ATOM 22
1 O6a O 15.3143 -14.4870
2 C6a C 16.5256 -15.1811
3 C1b C 17.7369 -14.4798
4 C1b C 18.9481 -15.1739
5 C7a C 20.1594 -14.4727
6 O7a O 21.3707 -15.1670
7 C1c C 22.5820 -14.4657
8 C1b C 23.7932 -15.1598
9 C5a C 25.0045 -14.4586
10 N1b N 26.2158 -15.1527
11 C1b C 27.4270 -14.4514
12 C1c C 28.6383 -15.1457
13 O6a O 16.5287 -16.5836
14 O6a O 20.1564 -13.0701
15 C1a C 22.5789 -13.0632
16 O5a O 25.0014 -13.0560
17 C1b C 28.6427 -16.5482
18 C1a C 29.8596 -17.2456
19 C1b C 29.8508 -14.4405
20 C1b C 31.0675 -15.1379
21 C1b C 32.2800 -14.4327
22 C1a C 33.4968 -15.1301
BOND 21
1 5 6 1
2 11 12 1
3 1 2 1
4 2 13 2
5 6 7 1
6 5 14 2
7 3 4 1
8 7 15 1
9 7 8 1
10 9 16 2
11 12 17 1
12 8 9 1
13 17 18 1
14 4 5 1
15 12 19 1
16 9 10 1
17 19 20 1
18 2 3 1
19 20 21 1
20 10 11 1
21 21 22 1
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