B26CIX
-OEChem-04012115212D
35 38 0 0 0 0 0 0 0999 V2000
10.5525 2.2046 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0
5.7123 -1.5948 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.6498 1.3278 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.0547 -0.3955 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.3991 -2.1318 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5274 0.7287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3364 0.1410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7183 0.1410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0274 -0.8101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0274 -0.8101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3518 0.3732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7029 0.3732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3424 -1.5948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.3955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3219 -1.3861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7328 -1.3861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.6255 1.5470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.9235 2.5016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.3031 0.8116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.8991 2.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.2788 1.0308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.5768 1.9854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9422 1.1895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1125 1.1895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5182 0.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5408 -2.1822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2296 1.7837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3940 -0.2642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9088 -1.8485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5033 2.9575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.1184 0.2198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.2052 -2.7208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0060 -2.0053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.0839 3.3126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.6990 0.5749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 22 1 0 0 0 0
2 10 1 0 0 0 0
2 16 2 0 0 0 0
3 11 1 0 0 0 0
3 17 1 0 0 0 0
3 27 1 0 0 0 0
4 11 2 0 0 0 0
4 16 1 0 0 0 0
5 16 1 0 0 0 0
5 32 1 0 0 0 0
5 33 1 0 0 0 0
6 7 1 0 0 0 0
6 8 1 0 0 0 0
6 23 1 0 0 0 0
6 24 1 0 0 0 0
7 10 2 0 0 0 0
7 11 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
12 14 1 0 0 0 0
12 25 1 0 0 0 0
13 15 1 0 0 0 0
13 26 1 0 0 0 0
14 15 2 0 0 0 0
14 28 1 0 0 0 0
15 29 1 0 0 0 0
17 18 2 0 0 0 0
17 19 1 0 0 0 0
18 20 1 0 0 0 0
18 30 1 0 0 0 0
19 21 2 0 0 0 0
19 31 1 0 0 0 0
20 22 2 0 0 0 0
20 34 1 0 0 0 0
21 22 1 0 0 0 0
21 35 1 0 0 0 0
M END
$$$$