@MOLECULE (1R,2S)-1-[(R)-isobutylsulfinyl]-2-methyl-cyclopropane 26 26 0 0 0 SMALL USER_CHARGES @ATOM 1 C 2.4954 -0.0098 0.2959 C.3 1 UNL11111111 -0.0366 2 C 3.1108 -0.9620 -0.7375 C.3 1 UNL11111111 -0.4563 3 C 3.5078 1.0945 0.6420 C.3 1 UNL11111111 -0.4563 4 C 1.2077 0.6387 -0.2242 C.3 1 UNL11111111 -0.5108 5 S -0.1674 -0.5840 -0.3483 S.O 1 UNL11111111 1.0992 6 O -0.4069 -1.0549 1.0406 O.2 1 UNL11111111 -0.8083 7 C -1.4573 0.6178 -0.7642 C.3 1 UNL11111111 -0.4436 8 H -1.2567 1.0365 -1.7552 H 1 UNL11111111 0.1656 9 C -2.0929 1.5075 0.2753 C.3 1 UNL11111111 -0.3186 10 C -2.9143 0.4207 -0.3777 C.3 1 UNL11111111 -0.0768 11 H -3.6572 0.7254 -1.1296 H 1 UNL11111111 0.1440 12 C -3.3848 -0.7583 0.4260 C.3 1 UNL11111111 -0.4538 13 H 2.2717 -0.5843 1.2332 H 1 UNL11111111 0.1538 14 H 2.4915 -1.8515 -0.8974 H 1 UNL11111111 0.1492 15 H 3.2534 -0.4726 -1.7058 H 1 UNL11111111 0.1398 16 H 4.0923 -1.3185 -0.4044 H 1 UNL11111111 0.1424 17 H 3.7556 1.7028 -0.2332 H 1 UNL11111111 0.1409 18 H 3.1183 1.7644 1.4163 H 1 UNL11111111 0.1450 19 H 4.4423 0.6678 1.0221 H 1 UNL11111111 0.1437 20 H 0.9108 1.4619 0.4502 H 1 UNL11111111 0.1649 21 H 1.3709 1.0909 -1.2141 H 1 UNL11111111 0.1566 22 H -1.8120 1.4029 1.3247 H 1 UNL11111111 0.1754 23 H -2.2853 2.5513 0.0465 H 1 UNL11111111 0.1523 24 H -4.3542 -0.5525 0.8971 H 1 UNL11111111 0.1476 25 H -3.4973 -1.6548 -0.1962 H 1 UNL11111111 0.1498 26 H -2.6890 -1.0250 1.2424 H 1 UNL11111111 0.1911 @BOND 1 1 2 1 2 1 3 1 3 1 4 1 4 4 5 1 5 5 6 2 6 5 7 1 7 7 8 1 8 7 9 1 9 9 10 1 10 10 11 1 11 7 10 1 12 10 12 1 13 1 13 1 14 2 14 1 15 2 15 1 16 2 16 1 17 3 17 1 18 3 18 1 19 3 19 1 20 4 20 1 21 4 21 1 22 9 22 1 23 9 23 1 24 12 24 1 25 12 25 1 26 12 26 1