BK57JA -OEChem-04012115022D 27 28 0 0 0 0 0 0 0999 V2000 4.8913 0.5194 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0823 -4.0684 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.1749 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8135 4.0020 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2733 0.5194 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 3.1930 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0823 -1.0684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0823 -0.0684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9483 -1.5684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2163 -1.5684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0823 -3.0684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9483 -2.5684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2163 -2.5684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 1.4704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5823 1.4704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9945 2.2795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9483 -4.5684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4853 -1.2584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6794 -1.2584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4853 -2.8784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6794 -2.8784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9467 1.9720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6383 -5.1053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4853 -4.8784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2583 -4.0315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0179 3.2578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0657 4.5684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 15 1 0 0 0 0 2 11 1 0 0 0 0 2 17 1 0 0 0 0 3 16 2 0 0 0 0 4 6 1 0 0 0 0 4 27 1 0 0 0 0 5 8 2 0 0 0 0 5 14 1 0 0 0 0 6 16 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 9 12 1 0 0 0 0 9 18 1 0 0 0 0 10 13 2 0 0 0 0 10 19 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 12 20 1 0 0 0 0 13 21 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 15 22 1 0 0 0 0 17 23 1 0 0 0 0 17 24 1 0 0 0 0 17 25 1 0 0 0 0 M END $$$$