BM2L9U
-OEChem-04022100272D
44 48 0 1 0 0 0 0 0999 V2000
6.6382 -0.2373 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1277 -0.2373 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.8830 0.0356 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
4.8830 1.0356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6877 -0.5480 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
4.0782 -0.5480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3830 -1.4942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9820 1.4695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7840 1.4695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3830 -1.4942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7595 2.4444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0065 2.4444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8830 -2.3602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8830 -2.3602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2295 0.7493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.5365 0.7493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3830 3.2263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3830 3.2263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3830 -3.2263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7690 2.7668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.9970 2.7668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3830 -3.2263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2318 1.0487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.5342 1.0486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 2.0642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7660 2.0642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3307 0.3173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4080 0.7058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7839 0.0645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5030 -2.3602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2630 -2.3602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3744 0.1465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3916 0.1465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.0997 -0.6514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1140 3.7849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6520 3.7849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6930 -3.7632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6380 3.3728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1280 3.3728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0730 -3.7632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7789 0.6252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9871 0.6252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4083 2.2492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3578 2.2492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 5 1 0 0 0 0
1 34 1 0 0 0 0
2 6 2 0 0 0 0
3 4 1 0 0 0 0
3 5 1 0 0 0 0
3 6 1 0 0 0 0
3 27 1 0 0 0 0
4 8 1 0 0 0 0
4 9 1 0 0 0 0
4 28 1 0 0 0 0
5 7 1 0 0 0 0
5 29 1 0 0 0 0
6 10 1 0 0 0 0
7 10 1 0 0 0 0
7 13 2 0 0 0 0
8 11 1 0 0 0 0
8 15 2 0 0 0 0
9 12 1 0 0 0 0
9 16 2 0 0 0 0
10 14 2 0 0 0 0
11 17 1 0 0 0 0
11 20 2 0 0 0 0
12 18 1 0 0 0 0
12 21 2 0 0 0 0
13 19 1 0 0 0 0
13 30 1 0 0 0 0
14 22 1 0 0 0 0
14 31 1 0 0 0 0
15 23 1 0 0 0 0
15 32 1 0 0 0 0
16 24 1 0 0 0 0
16 33 1 0 0 0 0
17 18 2 0 0 0 0
17 35 1 0 0 0 0
18 36 1 0 0 0 0
19 22 2 0 0 0 0
19 37 1 0 0 0 0
20 25 1 0 0 0 0
20 38 1 0 0 0 0
21 26 1 0 0 0 0
21 39 1 0 0 0 0
22 40 1 0 0 0 0
23 25 2 0 0 0 0
23 41 1 0 0 0 0
24 26 2 0 0 0 0
24 42 1 0 0 0 0
25 43 1 0 0 0 0
26 44 1 0 0 0 0
M END
$$$$