D0K1QB -OEChem-10101305022D 39 41 0 0 0 0 0 0 0999 V2000 2.4978 -1.1736 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.3486 -3.5000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.4090 0.1579 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5826 1.1428 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3486 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3486 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3486 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3486 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3486 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4826 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2147 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2147 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8486 -0.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4826 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8486 1.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4826 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2147 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2147 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8486 -0.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8486 1.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4826 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3486 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3486 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3486 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7516 -0.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7516 1.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5386 -0.9030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9457 1.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5386 1.9030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9457 -2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7516 -2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7516 3.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1586 -0.9030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9457 3.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1586 1.9030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.9307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6903 1.7534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9686 0.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3486 4.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 2 22 1 0 0 0 0 3 9 2 0 0 0 0 4 9 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 5 9 1 0 0 0 0 6 10 2 0 0 0 0 6 11 1 0 0 0 0 7 12 2 0 0 0 0 7 14 1 0 0 0 0 8 13 2 0 0 0 0 8 15 1 0 0 0 0 10 16 1 0 0 0 0 11 17 2 0 0 0 0 11 25 1 0 0 0 0 12 18 1 0 0 0 0 12 26 1 0 0 0 0 13 19 1 0 0 0 0 13 27 1 0 0 0 0 14 21 2 0 0 0 0 14 28 1 0 0 0 0 15 20 2 0 0 0 0 15 29 1 0 0 0 0 16 22 2 0 0 0 0 16 30 1 0 0 0 0 17 22 1 0 0 0 0 17 31 1 0 0 0 0 18 24 2 0 0 0 0 18 32 1 0 0 0 0 19 23 2 0 0 0 0 19 33 1 0 0 0 0 20 23 1 0 0 0 0 20 35 1 0 0 0 0 21 24 1 0 0 0 0 21 34 1 0 0 0 0 23 38 1 0 0 0 0 24 39 1 0 0 0 0 M END $$$$