ATOM 22
1 C1c C 30.1177 -17.1620
2 C5a C 31.3324 -17.8160
3 N1b N 28.9031 -17.8628
4 C1b C 30.1177 -15.7604
5 N1b N 32.5471 -17.0686
6 O5a O 31.3324 -19.2176
7 C5a C 27.6883 -17.2087
8 S2a S 31.2857 -14.5929
9 C1b C 33.7618 -17.7226
10 C1b C 26.4737 -17.9562
11 O5a O 27.6883 -15.8072
12 C6a C 34.9764 -16.9751
13 C1b C 25.2590 -17.3021
14 O6a O 36.1912 -17.6292
15 O6a O 34.9764 -15.5735
16 C1c C 24.0443 -18.0497
17 C6a C 22.8297 -17.3955
18 N1a N 24.0911 -19.4512
19 O6a O 21.6617 -18.1898
20 O6a O 22.8297 -15.9940
21 C1b C 32.5004 -15.2470
22 O1a O 33.7150 -14.4995
BOND 21
1 1 2 1
2 1 3 1
3 1 4 1 #Up
4 2 5 1
5 2 6 2
6 3 7 1
7 4 8 1
8 5 9 1
9 7 10 1
10 7 11 2
11 9 12 1
12 10 13 1
13 12 14 1
14 12 15 2
15 13 16 1
16 16 17 1
17 16 18 1 #Down
18 17 19 1
19 17 20 2
20 8 21 1
21 21 22 1
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