BPA1S3 -OEChem-04022109002D 37 40 0 0 0 0 0 0 0999 V2000 7.6026 0.2033 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 9.6813 -1.4871 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 9.1644 0.1660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1082 -2.1368 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6082 0.0539 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6045 -1.5558 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3525 -2.2105 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9456 -0.8098 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.2316 -0.7280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0091 -1.7029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6082 0.0539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9847 -0.7279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2072 -1.7029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9944 -0.6414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0421 0.9548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2222 -0.4056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7617 -2.4231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9912 -1.1082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7594 -2.1237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4800 0.2162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0393 1.0296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4788 1.7811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4732 1.9305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9126 2.6820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9098 2.7568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1082 -2.7568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3531 0.2004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6167 -3.0259 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2122 -2.5472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.6938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0117 0.5351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1611 0.7479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9483 -0.1028 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8605 1.7348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0914 1.9768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5634 3.1943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1788 3.3154 0.0000 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 $$$$