@MOLECULE (2R,3S)-2-(3,3-dimethylbutyl)-3-(1,1-dimethylpropyl)oxirane 40 40 0 0 0 SMALL USER_CHARGES @ATOM 1 C -3.0103 -2.4660 0.2150 C.3 1 UNL11111111 -0.7576 2 C -2.3714 -1.2140 0.8136 C.3 1 UNL11111111 -0.2760 3 C -2.4975 0.0354 -0.0899 C.3 1 UNL11111111 0.7999 4 C -1.9652 -0.2299 -1.5016 C.3 1 UNL11111111 -0.8718 5 C -3.9718 0.4712 -0.1975 C.3 1 UNL11111111 -1.0470 6 C -1.7463 1.1698 0.6031 C.3 1 UNL11111111 -0.5289 7 H -2.3435 1.6518 1.3907 H 1 UNL11111111 0.2540 8 O -1.0501 2.1097 -0.2177 O.3 1 UNL11111111 -0.1065 9 C -0.2608 1.3330 0.6920 C.3 1 UNL11111111 -0.3419 10 H 0.1345 1.9242 1.5285 H 1 UNL11111111 0.2545 11 C 0.7264 0.3778 0.0756 C.3 1 UNL11111111 0.0540 12 C 2.1649 0.7275 0.4755 C.3 1 UNL11111111 -0.8382 13 C 3.2109 -0.2876 -0.0424 C.3 1 UNL11111111 0.7768 14 C 3.1648 -0.3918 -1.5741 C.3 1 UNL11111111 -0.9634 15 C 4.6059 0.2132 0.3801 C.3 1 UNL11111111 -1.0133 16 C 2.9736 -1.6741 0.5765 C.3 1 UNL11111111 -0.9738 17 H -4.0761 -2.3180 0.0084 H 1 UNL11111111 0.2147 18 H -2.5292 -2.7550 -0.7263 H 1 UNL11111111 0.2110 19 H -2.9254 -3.3156 0.9019 H 1 UNL11111111 0.2398 20 H -2.8309 -0.9990 1.7977 H 1 UNL11111111 0.1462 21 H -1.3016 -1.4124 1.0203 H 1 UNL11111111 0.1464 22 H -2.6884 -0.7905 -2.1036 H 1 UNL11111111 0.2244 23 H -1.7632 0.7147 -2.0260 H 1 UNL11111111 0.2354 24 H -1.0372 -0.8084 -1.4903 H 1 UNL11111111 0.2147 25 H -4.4277 0.6183 0.7862 H 1 UNL11111111 0.2692 26 H -4.0590 1.4130 -0.7528 H 1 UNL11111111 0.2676 27 H -4.5708 -0.2776 -0.7258 H 1 UNL11111111 0.2755 28 H 0.4887 -0.6615 0.3784 H 1 UNL11111111 0.1326 29 H 0.6302 0.4074 -1.0311 H 1 UNL11111111 0.1301 30 H 2.4154 1.7358 0.0920 H 1 UNL11111111 0.2512 31 H 2.2431 0.7930 1.5773 H 1 UNL11111111 0.2684 32 H 3.2699 0.5920 -2.0435 H 1 UNL11111111 0.2479 33 H 3.9738 -1.0262 -1.9512 H 1 UNL11111111 0.2595 34 H 2.2228 -0.8259 -1.9236 H 1 UNL11111111 0.2449 35 H 4.6891 0.2968 1.4680 H 1 UNL11111111 0.2747 36 H 5.3915 -0.4707 0.0434 H 1 UNL11111111 0.2750 37 H 4.8237 1.1971 -0.0477 H 1 UNL11111111 0.2519 38 H 2.0290 -2.1114 0.2382 H 1 UNL11111111 0.2604 39 H 3.7710 -2.3718 0.3001 H 1 UNL11111111 0.2647 40 H 2.9444 -1.6232 1.6695 H 1 UNL11111111 0.2732 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 3 5 1 5 3 6 1 6 6 7 1 7 6 8 1 8 8 9 1 9 9 10 1 10 6 9 1 11 9 11 1 12 11 12 1 13 12 13 1 14 13 14 1 15 13 15 1 16 13 16 1 17 1 17 1 18 1 18 1 19 1 19 1 20 2 20 1 21 2 21 1 22 4 22 1 23 4 23 1 24 4 24 1 25 5 25 1 26 5 26 1 27 5 27 1 28 11 28 1 29 11 29 1 30 12 30 1 31 12 31 1 32 14 32 1 33 14 33 1 34 14 34 1 35 15 35 1 36 15 36 1 37 15 37 1 38 16 38 1 39 16 39 1 40 16 40 1