ATOM 12
1 C6a C 23.5385 -21.7560
2 C1c C 24.7451 -21.0593
3 N1b N 25.9518 -21.7560
4 C1b C 27.1584 -21.0593
5 C1b C 28.3650 -21.7560
6 S4a S 29.5717 -21.0593
7 O1d O 30.7989 -21.7681
8 O1d O 30.5568 -20.0045
9 O1d O 28.5865 -20.0742
10 C1a C 24.7451 -19.6662
11 O6a O 22.3319 -21.0593
12 O6a O 23.5385 -23.1493
BOND 11
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 6 7 1
7 6 8 2
8 6 9 2
9 2 10 1 #Up
10 1 11 1
11 1 12 2
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