ATOM 17
1 C8x C 13.6500 -17.0800
2 C8x C 13.6500 -18.4800
3 C8x C 14.8624 -19.1800
4 C8y C 16.0749 -18.4800
5 C8y C 16.0749 -17.0800
6 C8x C 14.8624 -16.3800
7 N4x N 17.4064 -18.9126
8 C8x C 18.2293 -17.7800
9 C8y C 17.4064 -16.6474
10 C1b C 17.7784 -15.3040
11 C1b C 19.1269 -14.9278
12 C1b C 19.4753 -13.5718
13 O2b O 20.8238 -13.1955
14 P1b P 20.8238 -11.7955
15 O1c O 22.2238 -11.7955
16 O1c O 19.4238 -11.7955
17 O1c O 20.8238 -10.3955
BOND 18
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 4 7 1
8 7 8 1
9 8 9 2
10 5 9 1
11 9 10 1
12 10 11 1
13 11 12 1
14 12 13 1
15 13 14 1
16 14 15 1
17 14 16 1
18 14 17 2
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