@MOLECULE (2R,3R)-2-(2,2-dimethylbutyl)-3-methyl-oxirane 28 28 0 0 0 SMALL USER_CHARGES @ATOM 1 C 3.8315 -0.7144 -0.0922 C.3 1 UNL11111111 -0.4655 2 C 2.6612 -0.0314 0.5528 C.3 1 UNL11111111 0.0167 3 H 2.7329 0.1009 1.6361 H 1 UNL11111111 0.1470 4 O 2.1563 1.1186 -0.1348 O.3 1 UNL11111111 -0.3668 5 C 1.3210 -0.0465 -0.1106 C.3 1 UNL11111111 0.0126 6 H 1.2097 -0.5226 -1.0889 H 1 UNL11111111 0.1527 7 C 0.0726 0.0670 0.7233 C.3 1 UNL11111111 -0.3372 8 C -1.2403 -0.0749 -0.0915 C.3 1 UNL11111111 0.1180 9 C -1.2958 1.0109 -1.1728 C.3 1 UNL11111111 -0.4627 10 C -1.3079 -1.4663 -0.7365 C.3 1 UNL11111111 -0.4650 11 C -2.4078 0.1033 0.9137 C.3 1 UNL11111111 -0.2774 12 C -3.7959 -0.0018 0.2834 C.3 1 UNL11111111 -0.4332 13 H 4.7844 -0.2948 0.2585 H 1 UNL11111111 0.1583 14 H 3.8362 -1.7894 0.1298 H 1 UNL11111111 0.1549 15 H 3.8203 -0.5985 -1.1854 H 1 UNL11111111 0.1634 16 H 0.0912 -0.6993 1.5232 H 1 UNL11111111 0.1485 17 H 0.0714 1.0487 1.2443 H 1 UNL11111111 0.1642 18 H -0.4272 0.9618 -1.8393 H 1 UNL11111111 0.1494 19 H -2.1903 0.9129 -1.7960 H 1 UNL11111111 0.1457 20 H -1.3046 2.0138 -0.7314 H 1 UNL11111111 0.1493 21 H -1.2635 -2.2592 0.0166 H 1 UNL11111111 0.1432 22 H -2.2391 -1.5968 -1.2988 H 1 UNL11111111 0.1485 23 H -0.4851 -1.6298 -1.4397 H 1 UNL11111111 0.1422 24 H -2.3146 -0.6535 1.7161 H 1 UNL11111111 0.1328 25 H -2.3095 1.0876 1.4111 H 1 UNL11111111 0.1367 26 H -4.5783 0.1603 1.0336 H 1 UNL11111111 0.1376 27 H -3.9398 0.7450 -0.5054 H 1 UNL11111111 0.1450 28 H -3.9670 -0.9891 -0.1585 H 1 UNL11111111 0.1412 @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