@MOLECULE [(R)-1,1-dimethylbutylsulfinyl]cyclohexane 38 38 0 0 0 SMALL USER_CHARGES @ATOM 1 C 2.0855 -1.0112 0.3559 C.3 1 UNL11111111 -0.2597 2 C 3.2578 -0.3284 1.0753 C.3 1 UNL11111111 -0.2634 3 C 3.8658 0.7687 0.1910 C.3 1 UNL11111111 -0.2650 4 C 2.7965 1.7916 -0.2158 C.3 1 UNL11111111 -0.2611 5 C 1.6291 1.0955 -0.9370 C.3 1 UNL11111111 -0.2588 6 C 1.0281 0.0272 -0.0200 C.3 1 UNL11111111 -0.3004 7 S -0.3971 -0.7844 -0.9000 S.O 1 UNL11111111 0.9549 8 O -0.0479 -2.2304 -0.9928 O.2 1 UNL11111111 -0.7894 9 C -1.7290 -0.7061 0.4269 C.3 1 UNL11111111 -0.0878 10 C -2.9527 -1.4016 -0.1664 C.3 1 UNL11111111 -0.4505 11 C -1.2721 -1.4701 1.6692 C.3 1 UNL11111111 -0.4693 12 C -2.0414 0.7463 0.8108 C.3 1 UNL11111111 -0.2959 13 C -2.4943 1.6470 -0.3469 C.3 1 UNL11111111 -0.2430 14 C -2.8755 3.0324 0.1799 C.3 1 UNL11111111 -0.4420 15 H 2.4535 -1.5442 -0.5453 H 1 UNL11111111 0.1593 16 H 1.6559 -1.8065 0.9966 H 1 UNL11111111 0.1471 17 H 2.9174 0.1025 2.0345 H 1 UNL11111111 0.1317 18 H 4.0283 -1.0782 1.3329 H 1 UNL11111111 0.1335 19 H 4.6915 1.2732 0.7237 H 1 UNL11111111 0.1272 20 H 4.3163 0.3148 -0.7117 H 1 UNL11111111 0.1379 21 H 2.4252 2.3261 0.6777 H 1 UNL11111111 0.1325 22 H 3.2386 2.5630 -0.8714 H 1 UNL11111111 0.1267 23 H 0.8740 1.8496 -1.2280 H 1 UNL11111111 0.1295 24 H 1.9994 0.6456 -1.8797 H 1 UNL11111111 0.1473 25 H 0.6549 0.5169 0.9064 H 1 UNL11111111 0.1472 26 H -2.7470 -2.4595 -0.3967 H 1 UNL11111111 0.1679 27 H -3.7925 -1.3890 0.5397 H 1 UNL11111111 0.1454 28 H -3.3079 -0.9339 -1.0921 H 1 UNL11111111 0.1464 29 H -0.4366 -0.9890 2.1887 H 1 UNL11111111 0.1428 30 H -2.0872 -1.5664 2.3975 H 1 UNL11111111 0.1497 31 H -0.9529 -2.4959 1.4186 H 1 UNL11111111 0.1757 32 H -2.8412 0.7327 1.5828 H 1 UNL11111111 0.1491 33 H -1.1748 1.2126 1.3205 H 1 UNL11111111 0.1373 34 H -1.7005 1.7509 -1.1094 H 1 UNL11111111 0.1374 35 H -3.3599 1.1954 -0.8683 H 1 UNL11111111 0.1390 36 H -2.0326 3.5178 0.6840 H 1 UNL11111111 0.1426 37 H -3.1953 3.6922 -0.6338 H 1 UNL11111111 0.1382 38 H -3.7005 2.9770 0.8982 H 1 UNL11111111 0.1401 @BOND 1 24 5 1 2 23 5 1 3 34 13 1 4 28 10 1 5 8 7 2 6 5 4 1 7 5 6 1 8 7 6 1 9 7 9 1 10 22 4 1 11 35 13 1 12 20 3 1 13 37 14 1 14 15 1 1 15 26 10 1 16 13 14 1 17 13 12 1 18 4 3 1 19 4 21 1 20 10 9 1 21 10 27 1 22 6 1 1 23 6 25 1 24 14 36 1 25 14 38 1 26 3 19 1 27 3 2 1 28 1 16 1 29 1 2 1 30 9 12 1 31 9 11 1 32 12 33 1 33 12 32 1 34 2 18 1 35 2 17 1 36 31 11 1 37 11 29 1 38 11 30 1