B2XY5U
-OEChem-04022103232D
45 46 0 0 0 0 0 0 0999 V2000
5.5458 0.0000 0.0000 Br 0 5 0 0 0 0 0 0 0 0 0 0
5.5458 2.5400 0.0000 Br 0 5 0 0 0 0 0 0 0 0 0 0
4.0678 6.2347 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0
7.5319 6.2347 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0
5.7998 6.2347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9338 5.7347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6659 5.7347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2018 5.7347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.3979 5.7347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3358 6.2347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.2640 6.2347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0678 7.2347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.5319 7.2347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3358 7.2347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.2640 7.2347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2018 7.7347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.3979 7.7347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4418 5.7000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.1579 5.7000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4418 7.7693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.1579 7.7693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5357 6.2139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.0640 6.2139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5357 7.2555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.0640 7.2555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1984 6.7096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4013 6.7096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5353 5.2597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3324 5.2597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2673 5.2597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.0644 5.2597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2018 5.1147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3979 5.1147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6047 7.5447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9950 7.5447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2018 8.3547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3979 8.3547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4490 5.0801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.1507 5.0801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4490 8.3893 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.1507 8.3893 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0000 5.9018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.5997 5.9018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0000 7.5676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.5997 7.5676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3 6 1 0 0 0 0
3 8 2 0 0 0 0
3 12 1 0 0 0 0
4 7 1 0 0 0 0
4 9 2 0 0 0 0
4 13 1 0 0 0 0
5 6 1 0 0 0 0
5 7 1 0 0 0 0
5 26 1 0 0 0 0
5 27 1 0 0 0 0
6 28 1 0 0 0 0
6 29 1 0 0 0 0
7 30 1 0 0 0 0
7 31 1 0 0 0 0
8 10 1 0 0 0 0
8 32 1 0 0 0 0
9 11 1 0 0 0 0
9 33 1 0 0 0 0
10 14 1 0 0 0 0
10 18 2 0 0 0 0
11 15 1 0 0 0 0
11 19 2 0 0 0 0
12 16 2 0 0 0 0
12 34 1 0 0 0 0
13 17 2 0 0 0 0
13 35 1 0 0 0 0
14 16 1 0 0 0 0
14 20 2 0 0 0 0
15 17 1 0 0 0 0
15 21 2 0 0 0 0
16 36 1 0 0 0 0
17 37 1 0 0 0 0
18 22 1 0 0 0 0
18 38 1 0 0 0 0
19 23 1 0 0 0 0
19 39 1 0 0 0 0
20 24 1 0 0 0 0
20 40 1 0 0 0 0
21 25 1 0 0 0 0
21 41 1 0 0 0 0
22 24 2 0 0 0 0
22 42 1 0 0 0 0
23 25 2 0 0 0 0
23 43 1 0 0 0 0
24 44 1 0 0 0 0
25 45 1 0 0 0 0
M CHG 4 1 -1 2 -1 3 1 4 1
M END
$$$$