ATOM 15
1 C1b C 27.7622 -18.2015
2 C2c C 28.9792 -18.9040
3 S2a S 28.9792 -20.3176
4 N2b N 30.1730 -18.2145
5 O1b O 31.3784 -18.9107
6 C1b C 30.2033 -21.0244
7 C1c C 30.2033 -22.4381
8 N1a N 28.9850 -23.1415
9 C6a C 31.4467 -23.1558
10 O6a O 32.6499 -22.4608
11 O6a O 31.4471 -24.5738
12 C1b C 26.5626 -18.8941
13 C1b C 25.3514 -18.1946
14 S2a S 24.1579 -18.8835
15 C1a C 22.9557 -18.1893
BOND 14
1 1 2 1
2 2 3 1
3 2 4 2
4 4 5 1
5 3 6 1
6 6 7 1
7 7 8 1 #Up
8 7 9 1
9 9 10 1
10 9 11 2
11 1 12 1
12 12 13 1
13 13 14 1
14 14 15 1
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