ATOM 17
1 C1x C 21.4489 -20.6694
2 C1y C 21.8825 -19.3383
3 S2x S 20.7454 -18.5093
4 C1x C 19.6154 -19.3383
5 C1x C 20.0489 -20.6694
6 C1b C 23.0883 -18.6289
7 C1b C 24.2986 -19.3325
8 C1b C 25.5086 -18.6289
9 C1b C 26.7188 -19.3325
10 C1b C 27.9291 -18.6289
11 C1b C 29.1391 -19.3325
12 C1b C 30.3422 -18.6289
13 C1b C 31.5525 -19.3325
14 C1b C 32.7627 -18.6289
15 C1b C 33.9727 -19.3325
16 C1b C 35.1830 -18.6289
17 C1a C 36.3932 -19.3325
BOND 17
1 3 4 1
2 8 9 1
3 4 5 1
4 9 10 1
5 5 1 1
6 10 11 1
7 11 12 1
8 2 6 1
9 12 13 1
10 1 2 1
11 13 14 1
12 6 7 1
13 14 15 1
14 2 3 1
15 15 16 1
16 7 8 1
17 16 17 1
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