@MOLECULE (2R,3R)-2-isohexyl-3-[(1S,2S)-2-methylcyclobutyl]oxirane 38 39 0 0 0 SMALL USER_CHARGES @ATOM 1 C -4.7317 -0.1452 -0.4718 C.3 1 UNL11111111 -0.0589 2 C -5.8734 -1.1154 -0.1390 C.3 1 UNL11111111 -0.4593 3 C -5.1597 1.2927 -0.1559 C.3 1 UNL11111111 -0.4532 4 C -3.4734 -0.5335 0.3281 C.3 1 UNL11111111 -0.2885 5 C -2.2095 0.1132 -0.2518 C.3 1 UNL11111111 -0.2641 6 C -0.9713 -0.3559 0.5217 C.3 1 UNL11111111 -0.3011 7 C 0.2909 0.2550 -0.0309 C.3 1 UNL11111111 0.0050 8 H 0.2141 0.7151 -1.0197 H 1 UNL11111111 0.1527 9 O 1.0622 1.0234 0.9001 O.3 1 UNL11111111 -0.3570 10 C 1.6193 -0.2207 0.4638 C.3 1 UNL11111111 -0.0149 11 H 1.6606 -0.9777 1.2546 H 1 UNL11111111 0.1514 12 C 2.8287 -0.1617 -0.4185 C.3 1 UNL11111111 -0.1663 13 H 2.6531 -0.7414 -1.3428 H 1 UNL11111111 0.1479 14 C 4.1704 -0.5529 0.2888 C.3 1 UNL11111111 -0.0878 15 H 4.0526 -0.6940 1.3770 H 1 UNL11111111 0.1375 16 C 4.8891 -1.7323 -0.3329 C.3 1 UNL11111111 -0.4542 17 C 4.7555 0.8457 -0.0654 C.3 1 UNL11111111 -0.2914 18 C 3.4038 1.2551 -0.7019 C.3 1 UNL11111111 -0.2706 19 H -4.5057 -0.2227 -1.5624 H 1 UNL11111111 0.1280 20 H -6.7890 -0.8500 -0.6782 H 1 UNL11111111 0.1433 21 H -5.6178 -2.1443 -0.4129 H 1 UNL11111111 0.1404 22 H -6.1074 -1.1048 0.9308 H 1 UNL11111111 0.1452 23 H -5.4179 1.4116 0.9019 H 1 UNL11111111 0.1451 24 H -4.3600 2.0066 -0.3810 H 1 UNL11111111 0.1446 25 H -6.0364 1.5838 -0.7438 H 1 UNL11111111 0.1402 26 H -3.5977 -0.2447 1.3880 H 1 UNL11111111 0.1413 27 H -3.3594 -1.6339 0.3283 H 1 UNL11111111 0.1360 28 H -2.1101 -0.1415 -1.3235 H 1 UNL11111111 0.1360 29 H -2.2890 1.2161 -0.2045 H 1 UNL11111111 0.1442 30 H -1.0749 -0.0905 1.5955 H 1 UNL11111111 0.1635 31 H -0.9026 -1.4616 0.4903 H 1 UNL11111111 0.1481 32 H 5.0492 -1.5940 -1.4088 H 1 UNL11111111 0.1472 33 H 5.8744 -1.8825 0.1251 H 1 UNL11111111 0.1475 34 H 4.3193 -2.6601 -0.2026 H 1 UNL11111111 0.1454 35 H 5.0479 1.4425 0.8012 H 1 UNL11111111 0.1412 36 H 5.5952 0.8228 -0.7626 H 1 UNL11111111 0.1396 37 H 3.4549 1.5196 -1.7590 H 1 UNL11111111 0.1349 38 H 2.8831 2.0616 -0.1723 H 1 UNL11111111 0.1608 @BOND 1 1 2 1 2 1 3 1 3 1 4 1 4 4 5 1 5 5 6 1 6 6 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 12 13 1 14 12 14 1 15 14 15 1 16 14 16 1 17 14 17 1 18 17 18 1 19 12 18 1 20 1 19 1 21 2 20 1 22 2 21 1 23 2 22 1 24 3 23 1 25 3 24 1 26 3 25 1 27 4 26 1 28 4 27 1 29 5 28 1 30 5 29 1 31 6 30 1 32 6 31 1 33 16 32 1 34 16 33 1 35 16 34 1 36 17 35 1 37 17 36 1 38 18 37 1 39 18 38 1