@MOLECULE (2S,3R)-2-cyclohexyl-3-ethyl-oxirane 29 30 0 0 0 SMALL USER_CHARGES @ATOM 1 C 3.9990 -0.7751 -0.7733 C.3 1 UNL11111111 -0.4314 2 C 2.4964 -0.7957 -0.4935 C.3 1 UNL11111111 -0.2740 3 C 2.1473 0.1648 0.6148 C.3 1 UNL11111111 0.0049 4 H 2.8871 0.2252 1.4211 H 1 UNL11111111 0.1490 5 O 1.6475 1.4408 0.1994 O.3 1 UNL11111111 -0.3584 6 C 0.7397 0.5833 0.8988 C.3 1 UNL11111111 -0.0268 7 H 0.4872 0.9423 1.9032 H 1 UNL11111111 0.1483 8 C -0.4415 0.0854 0.0974 C.3 1 UNL11111111 -0.1209 9 C -1.1856 -1.0018 0.8916 C.3 1 UNL11111111 -0.2736 10 C -2.4087 -1.4833 0.1001 C.3 1 UNL11111111 -0.2603 11 C -3.3457 -0.3092 -0.2163 C.3 1 UNL11111111 -0.2640 12 C -2.6011 0.7842 -0.9942 C.3 1 UNL11111111 -0.2616 13 C -1.3798 1.2679 -0.2040 C.3 1 UNL11111111 -0.2695 14 H 4.2562 -1.4266 -1.6159 H 1 UNL11111111 0.1430 15 H 4.3380 0.2378 -1.0273 H 1 UNL11111111 0.1529 16 H 4.5793 -1.1107 0.0930 H 1 UNL11111111 0.1414 17 H 1.9442 -0.5304 -1.4201 H 1 UNL11111111 0.1565 18 H 2.1668 -1.8185 -0.2237 H 1 UNL11111111 0.1457 19 H -0.0976 -0.3456 -0.8738 H 1 UNL11111111 0.1471 20 H -0.5093 -1.8492 1.1045 H 1 UNL11111111 0.1322 21 H -1.5047 -0.6071 1.8741 H 1 UNL11111111 0.1394 22 H -2.0841 -1.9705 -0.8382 H 1 UNL11111111 0.1353 23 H -2.9513 -2.2561 0.6738 H 1 UNL11111111 0.1286 24 H -4.2151 -0.6638 -0.7986 H 1 UNL11111111 0.1280 25 H -3.7559 0.1091 0.7217 H 1 UNL11111111 0.1356 26 H -2.2857 0.3979 -1.9813 H 1 UNL11111111 0.1360 27 H -3.2788 1.6324 -1.2008 H 1 UNL11111111 0.1317 28 H -1.7018 1.7523 0.7354 H 1 UNL11111111 0.1387 29 H -0.8302 2.0412 -0.7744 H 1 UNL11111111 0.1463 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 3 5 1 5 5 6 1 6 6 7 1 7 3 6 1 8 6 8 1 9 8 9 1 10 9 10 1 11 10 11 1 12 11 12 1 13 12 13 1 14 8 13 1 15 1 14 1 16 1 15 1 17 1 16 1 18 2 17 1 19 2 18 1 20 8 19 1 21 9 20 1 22 9 21 1 23 10 22 1 24 10 23 1 25 11 24 1 26 11 25 1 27 12 26 1 28 12 27 1 29 13 28 1 30 13 29 1