BGAE38 -OEChem-04022114423D 31 31 0 1 0 0 0 0 0999 V2000 -4.5582 0.2175 0.2606 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3658 -1.0713 0.6794 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6927 -0.0565 -0.1101 N 0 0 1 0 0 0 0 0 0 0 0 0 2.2705 -0.2503 0.1874 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4235 0.6152 -0.7634 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0616 0.5160 -0.5098 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9517 -1.7403 0.0633 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8192 -0.4523 -1.1689 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6761 1.3930 0.3842 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1661 1.2100 0.4307 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1911 -0.5433 -0.9343 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0480 1.3019 0.6187 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8055 0.3338 -0.0405 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7106 -1.4735 0.9025 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0499 0.0356 1.2259 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7005 1.6738 -0.6897 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6254 0.3370 -1.8073 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1625 -2.1152 -0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8980 -1.9407 0.2795 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4985 -2.3624 0.7804 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3551 -1.1374 -1.8734 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 2.1497 0.9056 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2529 1.2807 0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9478 1.3246 1.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7450 2.0650 -0.1061 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7626 -1.3003 -1.4654 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5092 1.9936 1.3195 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8554 -1.5271 -0.0265 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7430 -1.6444 1.2186 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0533 -1.6136 1.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4591 -2.2052 0.1306 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 15 1 0 0 0 0 5 6 1 0 0 0 0 5 16 1 0 0 0 0 5 17 1 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 7 18 1 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 8 11 1 0 0 0 0 8 21 1 0 0 0 0 9 12 2 0 0 0 0 9 22 1 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 13 2 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 M END $$$$