@MOLECULE (2S,3R)-2-(2,2-dimethylbutyl)-3-methyl-oxirane 28 28 0 0 0 SMALL USER_CHARGES @ATOM 1 C 3.1991 1.3102 0.0744 C.3 1 UNL11111111 -0.4615 2 C 2.7834 -0.0749 -0.3270 C.3 1 UNL11111111 0.0165 3 H 3.5089 -0.6143 -0.9453 H 1 UNL11111111 0.1447 4 O 2.2019 -0.8796 0.7046 O.3 1 UNL11111111 -0.3664 5 C 1.3430 -0.4814 -0.3716 C.3 1 UNL11111111 0.0123 6 H 1.0479 -1.3122 -1.0210 H 1 UNL11111111 0.1497 7 C 0.2511 0.4913 -0.0143 C.3 1 UNL11111111 -0.3313 8 C -1.1775 -0.1071 -0.1080 C.3 1 UNL11111111 0.1151 9 C -1.4823 -0.5124 -1.5567 C.3 1 UNL11111111 -0.4644 10 C -1.2867 -1.3283 0.8127 C.3 1 UNL11111111 -0.4626 11 C -2.1537 1.0052 0.3564 C.3 1 UNL11111111 -0.2779 12 C -3.6260 0.5964 0.3311 C.3 1 UNL11111111 -0.4317 13 H 4.2709 1.3570 0.3089 H 1 UNL11111111 0.1559 14 H 2.9995 2.0340 -0.7262 H 1 UNL11111111 0.1543 15 H 2.6651 1.6495 0.9739 H 1 UNL11111111 0.1651 16 H 0.4173 0.8625 1.0196 H 1 UNL11111111 0.1620 17 H 0.3213 1.3810 -0.6710 H 1 UNL11111111 0.1488 18 H -0.7987 -1.2897 -1.9129 H 1 UNL11111111 0.1425 19 H -2.4969 -0.9149 -1.6512 H 1 UNL11111111 0.1487 20 H -1.4007 0.3406 -2.2372 H 1 UNL11111111 0.1428 21 H -1.1300 -1.0525 1.8613 H 1 UNL11111111 0.1490 22 H -2.2704 -1.8023 0.7357 H 1 UNL11111111 0.1457 23 H -0.5354 -2.0876 0.5671 H 1 UNL11111111 0.1506 24 H -1.8824 1.3164 1.3841 H 1 UNL11111111 0.1363 25 H -2.0135 1.8998 -0.2796 H 1 UNL11111111 0.1324 26 H -4.2635 1.4103 0.6951 H 1 UNL11111111 0.1373 27 H -3.9599 0.3481 -0.6819 H 1 UNL11111111 0.1411 28 H -3.8150 -0.2763 0.9663 H 1 UNL11111111 0.1450 @BOND 1 1 2 1 2 2 3 1 3 2 4 1 4 4 5 1 5 5 6 1 6 2 5 1 7 5 7 1 8 7 8 1 9 8 9 1 10 8 10 1 11 8 11 1 12 11 12 1 13 1 13 1 14 1 14 1 15 1 15 1 16 7 16 1 17 7 17 1 18 9 18 1 19 9 19 1 20 9 20 1 21 10 21 1 22 10 22 1 23 10 23 1 24 11 24 1 25 11 25 1 26 12 26 1 27 12 27 1 28 12 28 1