BJVN02 -OEChem-04012116062D 46 49 0 0 0 0 0 0 0999 V2000 13.1276 2.7864 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 -1.5692 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6103 2.0871 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -2.3739 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 0.1861 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9030 1.0110 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 0.3923 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.0692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.0692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -0.7644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -1.5692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.5692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 -3.3244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.0692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.0692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2566 1.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2136 1.9615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9244 0.8047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1921 2.1677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5673 2.4996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5458 2.7058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2781 1.3428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6138 -0.1458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5028 3.1182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8600 1.4234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4813 3.3244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8385 1.6296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1491 2.5801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.1892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.0508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3996 -3.5170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1815 -3.9138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5783 -3.1318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.3792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.7592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5719 -2.1061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1532 2.9610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7384 3.2951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0245 0.0468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4212 -0.7351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2031 -0.3384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0887 3.5797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6674 0.8341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6739 3.9138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2525 1.1681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 2 11 1 0 0 0 0 2 37 1 0 0 0 0 3 23 2 0 0 0 0 4 8 1 0 0 0 0 4 11 1 0 0 0 0 4 14 1 0 0 0 0 5 7 2 0 0 0 0 5 10 1 0 0 0 0 6 18 2 0 0 0 0 6 19 1 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 12 2 0 0 0 0 9 10 1 0 0 0 0 9 13 2 0 0 0 0 10 11 2 0 0 0 0 12 15 1 0 0 0 0 12 30 1 0 0 0 0 13 16 1 0 0 0 0 13 31 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 36 1 0 0 0 0 17 19 2 0 0 0 0 17 21 1 0 0 0 0 17 23 1 0 0 0 0 18 20 1 0 0 0 0 18 22 1 0 0 0 0 19 24 1 0 0 0 0 20 25 2 0 0 0 0 20 26 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 27 1 0 0 0 0 25 43 1 0 0 0 0 26 28 2 0 0 0 0 26 44 1 0 0 0 0 27 29 2 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 M END $$$$