BPA1S3 -OEChem-04042106033D 37 40 0 0 0 0 0 0 0999 V2000 -0.5780 2.7335 2.0540 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.6204 -2.6412 0.6386 O 0 5 0 0 0 0 0 0 0 0 0 0 4.2748 -0.5368 1.1593 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5055 -2.2109 -0.8773 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7137 0.7797 -0.0581 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5800 -1.1964 0.2488 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8124 -2.1477 -0.3009 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8720 -1.6364 0.7086 N 0 3 0 0 0 0 0 0 0 0 0 0 0.3402 -0.7113 -0.1305 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1551 -1.9435 -0.5819 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4386 0.5730 -0.1577 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6425 -0.2416 0.0312 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6021 -1.5748 -0.4119 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9291 -0.0215 0.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3380 1.8377 -0.3547 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6781 -0.6428 0.3192 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7313 -3.0448 -0.6472 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5282 -1.7470 0.2637 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0587 -2.9484 -0.2379 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6114 1.1658 0.9983 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3316 2.8624 0.5915 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0838 1.9740 -1.5255 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0711 4.0236 0.3671 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8233 3.1353 -1.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8170 4.1602 -0.8037 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6416 -3.1251 -1.3027 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0568 0.2940 0.7224 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3711 -4.0114 -0.9971 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6828 -3.8351 -0.3058 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5506 -1.4149 0.4365 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5163 0.8942 1.5518 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9559 1.7127 1.6837 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8986 1.8433 0.1879 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0937 1.1904 -2.2788 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0768 4.8315 1.0944 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4025 3.2425 -2.6625 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3925 5.0644 -0.9789 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 2 8 1 0 0 0 0 3 8 2 0 0 0 0 4 10 1 0 0 0 0 4 13 1 0 0 0 0 4 26 1 0 0 0 0 5 11 2 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 14 1 0 0 0 0 6 30 1 0 0 0 0 7 13 2 0 0 0 0 8 18 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 9 16 1 0 0 0 0 10 17 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 14 2 0 0 0 0 14 20 1 0 0 0 0 15 21 1 0 0 0 0 15 22 2 0 0 0 0 16 18 2 0 0 0 0 16 27 1 0 0 0 0 17 19 2 0 0 0 0 17 28 1 0 0 0 0 18 19 1 0 0 0 0 19 29 1 0 0 0 0 20 31 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 21 23 2 0 0 0 0 22 24 1 0 0 0 0 22 34 1 0 0 0 0 23 25 1 0 0 0 0 23 35 1 0 0 0 0 24 25 2 0 0 0 0 24 36 1 0 0 0 0 25 37 1 0 0 0 0 M CHG 2 2 -1 8 1 M END $$$$