BPA3B1 -OEChem-04042104423D 45 47 0 1 0 0 0 0 0999 V2000 -4.0316 -3.3433 -0.2700 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9482 -2.1186 -0.4191 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6645 -1.0888 -0.7600 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0320 -1.8594 1.2827 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6484 0.1725 -0.5361 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9790 1.5679 -0.7125 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1612 0.3208 1.0385 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.0590 1.5487 0.7849 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9275 0.3016 0.1193 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2446 2.8504 0.8181 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1303 1.6049 0.2182 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.9885 -0.9665 0.9059 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0129 2.8167 -0.0832 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8557 1.4040 -0.5242 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8023 -1.0102 -0.3892 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.7292 -2.1851 -0.3644 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1585 0.8855 -0.4713 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3272 0.1825 0.7216 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1791 0.9015 -1.4219 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5166 -0.5046 0.9638 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3685 0.2144 -1.1796 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5373 -0.4887 0.0131 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7767 -1.2062 0.2655 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7930 0.3735 2.0727 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7897 1.6064 1.6049 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3082 -0.5639 0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2279 0.1420 -0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9168 3.0319 1.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8789 3.7009 0.5416 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2305 1.7461 1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6665 -1.0375 1.7685 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3268 -1.8390 0.9746 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3244 2.8092 -1.1354 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4369 3.7404 0.0551 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5399 2.2537 -0.6323 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2017 1.4237 -1.4031 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1602 -1.1123 -1.2716 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3125 0.2101 0.2384 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8627 2.0020 -1.6218 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6221 -4.1263 -0.2504 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5740 0.1388 1.5008 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0605 1.4457 -2.3556 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6298 -1.0455 1.8997 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1370 0.2532 -1.9466 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4966 -1.5762 -0.5798 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 40 1 0 0 0 0 2 16 2 0 0 0 0 3 23 1 0 0 0 0 3 45 1 0 0 0 0 4 23 2 0 0 0 0 5 14 1 0 0 0 0 5 15 1 0 0 0 0 5 38 1 0 0 0 0 6 11 1 0 0 0 0 6 17 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 7 24 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 8 25 1 0 0 0 0 9 11 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 13 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 13 1 0 0 0 0 11 30 1 0 0 0 0 12 15 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 18 41 1 0 0 0 0 19 21 2 0 0 0 0 19 42 1 0 0 0 0 20 22 2 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 M END $$$$