BC5PQ4 -OEChem-04012114592D 21 22 0 0 0 0 0 0 0999 V2000 7.2764 -0.5018 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.1970 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8600 0.3030 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.6970 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2764 1.1077 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.8030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.1970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.1970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.6970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.3030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.8030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8600 0.3030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.6970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.6970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.3170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.9230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 1.1130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4690 1.6970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -0.1601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.0070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -1.2340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 12 1 0 0 0 0 2 13 1 0 0 0 0 2 14 1 0 0 0 0 3 12 2 0 0 0 0 4 13 2 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 5 18 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 9 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 8 13 1 0 0 0 0 9 15 1 0 0 0 0 10 11 2 0 0 0 0 10 16 1 0 0 0 0 11 17 1 0 0 0 0 14 19 1 0 0 0 0 14 20 1 0 0 0 0 14 21 1 0 0 0 0 M END $$$$