BK7CR9 -OEChem-04012113482D 40 42 0 0 0 0 0 0 0999 V2000 3.2733 -1.2694 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.9249 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8135 -4.7520 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0823 2.3184 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0823 0.3184 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8913 -1.2694 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 -3.9430 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2163 1.8184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9483 1.8184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2163 0.8184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9483 0.8184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0823 3.3184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0823 -0.6816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9483 3.8184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8144 3.3184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9483 4.8184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 -2.2204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5823 -2.2204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6804 3.8184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8144 5.3184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6804 4.8184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9945 -3.0295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0042 2.4010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6057 1.7108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5589 1.7108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1604 2.4010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6057 0.9261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0042 0.2358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1604 0.2358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5589 0.9261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8702 3.9010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4717 3.2108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8144 2.6984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4114 5.1284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9467 -2.7220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2173 3.5084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8144 5.9384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2173 5.1284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0179 -4.0078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0657 -5.3184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 17 1 0 0 0 0 2 22 2 0 0 0 0 3 7 1 0 0 0 0 3 40 1 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 4 12 1 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 5 13 1 0 0 0 0 6 13 2 0 0 0 0 6 18 1 0 0 0 0 7 22 1 0 0 0 0 7 39 1 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 11 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 14 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 15 19 1 0 0 0 0 15 33 1 0 0 0 0 16 20 2 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 35 1 0 0 0 0 19 21 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 38 1 0 0 0 0 M END $$$$