B3EO5F -OEChem-04012113443D 35 37 0 0 0 0 0 0 0999 V2000 -4.7084 -1.8227 1.3962 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0971 -2.5002 -0.5045 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0417 -0.3898 -0.3894 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5364 0.8496 0.2880 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7162 0.5363 -0.7390 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2653 -0.7260 -1.1172 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0622 0.9272 0.2592 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5045 -0.5187 -0.2483 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3339 1.1137 1.0906 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9525 -1.2807 -0.4017 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7433 1.0601 1.0865 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3848 -0.7087 -0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5041 -1.2753 0.2732 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5658 -0.3354 0.1534 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0448 0.7922 -0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9241 -0.3357 0.5278 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8175 1.9240 -0.7685 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7091 0.7893 0.2504 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1622 1.9008 -0.3876 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3028 -0.0754 -1.9998 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2252 -1.7590 -1.4783 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1993 1.0444 0.9207 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0081 1.6867 -0.5295 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5095 -1.2543 0.5671 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3933 -0.7013 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3519 2.1435 1.4672 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3000 0.4455 1.9617 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7874 2.0923 1.4515 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6398 0.9048 0.4761 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7928 0.3864 1.9497 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5545 -2.2594 0.7198 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0969 1.1704 -1.2237 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3926 2.7898 -1.2654 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7600 0.8120 0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7899 2.7641 -0.5933 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 2 10 2 0 0 0 0 3 6 1 0 0 0 0 3 7 1 0 0 0 0 3 10 1 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 4 11 1 0 0 0 0 5 12 1 0 0 0 0 5 15 1 0 0 0 0 5 32 1 0 0 0 0 6 8 1 0 0 0 0 6 20 1 0 0 0 0 6 21 1 0 0 0 0 7 9 1 0 0 0 0 7 22 1 0 0 0 0 7 23 1 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 12 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 15 17 1 0 0 0 0 16 18 2 0 0 0 0 17 19 2 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 M END $$$$