@MOLECULE (2S,3S)-3-(1,1-dimethylbutyl)-2-ethyl-2-methyl-oxirane 34 34 0 0 0 SMALL USER_CHARGES @ATOM 1 C 3.8224 1.7658 0.2830 C.3 1 UNL11111111 -0.4423 2 C 3.1382 0.4285 -0.0056 C.3 1 UNL11111111 -0.2427 3 C 1.6628 0.4780 0.4089 C.3 1 UNL11111111 -0.2945 4 C 0.8745 -0.7970 0.0312 C.3 1 UNL11111111 0.0874 5 C 0.9208 -1.0653 -1.4767 C.3 1 UNL11111111 -0.4570 6 C 1.4472 -2.0238 0.7673 C.3 1 UNL11111111 -0.4612 7 C -0.5532 -0.5998 0.5350 C.3 1 UNL11111111 -0.0488 8 H -0.6605 -0.8622 1.5977 H 1 UNL11111111 0.1453 9 O -1.6264 -1.0957 -0.2672 O.3 1 UNL11111111 -0.3688 10 C -1.5896 0.3200 -0.0433 C.3 1 UNL11111111 0.1772 11 C -1.3495 1.1641 -1.2626 C.3 1 UNL11111111 -0.4672 12 C -2.6777 0.8300 0.8844 C.3 1 UNL11111111 -0.2822 13 C -4.0597 0.5644 0.2874 C.3 1 UNL11111111 -0.4265 14 H 3.3536 2.5842 -0.2743 H 1 UNL11111111 0.1413 15 H 3.7729 2.0202 1.3473 H 1 UNL11111111 0.1415 16 H 4.8799 1.7388 -0.0009 H 1 UNL11111111 0.1391 17 H 3.2270 0.1870 -1.0815 H 1 UNL11111111 0.1371 18 H 3.6580 -0.3861 0.5326 H 1 UNL11111111 0.1348 19 H 1.5922 0.6441 1.5009 H 1 UNL11111111 0.1384 20 H 1.1794 1.3571 -0.0588 H 1 UNL11111111 0.1393 21 H 1.8566 -1.5516 -1.7712 H 1 UNL11111111 0.1442 22 H 0.0975 -1.7277 -1.7801 H 1 UNL11111111 0.1649 23 H 0.8366 -0.1437 -2.0603 H 1 UNL11111111 0.1440 24 H 1.5065 -1.8586 1.8473 H 1 UNL11111111 0.1425 25 H 0.8206 -2.9074 0.5947 H 1 UNL11111111 0.1540 26 H 2.4559 -2.2657 0.4175 H 1 UNL11111111 0.1472 27 H -2.2183 1.7893 -1.5074 H 1 UNL11111111 0.1578 28 H -0.4898 1.8328 -1.1294 H 1 UNL11111111 0.1543 29 H -1.1566 0.5377 -2.1468 H 1 UNL11111111 0.1697 30 H -2.6054 0.3393 1.8761 H 1 UNL11111111 0.1455 31 H -2.5333 1.9113 1.0739 H 1 UNL11111111 0.1451 32 H -4.2178 1.1268 -0.6391 H 1 UNL11111111 0.1417 33 H -4.1792 -0.5012 0.0440 H 1 UNL11111111 0.1592 34 H -4.8574 0.8375 0.9855 H 1 UNL11111111 0.1392 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 4 5 1 5 4 6 1 6 4 7 1 7 7 8 1 8 7 9 1 9 9 10 1 10 7 10 1 11 10 11 1 12 10 12 1 13 12 13 1 14 1 14 1 15 1 15 1 16 1 16 1 17 2 17 1 18 2 18 1 19 3 19 1 20 3 20 1 21 5 21 1 22 5 22 1 23 5 23 1 24 6 24 1 25 6 25 1 26 6 26 1 27 11 27 1 28 11 28 1 29 11 29 1 30 12 30 1 31 12 31 1 32 13 32 1 33 13 33 1 34 13 34 1