ATOM 14
1 N1b N 28.6480 -17.0777
2 C5a C 29.8665 -17.7658
3 O5a O 29.8665 -19.1681
4 C1a C 31.0781 -17.0655
5 C1c C 27.4459 -17.7891
6 C6a C 26.2274 -17.0940
7 O6a O 25.0182 -17.8054
8 O6a O 26.2180 -15.6946
9 C1b C 27.4552 -19.1884
10 S2a S 26.2462 -19.8927
11 C5a C 26.2555 -21.2920
12 O5a O 25.0534 -22.0034
13 N1b N 27.4740 -21.9871
14 C1a C 28.6602 -21.2936
BOND 13
1 2 4 1
2 6 8 2
3 1 2 1
4 5 9 1 #Up
5 1 5 1
6 9 10 1
7 2 3 2
8 10 11 1
9 5 6 1
10 11 12 2
11 11 13 1
12 6 7 1
13 13 14 1
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