@MOLECULE (2r,3s)-2-[(2s,3r)-3-methyl-2-oxiranyl]-6-oxo-3,6-dihydro-2h-pyran-3-yl acetate 27 28 0 0 0 SMALL GASTEIGER @ATOM 1 O -2.2966 -1.4203 0.8999 O.3 1 UNL1111111111 -0.3562 2 O -0.6556 1.5216 -0.3274 O.3 1 UNL1111111111 -0.4026 3 O 0.9820 -0.8840 -0.3249 O.3 1 UNL1111111111 -0.4243 4 O 0.3451 3.3045 -1.0728 O.2 1 UNL1111111111 -0.4239 5 O 2.8078 -1.7358 0.6663 O.2 1 UNL1111111111 -0.5036 6 C -1.6774 -0.5298 -0.0281 C.3 1 UNL1111111111 -0.0266 7 C -3.1392 -0.4454 0.2654 C.3 1 UNL1111111111 0.0510 8 C -0.7171 0.4559 0.6105 C.3 1 UNL1111111111 0.0733 9 C 0.6524 -0.1936 0.8809 C.3 1 UNL1111111111 0.0574 10 C -4.1291 -0.9801 -0.7249 C.3 1 UNL1111111111 -0.4655 11 C 1.6843 0.8672 1.1360 C.2 1 UNL1111111111 -0.1045 12 C 0.4175 2.3743 -0.3140 C.2 1 UNL1111111111 0.5907 13 C 1.5463 2.0737 0.5842 C.2 1 UNL1111111111 -0.2725 14 C 2.1047 -1.6599 -0.3058 C.2 1 UNL1111111111 0.6311 15 C 2.2593 -2.3252 -1.6258 C.3 1 UNL1111111111 -0.5097 16 H -1.3185 -0.9860 -0.9560 H 1 UNL1111111111 0.1790 17 H -3.5196 0.3206 0.9490 H 1 UNL1111111111 0.1529 18 H -1.1228 0.8891 1.5573 H 1 UNL1111111111 0.1528 19 H 0.5825 -0.9397 1.7082 H 1 UNL1111111111 0.1688 20 H -3.8090 -1.9447 -1.1452 H 1 UNL1111111111 0.1655 21 H -5.1144 -1.1438 -0.2682 H 1 UNL1111111111 0.1592 22 H -4.2618 -0.2821 -1.5647 H 1 UNL1111111111 0.1661 23 H 2.5331 0.5731 1.7557 H 1 UNL1111111111 0.1818 24 H 2.2568 2.8899 0.7220 H 1 UNL1111111111 0.1891 25 H 2.0566 -1.6366 -2.4631 H 1 UNL1111111111 0.1920 26 H 1.5582 -3.1697 -1.7277 H 1 UNL1111111111 0.1905 27 H 3.2805 -2.7211 -1.7488 H 1 UNL1111111111 0.1882 @BOND 1 1 6 1 2 1 7 1 3 2 8 1 4 2 12 1 5 3 9 1 6 3 14 1 7 4 12 2 8 5 14 2 9 6 7 1 10 6 8 1 11 6 16 1 12 7 10 1 13 7 17 1 14 8 9 1 15 8 18 1 16 9 11 1 17 9 19 1 18 10 20 1 19 10 21 1 20 10 22 1 21 11 13 2 22 11 23 1 23 12 13 1 24 13 24 1 25 14 15 1 26 15 25 1 27 15 26 1 28 15 27 1