Mol:
8.1580 28.2600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1580 29.8300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7983 30.6150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7983 32.1850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4386 32.9700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4386 34.5400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0790 35.3250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0790 36.8950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7193 37.6800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7193 39.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3597 40.0350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3597 41.6050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0000 42.3900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.6669 21.1950 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
15 16 1 0 0 0 0
16 17 1 0 0 0 0
17 18 1 0 0 0 0
18 19 1 0 0 0 0
19 20 1 0 0 0 0
20 21 1 0 0 0 0
3 22 1 0 0 0 0
22 23 1 0 0 0 0
23 24 1 0 0 0 0
24 25 1 0 0 0 0
25 26 1 0 0 0 0
26 27 1 0 0 0 0
27 28 1 0 0 0 0
28 29 1 0 0 0 0
29 30 1 0 0 0 0
30 31 1 0 0 0 0
31 32 1 0 0 0 0
32 33 1 0 0 0 0
33 34 1 0 0 0 0
34 35 1 0 0 0 0
35 36 1 0 0 0 0
36 37 1 0 0 0 0
37 38 1 0 0 0 0
38 39 1 0 0 0 0
3 40 1 0 0 0 0
M CHG 1 1 -1
M CHG 1 3 1
M END
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