BDO7H9 -OEChem-04012114473D 43 45 0 1 0 0 0 0 0999 V2000 -1.8739 1.4268 0.9074 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.3039 0.6640 -1.1799 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7326 0.2518 -1.7128 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5001 1.9023 2.6037 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2411 1.4617 -1.7702 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2565 -0.0267 -2.0334 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4419 0.0179 0.2271 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5713 0.1840 -1.0261 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2640 1.2238 1.1511 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8974 -0.2306 -0.1216 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1489 0.5381 -0.6874 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8055 1.4182 1.5136 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2321 1.0707 0.4884 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7727 0.8455 -0.2675 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3601 -1.5348 -0.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5541 -0.2157 0.7733 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5833 -0.5283 -0.1146 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1109 0.6174 -0.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6985 -1.7630 -0.6164 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5738 -0.6869 -0.7625 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0194 -1.2057 1.5977 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0778 -1.8309 -0.1785 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5141 -2.5085 1.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2130 1.7300 -0.0873 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5431 -2.8212 0.6459 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0780 -0.8626 0.7788 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5963 -0.7569 -1.5917 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9799 0.9599 -1.6865 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5839 2.1673 0.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8319 1.0750 2.0775 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4529 1.8765 -0.1664 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6878 -2.3816 -0.1873 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7918 1.4551 -0.7077 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0587 -2.7785 -0.7531 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2262 -0.0676 -2.4787 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6154 -0.8644 -1.0135 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2240 -0.9909 2.3074 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8799 -2.1130 -0.8536 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0995 -3.2790 2.1774 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7752 2.4339 -0.7062 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9107 1.1242 0.4947 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5467 2.2866 0.5678 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9286 -3.8354 0.5975 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 16 1 0 0 0 0 2 5 2 0 0 0 0 2 6 2 0 0 0 0 2 17 1 0 0 0 0 2 24 1 0 0 0 0 3 11 1 0 0 0 0 3 35 1 0 0 0 0 4 12 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 7 26 1 0 0 0 0 8 11 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 12 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 14 2 0 0 0 0 10 15 1 0 0 0 0 11 13 2 0 0 0 0 12 13 1 0 0 0 0 14 18 1 0 0 0 0 14 31 1 0 0 0 0 15 19 2 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 22 2 0 0 0 0 18 20 2 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 20 36 1 0 0 0 0 21 23 1 0 0 0 0 21 37 1 0 0 0 0 22 25 1 0 0 0 0 22 38 1 0 0 0 0 23 25 2 0 0 0 0 23 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 M END $$$$