Mol:
0 0 0 0 0
7.0086 3.1400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.3683 2.3550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.3683 0.7850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7280 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1400 14.1300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0000 14.1300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2 3 1 0 0 0 0
3 4 1 0 0 0 0
4 5 1 0 0 0 0
5 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 1 0 0 0 0
10 11 1 0 0 0 0
11 12 1 0 0 0 0
12 13 1 0 0 0 0
13 14 1 0 0 0 0
14 15 1 0 0 0 0
3 16 1 0 0 0 0
3 17 1 0 0 0 0
M CHG 1 1 -1
M CHG 1 3 1
M END
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