ATOM 16
1 Z Fe 22.4982 -16.6788
2 O5a O 22.6054 -14.7878
3 O5a O 24.5337 -17.7923
4 O5a O 20.7703 -17.8992
5 O2a O 24.5472 -16.0361
6 O2a O 22.4004 -18.6625
7 O2a O 20.9103 -15.5192
8 C5a C 23.5739 -14.2244
9 C5a C 24.5430 -18.9145
10 C5a C 19.8017 -17.3356
11 N1b N 24.5472 -14.7832
12 N1b N 23.5837 -19.4874
13 N1b N 19.8017 -16.2180
14 R R 23.5692 -13.1068
15 R R 25.5209 -19.4594
16 R R 18.8377 -17.8944
BOND 15
1 1 5 1
2 1 6 1
3 1 7 1
4 2 8 2
5 3 9 2
6 4 10 2
7 5 11 1
8 6 12 1
9 7 13 1
10 8 14 1
11 9 15 1
12 10 16 1
13 8 11 1
14 9 12 1
15 10 13 1
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