BE09GA
-OEChem-04012116012D
40 42 0 0 0 0 0 0 0999 V2000
2.8660 -2.1900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -0.6900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -2.1900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -2.1900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.3100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 2.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 -1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 -2.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 -0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 -1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 -0.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 -0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 0.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6762 0.7274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0747 1.4177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1215 1.4177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5200 0.7274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0747 2.2023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6762 2.8926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5200 2.8926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1215 2.2023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9966 3.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1996 3.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -2.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -2.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 -2.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6592 -0.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4651 -2.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 0.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4651 -0.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 15 2 0 0 0 0
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2 14 2 0 0 0 0
3 14 1 0 0 0 0
3 15 1 0 0 0 0
3 34 1 0 0 0 0
4 14 1 0 0 0 0
4 17 1 0 0 0 0
4 35 1 0 0 0 0
5 16 3 0 0 0 0
6 7 1 0 0 0 0
6 8 1 0 0 0 0
6 12 1 0 0 0 0
6 23 1 0 0 0 0
7 9 1 0 0 0 0
7 24 1 0 0 0 0
7 25 1 0 0 0 0
8 10 1 0 0 0 0
8 26 1 0 0 0 0
8 27 1 0 0 0 0
9 11 1 0 0 0 0
9 28 1 0 0 0 0
9 29 1 0 0 0 0
10 11 1 0 0 0 0
10 30 1 0 0 0 0
10 31 1 0 0 0 0
11 32 1 0 0 0 0
11 33 1 0 0 0 0
12 13 2 0 0 0 0
13 15 1 0 0 0 0
13 16 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 36 1 0 0 0 0
19 21 2 0 0 0 0
19 37 1 0 0 0 0
20 22 2 0 0 0 0
20 38 1 0 0 0 0
21 22 1 0 0 0 0
21 39 1 0 0 0 0
22 40 1 0 0 0 0
M END
$$$$