@MOLECULE (2S,3R)-2-(3,3-dimethylcyclobutyl)-3-isopentyl-oxirane 38 39 0 0 0 SMALL USER_CHARGES @ATOM 1 C -1.7421 0.8919 -0.1507 C.3 1 UNL11111111 -0.3172 2 C -3.2882 0.6968 -0.0253 C.3 1 UNL11111111 0.1085 3 C -3.9519 1.7003 0.9030 C.3 1 UNL11111111 -0.4648 4 C -4.0054 0.6243 -1.3626 C.3 1 UNL11111111 -0.4640 5 C -3.0437 -0.6986 0.6335 C.3 1 UNL11111111 -0.3137 6 C -1.5069 -0.4872 0.5288 C.3 1 UNL11111111 -0.1336 7 C -0.7925 -1.4755 -0.3414 C.3 1 UNL11111111 -0.0130 8 H -1.4084 -1.9593 -1.1067 H 1 UNL11111111 0.1497 9 O 0.0927 -2.3737 0.3377 O.3 1 UNL11111111 -0.3595 10 C 0.6908 -1.4090 -0.5350 C.3 1 UNL11111111 0.0074 11 H 1.1278 -1.8486 -1.4376 H 1 UNL11111111 0.1488 12 C 1.5166 -0.3405 0.1342 C.3 1 UNL11111111 -0.2974 13 C 2.9868 -0.4228 -0.2923 C.3 1 UNL11111111 -0.2825 14 C 3.8231 0.7090 0.3358 C.3 1 UNL11111111 -0.0566 15 C 5.3162 0.3812 0.2004 C.3 1 UNL11111111 -0.4577 16 C 3.5222 2.0530 -0.3392 C.3 1 UNL11111111 -0.4539 17 H -1.3790 0.9619 -1.1777 H 1 UNL11111111 0.1450 18 H -1.3455 1.7426 0.4055 H 1 UNL11111111 0.1417 19 H -3.9655 2.7037 0.4622 H 1 UNL11111111 0.1460 20 H -4.9901 1.4201 1.1164 H 1 UNL11111111 0.1477 21 H -3.4282 1.7711 1.8637 H 1 UNL11111111 0.1486 22 H -3.5340 -0.0986 -2.0385 H 1 UNL11111111 0.1475 23 H -5.0517 0.3216 -1.2367 H 1 UNL11111111 0.1479 24 H -4.0018 1.5964 -1.8692 H 1 UNL11111111 0.1464 25 H -3.4158 -0.7910 1.6552 H 1 UNL11111111 0.1451 26 H -3.4323 -1.5442 0.0635 H 1 UNL11111111 0.1454 27 H -1.0221 -0.4099 1.5193 H 1 UNL11111111 0.1554 28 H 1.1021 0.6592 -0.1081 H 1 UNL11111111 0.1518 29 H 1.4375 -0.4395 1.2376 H 1 UNL11111111 0.1613 30 H 3.4028 -1.4045 0.0078 H 1 UNL11111111 0.1445 31 H 3.0711 -0.3820 -1.3935 H 1 UNL11111111 0.1384 32 H 3.5715 0.7857 1.4211 H 1 UNL11111111 0.1308 33 H 5.6084 0.2651 -0.8485 H 1 UNL11111111 0.1439 34 H 5.9369 1.1757 0.6276 H 1 UNL11111111 0.1420 35 H 5.5700 -0.5485 0.7209 H 1 UNL11111111 0.1440 36 H 4.1068 2.8616 0.1118 H 1 UNL11111111 0.1402 37 H 3.7644 2.0285 -1.4070 H 1 UNL11111111 0.1434 38 H 2.4645 2.3212 -0.2471 H 1 UNL11111111 0.1421 @BOND 1 1 2 1 2 2 3 1 3 2 4 1 4 2 5 1 5 5 6 1 6 1 6 1 7 6 7 1 8 7 8 1 9 7 9 1 10 9 10 1 11 10 11 1 12 7 10 1 13 10 12 1 14 12 13 1 15 13 14 1 16 14 15 1 17 14 16 1 18 1 17 1 19 1 18 1 20 3 19 1 21 3 20 1 22 3 21 1 23 4 22 1 24 4 23 1 25 4 24 1 26 5 25 1 27 5 26 1 28 6 27 1 29 12 28 1 30 12 29 1 31 13 30 1 32 13 31 1 33 14 32 1 34 15 33 1 35 15 34 1 36 15 35 1 37 16 36 1 38 16 37 1 39 16 38 1