B5XGQ0 -OEChem-04022103022D 44 47 0 0 0 0 0 0 0999 V2000 2.8660 3.3100 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 6.4103 -2.4947 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.3100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.6900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.1900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.6900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9939 -1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9939 -1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4103 -0.8853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4939 -0.8240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4939 -0.8240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9939 0.0421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9939 0.0421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4939 0.9081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4939 0.9081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8863 -2.3006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5765 -1.9020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6029 -0.2959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6029 -3.0840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7741 0.2731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1541 1.3469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8039 -1.3609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3739 0.0421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 2.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6139 0.0421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1839 1.4450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8039 1.4450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -2.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 2.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 2 8 1 0 0 0 0 2 9 1 0 0 0 0 2 30 1 0 0 0 0 3 12 1 0 0 0 0 3 14 1 0 0 0 0 3 16 1 0 0 0 0 4 9 1 0 0 0 0 4 15 2 0 0 0 0 5 12 2 0 0 0 0 5 15 1 0 0 0 0 6 15 1 0 0 0 0 6 42 1 0 0 0 0 6 43 1 0 0 0 0 7 9 2 0 0 0 0 7 11 1 0 0 0 0 7 12 1 0 0 0 0 8 10 1 0 0 0 0 8 11 2 0 0 0 0 10 13 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 13 17 2 0 0 0 0 13 18 1 0 0 0 0 14 19 2 0 0 0 0 14 20 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 17 21 1 0 0 0 0 17 34 1 0 0 0 0 18 22 2 0 0 0 0 18 35 1 0 0 0 0 19 23 1 0 0 0 0 19 36 1 0 0 0 0 20 24 2 0 0 0 0 20 37 1 0 0 0 0 21 25 2 0 0 0 0 21 38 1 0 0 0 0 22 25 1 0 0 0 0 22 39 1 0 0 0 0 23 26 2 0 0 0 0 24 26 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 26 44 1 0 0 0 0 M END $$$$