ATOM 21
1 C1a C 21.9567 -20.8367
2 C1b C 23.1691 -20.1367
3 C1b C 24.3815 -20.8367
4 C1b C 25.5940 -20.1367
5 C1b C 26.8064 -20.8367
6 N1d N 28.0188 -20.1367 #+
7 C1b C 29.2313 -20.8367
8 C1b C 30.4437 -20.1367
9 C1b C 31.6561 -20.8367
10 C1b C 32.8686 -20.1367
11 C1a C 34.0811 -20.8367
12 C1b C 28.0188 -21.5367
13 C1b C 28.0188 -18.7367
14 C1b C 29.2071 -18.0509
15 C1b C 30.4104 -18.7460
16 C1b C 31.5941 -18.0629
17 C1a C 32.7870 -18.7521
18 C1b C 29.2268 -22.2344
19 C1b C 30.4525 -21.5265
20 C1b C 31.6775 -22.2332
21 C1a C 32.9017 -21.5953
BOND 20
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 6 7 1
7 7 8 1
8 8 9 1
9 9 10 1
10 10 11 1
11 6 12 1
12 6 13 1
13 13 14 1
14 14 15 1
15 15 16 1
16 16 17 1
17 12 18 1
18 18 19 1
19 19 20 1
20 20 21 1
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