@MOLECULE 1-[(R)-butylsulfinyl]-3,3-dimethyl-butane 34 33 0 0 0 SMALL USER_CHARGES @ATOM 1 C 5.8038 -0.3885 -0.0236 C.3 1 UNL11111111 -0.4422 2 C 4.4053 -0.9597 -0.2579 C.3 1 UNL11111111 -0.2507 3 C 3.3264 0.0523 0.1622 C.3 1 UNL11111111 -0.2507 4 C 1.9325 -0.5285 -0.0583 C.3 1 UNL11111111 -0.4997 5 S 0.6550 0.7014 0.4515 S.O 1 UNL11111111 1.0579 6 O 0.7183 1.7987 -0.5446 O.2 1 UNL11111111 -0.7930 7 C -0.8255 -0.3066 0.0125 C.3 1 UNL11111111 -0.4923 8 C -2.0921 0.4932 0.2974 C.3 1 UNL11111111 -0.2788 9 C -3.3942 -0.2776 -0.0393 C.3 1 UNL11111111 0.1300 10 C -3.4985 -1.5686 0.7875 C.3 1 UNL11111111 -0.4675 11 C -4.5834 0.6359 0.3146 C.3 1 UNL11111111 -0.4727 12 C -3.4532 -0.6160 -1.5359 C.3 1 UNL11111111 -0.4662 13 H 5.9613 0.5326 -0.5973 H 1 UNL11111111 0.1482 14 H 5.9708 -0.1506 1.0324 H 1 UNL11111111 0.1406 15 H 6.5796 -1.1000 -0.3272 H 1 UNL11111111 0.1409 16 H 4.2802 -1.2224 -1.3257 H 1 UNL11111111 0.1365 17 H 4.2831 -1.9041 0.3038 H 1 UNL11111111 0.1294 18 H 3.4813 0.3358 1.2212 H 1 UNL11111111 0.1377 19 H 3.4544 0.9887 -0.4232 H 1 UNL11111111 0.1583 20 H 1.8031 -0.8030 -1.1194 H 1 UNL11111111 0.1624 21 H 1.7954 -1.4501 0.5280 H 1 UNL11111111 0.1526 22 H -0.7938 -0.5969 -1.0518 H 1 UNL11111111 0.1641 23 H -0.8078 -1.2387 0.5984 H 1 UNL11111111 0.1543 24 H -2.1313 0.8008 1.3610 H 1 UNL11111111 0.1389 25 H -2.0835 1.4380 -0.2903 H 1 UNL11111111 0.1597 26 H -3.4100 -1.3659 1.8593 H 1 UNL11111111 0.1417 27 H -4.4626 -2.0624 0.6249 H 1 UNL11111111 0.1434 28 H -2.7190 -2.2869 0.5168 H 1 UNL11111111 0.1416 29 H -4.5544 1.5684 -0.2593 H 1 UNL11111111 0.1494 30 H -5.5384 0.1477 0.0960 H 1 UNL11111111 0.1453 31 H -4.5853 0.8981 1.3770 H 1 UNL11111111 0.1419 32 H -2.7097 -1.3703 -1.8107 H 1 UNL11111111 0.1423 33 H -4.4351 -1.0119 -1.8157 H 1 UNL11111111 0.1448 34 H -3.2685 0.2714 -2.1520 H 1 UNL11111111 0.1518 @BOND 1 34 12 1 2 33 12 1 3 32 12 1 4 12 9 1 5 16 2 1 6 20 4 1 7 22 7 1 8 13 1 1 9 6 5 2 10 19 3 1 11 15 1 1 12 25 8 1 13 29 11 1 14 2 1 1 15 2 3 1 16 2 17 1 17 4 3 1 18 4 5 1 19 4 21 1 20 9 8 1 21 9 11 1 22 9 10 1 23 1 14 1 24 7 8 1 25 7 5 1 26 7 23 1 27 30 11 1 28 3 18 1 29 8 24 1 30 11 31 1 31 28 10 1 32 27 10 1 33 10 26 1