D0Q6CJ -OEChem-10101305032D 29 31 0 0 0 0 0 0 0999 V2000 2.8660 2.7621 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.2621 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.7379 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 -1.2654 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 8.9904 -2.7621 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 -1.7621 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.3301 -1.2379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.2379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.2379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.2621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.7379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.2379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2241 -1.7726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2241 0.2967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -1.2587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -0.2171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.2621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.2379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.7621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.2621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.2621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 -1.5479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2169 -2.3926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2169 0.9167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6659 0.0950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 1.5721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.8579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.0479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 1.5721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 2 8 1 0 0 0 0 2 9 1 0 0 0 0 3 11 2 0 0 0 0 4 6 1 0 0 0 0 5 6 2 0 0 0 0 6 15 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 7 13 1 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 9 12 2 0 0 0 0 10 17 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 12 22 1 0 0 0 0 13 15 2 0 0 0 0 13 23 1 0 0 0 0 14 16 2 0 0 0 0 14 24 1 0 0 0 0 15 16 1 0 0 0 0 16 25 1 0 0 0 0 17 19 1 0 0 0 0 17 26 1 0 0 0 0 18 20 2 0 0 0 0 18 27 1 0 0 0 0 19 21 2 0 0 0 0 20 21 1 0 0 0 0 20 28 1 0 0 0 0 21 29 1 0 0 0 0 M CHG 2 4 -1 6 1 M END $$$$