BBL4O3 -OEChem-04022106262D 47 50 0 0 0 0 0 0 0999 V2000 5.4716 0.2107 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.8080 0.8493 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3025 1.8198 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2807 1.6119 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8772 0.6521 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7833 -0.9034 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8656 -2.4172 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 -0.0643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4067 -0.1688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 -0.8733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.0823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 -1.7868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 -1.8914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8025 0.9538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3852 0.6174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2512 0.1174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8958 2.7334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1172 0.6174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9833 0.1174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2512 -0.8826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9833 -0.8826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1172 -1.3826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8772 -1.4173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7833 0.1382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6474 0.6416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0179 0.0005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4500 0.4497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8052 -0.0188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5030 -1.2200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4197 -0.4273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4860 -0.7356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5693 -1.5283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5391 -2.4053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1839 -1.9368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0305 -2.1632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7587 -2.4873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4622 2.9856 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6436 3.2998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3294 2.4812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1172 1.2374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7143 -1.1926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1172 -2.0026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9594 0.1058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1831 0.9536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3353 1.1773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3990 -2.7334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3252 -2.7210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 8 1 0 0 0 0 2 14 2 0 0 0 0 3 4 1 0 0 0 0 3 14 1 0 0 0 0 3 17 1 0 0 0 0 4 15 2 0 0 0 0 5 19 1 0 0 0 0 5 24 2 0 0 0 0 6 23 2 0 0 0 0 6 24 1 0 0 0 0 7 23 1 0 0 0 0 7 46 1 0 0 0 0 7 47 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 26 1 0 0 0 0 9 11 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 12 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 13 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 15 16 1 0 0 0 0 16 18 2 0 0 0 0 16 20 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 21 2 0 0 0 0 20 22 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 42 1 0 0 0 0 24 25 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 M END $$$$