ATOM 13
1 C8y C 28.5015 -24.7376
2 C8y C 28.5015 -26.1635
3 C8y C 29.7054 -24.0305
4 N4x N 27.1983 -24.3051
5 N4x N 29.7054 -26.8472
6 N4x N 27.1983 -26.5960
7 N4y N 30.9267 -24.7668
8 O5x O 29.7054 -22.6513
9 C8y C 26.3801 -25.4623
10 C8y C 30.9267 -26.1110
11 C1a C 32.1773 -24.0889
12 O5x O 32.1773 -26.8122
13 O5x O 24.9900 -25.4691
BOND 14
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 3 8 2
8 4 9 1
9 5 10 1
10 7 11 1
11 10 12 2
12 6 9 1
13 7 10 1
14 9 13 2
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