@MOLECULE (2R,3R)-2-(3,3-dimethylbutyl)-3-[(1R)-1-methylbutyl]oxirane 40 40 0 0 0 SMALL USER_CHARGES @ATOM 1 C -4.3275 1.3342 0.4698 C.3 1 UNL11111111 -0.4654 2 C -3.9612 -0.0918 0.0342 C.3 1 UNL11111111 0.1321 3 C -3.9856 -1.0279 1.2522 C.3 1 UNL11111111 -0.4659 4 C -5.0014 -0.5831 -0.9915 C.3 1 UNL11111111 -0.4707 5 C -2.5740 -0.1201 -0.6489 C.3 1 UNL11111111 -0.2932 6 C -1.4364 0.3860 0.2437 C.3 1 UNL11111111 -0.2991 7 C -0.1071 0.2873 -0.4628 C.3 1 UNL11111111 0.0073 8 H -0.1301 -0.1151 -1.4792 H 1 UNL11111111 0.1505 9 O 0.7433 1.4329 -0.3203 O.3 1 UNL11111111 -0.3666 10 C 1.1591 0.2271 0.3283 C.3 1 UNL11111111 -0.0152 11 H 1.1238 0.2746 1.4197 H 1 UNL11111111 0.1495 12 C 2.3957 -0.4288 -0.2521 C.3 1 UNL11111111 -0.1119 13 H 2.4322 -0.2380 -1.3537 H 1 UNL11111111 0.1502 14 C 2.3156 -1.9374 -0.0003 C.3 1 UNL11111111 -0.4481 15 C 3.6467 0.1930 0.3941 C.3 1 UNL11111111 -0.2818 16 C 4.9204 -0.1607 -0.3846 C.3 1 UNL11111111 -0.2471 17 C 6.1504 0.4617 0.2768 C.3 1 UNL11111111 -0.4393 18 H -3.6662 1.6970 1.2633 H 1 UNL11111111 0.1455 19 H -4.2566 2.0375 -0.3668 H 1 UNL11111111 0.1471 20 H -5.3516 1.3802 0.8546 H 1 UNL11111111 0.1437 21 H -4.9900 -1.0886 1.6838 H 1 UNL11111111 0.1430 22 H -3.6813 -2.0438 0.9811 H 1 UNL11111111 0.1434 23 H -3.3140 -0.6795 2.0432 H 1 UNL11111111 0.1444 24 H -5.0395 0.0722 -1.8674 H 1 UNL11111111 0.1451 25 H -4.7724 -1.5944 -1.3409 H 1 UNL11111111 0.1425 26 H -6.0055 -0.6065 -0.5566 H 1 UNL11111111 0.1442 27 H -2.3566 -1.1552 -0.9752 H 1 UNL11111111 0.1378 28 H -2.6148 0.4897 -1.5725 H 1 UNL11111111 0.1432 29 H -1.6178 1.4433 0.5341 H 1 UNL11111111 0.1660 30 H -1.4126 -0.1839 1.1928 H 1 UNL11111111 0.1492 31 H 3.2019 -2.4531 -0.3864 H 1 UNL11111111 0.1471 32 H 2.2469 -2.1657 1.0691 H 1 UNL11111111 0.1461 33 H 1.4401 -2.3770 -0.4912 H 1 UNL11111111 0.1453 34 H 3.5300 1.2953 0.4297 H 1 UNL11111111 0.1495 35 H 3.7392 -0.1362 1.4447 H 1 UNL11111111 0.1383 36 H 5.0401 -1.2587 -0.4431 H 1 UNL11111111 0.1321 37 H 4.8343 0.1925 -1.4300 H 1 UNL11111111 0.1355 38 H 6.0659 1.5532 0.3319 H 1 UNL11111111 0.1455 39 H 6.2871 0.0899 1.2982 H 1 UNL11111111 0.1410 40 H 7.0626 0.2299 -0.2837 H 1 UNL11111111 0.1394 @BOND 1 1 2 1 2 2 3 1 3 2 4 1 4 2 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 12 15 1 16 15 16 1 17 16 17 1 18 1 18 1 19 1 19 1 20 1 20 1 21 3 21 1 22 3 22 1 23 3 23 1 24 4 24 1 25 4 25 1 26 4 26 1 27 5 27 1 28 5 28 1 29 6 29 1 30 6 30 1 31 14 31 1 32 14 32 1 33 14 33 1 34 15 34 1 35 15 35 1 36 16 36 1 37 16 37 1 38 17 38 1 39 17 39 1 40 17 40 1