@MOLECULE 10,11-dimethyl-7,8,8a,9a-tetrahydrochryseno[3,4-b]oxirene-7,8-diol 41 45 0 0 0 SMALL GASTEIGER @ATOM 1 O 2.7506 -1.9814 -0.1958 O.3 1 UNL111111111 -0.2919 2 O 4.2620 -0.2414 -1.4321 O.3 1 UNL111111111 -0.4981 3 O 3.4525 1.8742 1.3936 O.3 1 UNL111111111 -0.5306 4 C 3.5145 -1.0952 0.6185 C.3 1 UNL111111111 -0.0212 5 C 2.0236 -1.1632 0.7261 C.3 1 UNL111111111 0.0027 6 C 4.1501 0.0968 -0.0664 C.3 1 UNL111111111 0.0697 7 C 1.1940 -0.0726 0.1632 C.ar 1 UNL111111111 -0.0115 8 C 3.2800 1.3730 0.0766 C.3 1 UNL111111111 0.0908 9 C 1.7961 1.1556 -0.0529 C.ar 1 UNL111111111 -0.0158 10 C -0.2031 -0.2342 -0.0387 C.ar 1 UNL111111111 -0.0129 11 C -0.9921 0.9223 -0.2086 C.ar 1 UNL111111111 -0.0122 12 C 1.0121 2.2797 -0.3691 C.ar 1 UNL111111111 -0.1452 13 C -0.8588 -1.5246 -0.0725 C.ar 1 UNL111111111 0.0042 14 C -0.3592 2.1684 -0.4065 C.ar 1 UNL111111111 -0.1472 15 C -2.4353 0.8249 -0.1368 C.ar 1 UNL111111111 -0.0183 16 C -2.2119 -1.6169 0.0899 C.ar 1 UNL111111111 -0.0101 17 C -3.0345 -0.4290 0.0897 C.ar 1 UNL111111111 -0.0068 18 C -0.0527 -2.7354 -0.4038 C.3 1 UNL111111111 -0.4503 19 C -3.2585 1.9674 -0.2454 C.ar 1 UNL111111111 -0.1468 20 C -2.8967 -2.9387 0.2203 C.3 1 UNL111111111 -0.4419 21 C -4.4372 -0.5006 0.2458 C.ar 1 UNL111111111 -0.1565 22 C -4.6268 1.8761 -0.1036 C.ar 1 UNL111111111 -0.1522 23 C -5.2217 0.6295 0.1534 C.ar 1 UNL111111111 -0.1457 24 H 4.1492 -1.5996 1.3516 H 1 UNL111111111 0.1547 25 H 1.5642 -1.7072 1.5612 H 1 UNL111111111 0.1655 26 H 5.1685 0.2860 0.3456 H 1 UNL111111111 0.1201 27 H 3.6271 2.1393 -0.6560 H 1 UNL111111111 0.1213 28 H 1.4921 3.2404 -0.5447 H 1 UNL111111111 0.1531 29 H 4.8154 0.4124 -1.9066 H 1 UNL111111111 0.3004 30 H -0.9624 3.0574 -0.5918 H 1 UNL111111111 0.1566 31 H 4.3315 2.2858 1.4997 H 1 UNL111111111 0.3049 32 H -0.6434 -3.4979 -0.9323 H 1 UNL111111111 0.1574 33 H 0.7760 -2.4925 -1.0922 H 1 UNL111111111 0.1812 34 H 0.3790 -3.2150 0.4839 H 1 UNL111111111 0.1591 35 H -2.8072 2.9408 -0.4381 H 1 UNL111111111 0.1526 36 H -3.6050 -2.9434 1.0621 H 1 UNL111111111 0.1545 37 H -3.4567 -3.1875 -0.6931 H 1 UNL111111111 0.1582 38 H -2.2018 -3.7671 0.4133 H 1 UNL111111111 0.1591 39 H -4.9091 -1.4628 0.4377 H 1 UNL111111111 0.1528 40 H -5.2523 2.7620 -0.1864 H 1 UNL111111111 0.1486 41 H -6.3007 0.5646 0.2754 H 1 UNL111111111 0.1474 @BOND 1 1 4 1 2 1 5 1 3 2 6 1 4 2 29 1 5 3 8 1 6 3 31 1 7 4 5 1 8 4 6 1 9 4 24 1 10 5 7 1 11 5 25 1 12 6 8 1 13 6 26 1 14 7 9 ar 15 7 10 ar 16 8 9 1 17 8 27 1 18 9 12 ar 19 10 11 ar 20 10 13 ar 21 11 14 ar 22 11 15 ar 23 12 14 ar 24 12 28 1 25 13 16 ar 26 13 18 1 27 14 30 1 28 15 17 ar 29 15 19 ar 30 16 17 ar 31 16 20 1 32 17 21 ar 33 18 32 1 34 18 33 1 35 18 34 1 36 19 22 ar 37 19 35 1 38 20 36 1 39 20 37 1 40 20 38 1 41 21 23 ar 42 21 39 1 43 22 23 ar 44 22 40 1 45 23 41 1