Mol:
N 0 0 0 0 0 0 0 0 0 0 0 0
2.7193 4.7100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3597 5.4950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.7983 2.3550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1580 3.1400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.5176 2.3550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.8773 3.1400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.5176 0.7850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.8773 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1580 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7983 0.7850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 1 0 0 0 0
3 4 1 0 0 0 0
4 5 2 0 0 0 0
4 6 1 0 0 0 0
6 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 1 0 0 0 0
9 10 2 0 0 0 0
10 11 1 0 0 0 0
11 12 2 0 0 0 0
12 13 1 0 0 0 0
13 8 2 0 0 0 0
9 14 1 0 0 0 0
14 15 2 0 0 0 0
15 16 1 0 0 0 0
16 17 2 0 0 0 0
16 18 1 0 0 0 0
18 19 1 0 0 0 0
19 20 2 0 0 0 0
19 21 1 0 0 0 0
21 22 1 0 0 0 0
22 15 1 0 0 0 0
22 23 2 0 0 0 0
18 24 1 0 0 0 0
24 25 1 0 0 0 0
25 26 2 0 0 0 0
26 27 1 0 0 0 0
26 28 1 0 0 0 0
28 29 1 0 0 0 0
28 30 2 0 0 0 0
30 31 1 0 0 0 0
31 24 2 0 0 0 0
M END
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