D0F3TL -OEChem-09301911143D 31 33 0 0 0 0 0 0 0999 V2000 5.1716 2.8331 -0.0003 Br 0 0 0 0 0 0 0 0 0 0 0 0 -4.9627 2.1152 0.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1939 -0.1460 -0.0009 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2541 -1.5678 -0.0003 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9462 -2.7199 -0.0001 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2128 0.7850 -0.0003 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0992 -1.7379 0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0587 -0.6608 0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9424 -0.3531 -0.0014 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3069 -3.0956 0.0018 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5236 -0.1410 -1.2078 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5217 -0.1389 1.2082 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3277 -0.3863 -0.0022 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0128 -3.6496 0.0011 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0078 0.8264 -0.0015 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4513 0.9004 -1.2081 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4496 0.9024 1.2081 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9144 1.4221 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2920 2.0187 -0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9085 1.9442 0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4617 0.8493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2547 -3.6146 0.0029 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1720 -0.5362 -2.1579 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1687 -0.5325 2.1585 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8954 -1.3114 -0.0026 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2714 -4.6920 0.0015 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8032 1.2943 -2.1581 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 1.2980 2.1579 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7617 2.9960 0.0005 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3028 2.8445 0.0013 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9437 2.1193 0.0042 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 2 21 1 0 0 0 0 2 31 1 0 0 0 0 3 21 2 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 9 1 0 0 0 0 5 14 2 0 0 0 0 6 9 2 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 7 10 2 0 0 0 0 8 11 2 0 0 0 0 8 12 1 0 0 0 0 9 13 1 0 0 0 0 10 14 1 0 0 0 0 10 22 1 0 0 0 0 11 16 1 0 0 0 0 11 23 1 0 0 0 0 12 17 2 0 0 0 0 12 24 1 0 0 0 0 13 15 2 0 0 0 0 13 25 1 0 0 0 0 14 26 1 0 0 0 0 15 19 1 0 0 0 0 15 21 1 0 0 0 0 16 18 2 0 0 0 0 16 27 1 0 0 0 0 17 18 1 0 0 0 0 17 28 1 0 0 0 0 19 20 2 0 0 0 0 19 29 1 0 0 0 0 20 30 1 0 0 0 0 M END $$$$