@MOLECULE [(S)-[(1R)-1-methylbutyl]sulfinyl]cyclopropane 26 26 0 0 0 SMALL USER_CHARGES @ATOM 1 C -3.0284 0.6350 -0.0680 C.3 1 UNL11111111 -0.2894 2 C -3.2902 -0.7756 0.3878 C.3 1 UNL11111111 -0.2830 3 C -2.0012 -0.0875 0.7710 C.3 1 UNL11111111 -0.4033 4 S -0.4492 -0.6857 0.0446 S.O 1 UNL11111111 1.0495 5 O -0.6602 -0.7543 -1.4249 O.2 1 UNL11111111 -0.7923 6 C 0.6087 0.8151 0.3527 C.3 1 UNL11111111 -0.2914 7 H 0.6797 0.9375 1.4556 H 1 UNL11111111 0.1455 8 C 0.0077 2.0692 -0.2671 C.3 1 UNL11111111 -0.4508 9 C 2.0013 0.5611 -0.2327 C.3 1 UNL11111111 -0.2741 10 C 2.8441 -0.3994 0.6179 C.3 1 UNL11111111 -0.2488 11 C 4.2462 -0.5416 0.0220 C.3 1 UNL11111111 -0.4413 12 H -2.8275 0.8230 -1.1263 H 1 UNL11111111 0.1781 13 H -3.5885 1.4620 0.3586 H 1 UNL11111111 0.1512 14 H -4.0367 -0.9725 1.1530 H 1 UNL11111111 0.1514 15 H -3.2887 -1.5832 -0.3458 H 1 UNL11111111 0.1708 16 H -1.8588 0.2180 1.8096 H 1 UNL11111111 0.1649 17 H -0.9602 2.3381 0.1730 H 1 UNL11111111 0.1467 18 H 0.6672 2.9365 -0.1321 H 1 UNL11111111 0.1477 19 H -0.1477 1.9530 -1.3517 H 1 UNL11111111 0.1686 20 H 1.9283 0.1857 -1.2760 H 1 UNL11111111 0.1621 21 H 2.5406 1.5271 -0.3227 H 1 UNL11111111 0.1431 22 H 2.9125 -0.0290 1.6576 H 1 UNL11111111 0.1287 23 H 2.3675 -1.3960 0.6782 H 1 UNL11111111 0.1406 24 H 4.8648 -1.2217 0.6170 H 1 UNL11111111 0.1370 25 H 4.2070 -0.9409 -0.9989 H 1 UNL11111111 0.1483 26 H 4.7655 0.4219 -0.0212 H 1 UNL11111111 0.1400 @BOND 1 1 2 1 2 2 3 1 3 1 3 1 4 3 4 1 5 4 5 2 6 4 6 1 7 6 7 1 8 6 8 1 9 6 9 1 10 9 10 1 11 10 11 1 12 1 12 1 13 1 13 1 14 2 14 1 15 2 15 1 16 3 16 1 17 8 17 1 18 8 18 1 19 8 19 1 20 9 20 1 21 9 21 1 22 10 22 1 23 10 23 1 24 11 24 1 25 11 25 1 26 11 26 1