B8K0PW
-OEChem-04012116242D
42 43 0 0 0 0 0 0 0999 V2000
4.5981 -0.0000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 5.0000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
7.3301 4.0000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
5.3301 4.0000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -3.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -1.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -0.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2646 -2.5250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4675 -2.5250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9441 -5.0826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3426 -4.3923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7880 -2.9174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3894 -3.6077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4675 -5.4750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2646 -5.4750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3894 -4.3923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7880 -5.0826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8101 -3.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2087 -2.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3860 -1.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9875 -2.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -1.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 -0.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 1.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9272 1.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 2.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9272 2.8100 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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3 22 1 0 0 0 0
4 22 1 0 0 0 0
5 8 1 0 0 0 0
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6 14 1 0 0 0 0
6 15 1 0 0 0 0
6 37 1 0 0 0 0
7 15 1 0 0 0 0
7 16 1 0 0 0 0
7 38 1 0 0 0 0
8 10 1 0 0 0 0
8 23 1 0 0 0 0
8 24 1 0 0 0 0
9 11 1 0 0 0 0
9 25 1 0 0 0 0
9 26 1 0 0 0 0
10 12 1 0 0 0 0
10 27 1 0 0 0 0
10 28 1 0 0 0 0
11 12 1 0 0 0 0
11 29 1 0 0 0 0
11 30 1 0 0 0 0
12 31 1 0 0 0 0
12 32 1 0 0 0 0
13 14 1 0 0 0 0
13 33 1 0 0 0 0
13 34 1 0 0 0 0
14 35 1 0 0 0 0
14 36 1 0 0 0 0
16 17 2 0 0 0 0
16 18 1 0 0 0 0
17 20 1 0 0 0 0
17 39 1 0 0 0 0
18 21 2 0 0 0 0
18 40 1 0 0 0 0
19 20 2 0 0 0 0
19 21 1 0 0 0 0
19 22 1 0 0 0 0
20 41 1 0 0 0 0
21 42 1 0 0 0 0
M END
$$$$