C.3 1 UNL11111111 -0.3523 10 H -1.7049 1.3943 -0.0795 H 1 UNL11111111 0.1525 11 C -2.8843 -0.4271 -0.5741 C.3 1 UNL11111111 -0.0673 12 H -2.6253 -1.3165 -1.1784 H 1 UNL11111111 0.1473 13 C -3.8292 0.4772 -1.3410 C.3 1 UNL11111111 -0.4567 14 C -3.3575 -0.8164 0.8581 C.3 1 UNL11111111 -0.2903 15 C -2.0770 -0.1744 1.4517 C.3 1 UNL11111111 -0.2654 16 H 5.0095 -1.8556 -0.1759 H 1 UNL11111111 0.1432 17 H 4.4710 -0.9931 -1.6189 H 1 UNL11111111 0.1394 18 H 5.2431 -0.1088 -0.2944 H 1 UNL11111111 0.1355 19 H 2.5238 -1.5765 -0.0963 H 1 UNL11111111 0.1739 20 H 3.2857 -0.6915 1.2200 H 1 UNL11111111 0.1367 21 H 3.2354 1.4366 -0.1089 H 1 UNL11111111 0.1375 22 H 2.5380 0.6001 -1.4890 H 1 UNL11111111 0.1396 23 H 1.9587 1.3505 2.1524 H 1 UNL11111111 0.1506 24 H 0.2030 1.1924 2.1324 H 1 UNL11111111 0.1442 25 H 1.2221 -0.2500 2.0329 H 1 UNL11111111 0.1732 26 H 0.7083 2.4392 -1.3388 H 1 UNL11111111 0.1486 27 H -0.1796 2.6614 0.1823 H 1 UNL11111111 0.1454 28 H 1.5241 3.0502 0.0958 H 1 UNL11111111 0.1559 29 H -3.3767 0.8280 -2.2761 H 1 UNL11111111 0.1455 30 H -4.7544 -0.0522 -1.6012 H 1 UNL11111111 0.1469 31 H -4.1152 1.3615 -0.7602 H 1 UNL11111111 0.1449 32 H -4.2903 -0.3464 1.1735 H 1 UNL11111111 0.1381 33 H -3.4425 -1.8931 1.0251 H 1 UNL11111111 0.1461 34 H -1.3996 -0.9057 1.9160 H 1 UNL11111111 0.1674 35 H -2.2579 0.6274 2.1705 H 1 UNL11111111 0.1328 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 4 5 1 5 4 6 1 6 4 7 1 7 7 8 2 8 7 9 1 9 9 10 1 10 9 11 1 11 11 12 1 12 11 13 1 13 11 14 1 14 14 15 1 15 9 15 1 16 1 16 1 17 1 17 1 18 1 18 1 19 2 19 1 20 2 20 1 21 3 21 1 22 3 22 1 23 5 23 1 24 5 24 1 25 5 25 1 26 6 26 1 27 6 27 1 28 6 28 1 29 13 29 1 30 13 30 1 31 13 31 1 32 14 32 1 33 14 33 1 34 15 34 1 35 15 35 1