ATOM 13
1 C2y C 28.5081 -18.5643
2 C1y C 28.4904 -19.9532
3 C2x C 29.8533 -18.2088
4 C1y C 27.3236 -17.8014
5 C1y C 29.7250 -20.4644
6 C1x C 27.1799 -20.6024
7 C5x C 30.6062 -19.3831
8 C1x C 26.0725 -18.4429
9 C1a C 27.3955 -16.3943
10 C1a C 30.0677 -21.8609
11 N1y N 26.0112 -19.8446
12 O5x O 32.0132 -19.3719
13 C1a C 24.7547 -20.4757
BOND 14
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 4 8 1
8 4 9 1 #Down
9 5 10 1 #Up
10 6 11 1
11 7 12 2
12 11 13 1
13 5 7 1
14 8 11 1
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