@MOLECULE (2R)-1,1-dimethyl-2-[(S)-[(1S)-1-methylbutyl]sulfinyl]cyclopropane 32 32 0 0 0 SMALL USER_CHARGES @ATOM 1 C 2.8252 -0.1751 0.0865 C.3 1 UNL111 0.1060 2 C 2.9917 -1.2816 -0.9225 C.3 1 UNL111 -0.4531 3 C 3.7513 -0.3274 1.2703 C.3 1 UNL111 -0.4511 4 C 2.4806 1.2236 -0.3872 C.3 1 UNL111 -0.3433 5 C 1.4510 0.4212 0.3677 C.3 1 UNL111 -0.4384 6 H 1.2369 0.6898 1.4060 H 1 UNL111 0.1702 7 S -0.0197 -0.1897 -0.5061 S.O 1 UNL111 1.0595 8 O -0.2998 -1.5343 0.0647 O.2 1 UNL111 -0.7992 9 C -1.2685 0.9544 0.2775 C.3 1 UNL111 -0.2960 10 H -1.2112 0.8404 1.3834 H 1 UNL111 0.1550 11 C -0.9403 2.3903 -0.1114 C.3 1 UNL111 -0.4480 12 C -2.6795 0.5819 -0.1875 C.3 1 UNL111 -0.2640 13 C -3.2247 -0.6617 0.5295 C.3 1 UNL111 -0.2615 14 C -4.6717 -0.9323 0.1167 C.3 1 UNL111 -0.4412 15 H 2.5073 -2.2074 -0.5688 H 1 UNL111 0.1750 16 H 2.5566 -1.0433 -1.9002 H 1 UNL111 0.1517 17 H 4.0502 -1.5129 -1.0948 H 1 UNL111 0.1486 18 H 4.8028 -0.3094 0.9583 H 1 UNL111 0.1507 19 H 3.6200 0.4658 2.0149 H 1 UNL111 0.1474 20 H 3.5732 -1.2841 1.7819 H 1 UNL111 0.1616 21 H 2.9366 2.0860 0.0918 H 1 UNL111 0.1561 22 H 2.3651 1.4201 -1.4496 H 1 UNL111 0.1593 23 H -1.0221 2.5631 -1.1920 H 1 UNL111 0.1489 24 H -1.6379 3.0902 0.3707 H 1 UNL111 0.1514 25 H 0.0667 2.6973 0.1999 H 1 UNL111 0.1485 26 H -3.3624 1.4350 0.0070 H 1 UNL111 0.1372 27 H -2.7183 0.4315 -1.2833 H 1 UNL111 0.1394 28 H -2.5957 -1.5508 0.3028 H 1 UNL111 0.1760 29 H -3.1592 -0.5329 1.6255 H 1 UNL111 0.1343 30 H -4.7549 -1.0951 -0.9633 H 1 UNL111 0.1395 31 H -5.0586 -1.8301 0.6127 H 1 UNL111 0.1436 32 H -5.3309 -0.0992 0.3809 H 1 UNL111 0.1358 @BOND 1 1 2 1 2 1 3 1 3 1 4 1 4 4 5 1 5 5 6 1 6 1 5 1 7 5 7 1 8 7 8 2 9 7 9 1 10 9 10 1 11 9 11 1 12 9 12 1 13 12 13 1 14 13 14 1 15 2 15 1 16 2 16 1 17 2 17 1 18 3 18 1 19 3 19 1 20 3 20 1 21 4 21 1 22 4 22 1 23 11 23 1 24 11 24 1 25 11 25 1 26 12 26 1 27 12 27 1 28 13 28 1 29 13 29 1 30 14 30 1 31 14 31 1 32 14 32 1