BBAD28 -OEChem-04022106542D 28 28 0 1 0 0 0 0 0999 V2000 4.6288 1.9798 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8044 1.9798 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5896 -2.3546 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7166 -0.3681 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7486 -1.0674 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9076 0.2197 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2166 1.1708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2166 1.1708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5256 0.2197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9565 -0.0893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7976 -1.3765 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0544 -0.7073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8106 -0.3926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4981 1.7232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8290 1.0738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8356 -0.3172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0920 0.4719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7166 -0.9881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8702 0.5247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3369 -0.0677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2094 -1.4823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8810 2.5462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4210 1.9150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2079 -1.5680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4693 -0.2466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5937 -0.2925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6396 -1.1681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.5462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7 1 1 1 0 0 0 1 22 1 0 0 0 0 8 2 1 1 0 0 0 2 23 1 0 0 0 0 11 3 1 1 0 0 0 3 28 1 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 4 18 1 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 6 0 0 0 6 13 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 8 15 1 0 0 0 0 9 16 1 0 0 0 0 9 17 1 0 0 0 0 10 19 1 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 24 1 0 0 0 0 12 25 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 M END $$$$