@MOLECULE (2S,3S)-2-isohexyl-3-[(1S,2S)-2-methylcyclobutyl]oxirane 38 39 0 0 0 SMALL USER_CHARGES @ATOM 1 C -4.7305 0.0218 -0.2758 C.3 1 UNL11111111 -0.0581 2 C -5.9642 -0.3088 0.5749 C.3 1 UNL11111111 -0.4590 3 C -4.7896 1.4846 -0.7321 C.3 1 UNL11111111 -0.4543 4 C -3.4550 -0.2554 0.5423 C.3 1 UNL11111111 -0.2880 5 C -2.1977 -0.2092 -0.3333 C.3 1 UNL11111111 -0.2642 6 C -0.9464 -0.4727 0.5127 C.3 1 UNL11111111 -0.3005 7 C 0.3017 -0.4126 -0.3298 C.3 1 UNL11111111 0.0081 8 H 0.2025 0.0761 -1.3033 H 1 UNL11111111 0.1523 9 O 1.0797 -1.6143 -0.3665 O.3 1 UNL11111111 -0.3590 10 C 1.6444 -0.4933 0.3237 C.3 1 UNL11111111 -0.0153 11 H 1.7149 -0.6331 1.4065 H 1 UNL11111111 0.1520 12 C 2.8309 0.1386 -0.3343 C.3 1 UNL11111111 -0.1593 13 H 2.8634 -0.1025 -1.4119 H 1 UNL11111111 0.1585 14 C 4.1972 -0.1248 0.3825 C.3 1 UNL11111111 -0.0835 15 H 4.0872 -0.7030 1.3157 H 1 UNL11111111 0.1360 16 C 5.2611 -0.7380 -0.5036 C.3 1 UNL11111111 -0.4525 17 C 4.3473 1.4042 0.6381 C.3 1 UNL11111111 -0.2945 18 C 2.9767 1.6594 -0.0376 C.3 1 UNL11111111 -0.2812 19 H -4.7308 -0.6375 -1.1772 H 1 UNL11111111 0.1307 20 H -6.8897 -0.1358 0.0158 H 1 UNL11111111 0.1431 21 H -5.9624 -1.3574 0.8907 H 1 UNL11111111 0.1427 22 H -6.0055 0.3095 1.4777 H 1 UNL11111111 0.1439 23 H -4.7350 2.1723 0.1181 H 1 UNL11111111 0.1433 24 H -3.9628 1.7267 -1.4082 H 1 UNL11111111 0.1421 25 H -5.7212 1.6959 -1.2677 H 1 UNL11111111 0.1410 26 H -3.3734 0.4736 1.3690 H 1 UNL11111111 0.1378 27 H -3.5340 -1.2493 1.0233 H 1 UNL11111111 0.1388 28 H -2.2720 -0.9591 -1.1442 H 1 UNL11111111 0.1432 29 H -2.1175 0.7745 -0.8332 H 1 UNL11111111 0.1380 30 H -0.8844 0.2646 1.3375 H 1 UNL11111111 0.1479 31 H -1.0212 -1.4671 1.0023 H 1 UNL11111111 0.1635 32 H 5.3988 -0.1730 -1.4332 H 1 UNL11111111 0.1472 33 H 6.2315 -0.7736 0.0058 H 1 UNL11111111 0.1465 34 H 4.9954 -1.7660 -0.7837 H 1 UNL11111111 0.1532 35 H 4.3940 1.6816 1.6925 H 1 UNL11111111 0.1371 36 H 5.1957 1.8669 0.1299 H 1 UNL11111111 0.1415 37 H 3.0194 2.2878 -0.9295 H 1 UNL11111111 0.1396 38 H 2.2125 2.0679 0.6276 H 1 UNL11111111 0.1413 @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