BW8A1V -OEChem-04022107202D 23 25 0 0 0 0 0 0 0999 V2000 8.3037 1.3137 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9930 0.3632 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9930 -1.2463 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5766 -0.4416 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4782 0.0530 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 -1.3483 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 0.2609 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.6051 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -0.9416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -1.4416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 0.0584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -0.9416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -1.4416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 0.0584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 0.5584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 -0.9416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0502 -1.9165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8472 -1.9165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -2.0616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7778 0.3684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 1.1784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2478 0.8273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9103 1.4416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 2 4 1 0 0 0 0 2 11 1 0 0 0 0 3 4 2 0 0 0 0 3 12 1 0 0 0 0 5 7 1 0 0 0 0 5 16 2 0 0 0 0 6 8 2 0 0 0 0 6 16 1 0 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 9 10 1 0 0 0 0 9 13 2 0 0 0 0 9 14 1 0 0 0 0 10 16 1 0 0 0 0 10 17 1 0 0 0 0 10 18 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 19 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 21 1 0 0 0 0 M END $$$$