@MOLECULE spiro(estra-1,3,5(10),6,8-pentaene-17,2'-oxiran)-3-ol 41 45 0 0 0 SMALL GASTEIGER @ATOM 1 O -4.4996 0.9120 0.8301 O.3 1 UNL11111111111 -0.3571 2 O 6.0257 0.1760 -0.2607 O.3 1 UNL11111111111 -0.4730 3 C -3.7838 0.1317 -0.1282 C.3 1 UNL11111111111 0.1439 4 C -2.2901 0.4052 -0.2780 C.3 1 UNL11111111111 0.0552 5 C -1.6888 -0.8011 0.5037 C.3 1 UNL11111111111 -0.1343 6 C -3.9810 -1.3753 -0.0502 C.3 1 UNL11111111111 -0.2985 7 C -4.8524 1.0699 -0.5504 C.3 1 UNL11111111111 -0.1645 8 C -2.5646 -1.9894 0.0728 C.3 1 UNL11111111111 -0.2689 9 C -1.7650 1.6674 0.3997 C.3 1 UNL11111111111 -0.2824 10 C -1.9527 0.3998 -1.7721 C.3 1 UNL11111111111 -0.4548 11 C -0.2135 -0.8402 0.3146 C.ar 1 UNL11111111111 -0.0475 12 C -0.2218 1.6869 0.4027 C.3 1 UNL11111111111 -0.2768 13 C 0.4761 0.3562 0.3019 C.ar 1 UNL11111111111 0.0150 14 C 0.4697 -2.0741 0.1921 C.ar 1 UNL11111111111 -0.1249 15 C 1.8997 0.3502 0.1690 C.ar 1 UNL11111111111 -0.0913 16 C 2.5738 -0.8882 0.0355 C.ar 1 UNL11111111111 0.0617 17 C 1.8304 -2.1008 0.0499 C.ar 1 UNL11111111111 -0.1888 18 C 2.6692 1.5479 0.1659 C.ar 1 UNL11111111111 -0.0793 19 C 3.9835 -0.9201 -0.1101 C.ar 1 UNL11111111111 -0.2749 20 C 4.0326 1.5220 0.0270 C.ar 1 UNL11111111111 -0.2847 21 C 4.6765 0.2673 -0.1138 C.ar 1 UNL11111111111 0.2850 22 H -1.8732 -0.6334 1.6029 H 1 UNL11111111111 0.1626 23 H -4.5097 -1.7585 -0.9370 H 1 UNL11111111111 0.1474 24 H -4.6044 -1.6333 0.8253 H 1 UNL11111111111 0.1608 25 H -4.6117 2.0388 -0.9784 H 1 UNL11111111111 0.1490 26 H -5.8437 0.7129 -0.8136 H 1 UNL11111111111 0.1487 27 H -2.5374 -2.8094 0.8048 H 1 UNL11111111111 0.1404 28 H -2.2277 -2.4083 -0.8893 H 1 UNL11111111111 0.1444 29 H -2.1530 1.7230 1.4370 H 1 UNL11111111111 0.1566 30 H -2.1531 2.5726 -0.1009 H 1 UNL11111111111 0.1428 31 H -2.3891 1.2657 -2.2798 H 1 UNL11111111111 0.1439 32 H -0.8681 0.4302 -1.9373 H 1 UNL11111111111 0.1620 33 H -2.3253 -0.5030 -2.2684 H 1 UNL11111111111 0.1492 34 H 0.1195 2.1995 1.3284 H 1 UNL11111111111 0.1547 35 H 0.1141 2.3231 -0.4462 H 1 UNL11111111111 0.1514 36 H -0.1050 -2.9989 0.2128 H 1 UNL11111111111 0.1535 37 H 2.3656 -3.0429 -0.0507 H 1 UNL11111111111 0.1586 38 H 2.1616 2.5065 0.2794 H 1 UNL11111111111 0.1528 39 H 4.5041 -1.8677 -0.2160 H 1 UNL11111111111 0.1784 40 H 4.6186 2.4350 0.0247 H 1 UNL11111111111 0.1589 41 H 6.4623 1.0598 -0.2499 H 1 UNL11111111111 0.3245 @BOND 1 1 3 1 2 1 7 1 3 2 21 1 4 2 41 1 5 3 4 1 6 3 6 1 7 3 7 1 8 4 5 1 9 4 9 1 10 4 10 1 11 5 8 1 12 5 11 1 13 5 22 1 14 6 8 1 15 6 23 1 16 6 24 1 17 7 25 1 18 7 26 1 19 8 27 1 20 8 28 1 21 9 12 1 22 9 29 1 23 9 30 1 24 10 31 1 25 10 32 1 26 10 33 1 27 11 13 ar 28 11 14 ar 29 12 13 1 30 12 34 1 31 12 35 1 32 13 15 ar 33 14 17 ar 34 14 36 1 35 15 16 ar 36 15 18 ar 37 16 17 ar 38 16 19 ar 39 17 37 1 40 18 20 ar 41 18 38 1 42 19 21 ar 43 19 39 1 44 20 21 ar 45 20 40 1