B8A9TN -OEChem-04022101592D 43 45 0 1 0 0 0 0 0999 V2000 8.3074 -3.4571 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.4863 -1.0836 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.2547 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 9.3952 2.8907 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2197 2.8907 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2754 -0.1565 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4984 1.1307 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3074 0.5429 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.1165 1.1307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5474 0.8216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3074 -0.4571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8074 2.0817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8074 2.0817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8042 1.4908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0675 0.8216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8532 1.1818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1735 -0.9571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4414 -0.9571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8107 1.4908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1735 -1.9571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4414 -1.9571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6453 0.2036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1100 1.8509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3074 -2.4571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6942 -0.1054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1590 1.5419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9511 0.5637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7550 0.2614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0588 0.4399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8384 0.2742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2928 1.8725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5132 2.0382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7104 -0.6471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9045 -0.6471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2255 1.0300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2714 1.9056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3958 1.9515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7104 -2.2671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9045 -2.2671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1430 3.4571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1060 -0.2113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2389 2.4573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6982 1.9567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 2 25 1 0 0 0 0 3 27 1 0 0 0 0 4 13 1 0 0 0 0 4 40 1 0 0 0 0 5 12 2 0 0 0 0 6 15 2 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 28 1 0 0 0 0 9 13 2 0 0 0 0 9 15 1 0 0 0 0 10 14 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 17 2 0 0 0 0 11 18 1 0 0 0 0 12 13 1 0 0 0 0 14 16 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 19 1 0 0 0 0 16 22 2 0 0 0 0 16 23 1 0 0 0 0 17 20 1 0 0 0 0 17 33 1 0 0 0 0 18 21 2 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 24 2 0 0 0 0 20 38 1 0 0 0 0 21 24 1 0 0 0 0 21 39 1 0 0 0 0 22 25 1 0 0 0 0 22 41 1 0 0 0 0 23 26 2 0 0 0 0 23 42 1 0 0 0 0 25 27 2 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 M END $$$$