B6PHU1 -OEChem-04012117102D 20 21 0 0 0 0 0 0 0999 V2000 4.6660 -1.5173 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -0.0173 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 1.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 0.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 0.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -0.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -0.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 1.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -0.5520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.0035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.0381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0646 1.9576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2675 1.9576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1426 0.8750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7441 1.5653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 -0.3273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 2.1373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -1.1720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 1.3156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -0.3502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 2 0 0 0 0 2 5 1 0 0 0 0 2 7 1 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 12 1 0 0 0 0 3 13 1 0 0 0 0 4 6 1 0 0 0 0 4 8 2 0 0 0 0 5 14 1 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 6 9 2 0 0 0 0 8 10 1 0 0 0 0 8 17 1 0 0 0 0 9 11 1 0 0 0 0 9 18 1 0 0 0 0 10 11 2 0 0 0 0 10 19 1 0 0 0 0 11 20 1 0 0 0 0 M END $$$$