D0PU5V -OEChem-10101305022D 27 29 0 0 0 0 0 0 0999 V2000 3.5827 -0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.1636 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8468 -0.5208 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4782 0.4945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 -0.9067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9407 1.0347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9407 -1.0347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 0.7024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8468 0.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0502 -1.4750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8472 -1.4750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -1.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7778 0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 1.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9389 0.9094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5402 -1.5132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9336 1.6546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9336 -1.6546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2478 1.2688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3825 0.8329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 11 1 0 0 0 0 1 12 1 0 0 0 0 2 12 2 0 0 0 0 2 15 1 0 0 0 0 3 14 2 0 0 0 0 3 16 1 0 0 0 0 4 5 1 0 0 0 0 4 17 1 0 0 0 0 4 18 1 0 0 0 0 5 7 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 6 14 1 0 0 0 0 7 19 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 9 10 2 0 0 0 0 9 20 1 0 0 0 0 10 21 1 0 0 0 0 11 15 2 0 0 0 0 11 22 1 0 0 0 0 12 23 1 0 0 0 0 13 16 2 0 0 0 0 13 24 1 0 0 0 0 14 25 1 0 0 0 0 15 26 1 0 0 0 0 16 27 1 0 0 0 0 M END $$$$