ATOM 26
1 C1y C 16.8492 -16.2080
2 C1y C 16.8492 -17.5469
3 O2a O 18.0471 -15.5034
4 O2x O 15.6513 -15.5034
5 C1y C 15.6513 -18.2516
6 N1a N 17.9062 -18.6039
7 C1y C 19.2451 -14.7987
8 C1y C 14.4534 -16.2080
9 C1y C 14.4534 -17.5469
10 O1a O 15.6513 -19.6609
11 C1y C 19.2451 -13.3894
12 C1y C 20.4430 -15.5034
13 C1b C 13.2555 -15.5034
14 O1a O 13.2555 -18.2516
15 O2x O 20.4430 -12.6848
16 C1b C 18.0471 -12.6848
17 C1y C 21.7114 -14.7987
18 O1a O 20.4430 -16.8422
19 O1a O 12.1985 -16.4194
20 C1y C 21.7114 -13.3894
21 O1a O 16.9902 -13.6008
22 N1b N 22.7683 -15.8557
23 O1a O 22.9093 -12.6848
24 C5a C 23.9663 -15.1511
25 C1a C 25.1642 -15.8557
26 O5a O 23.9663 -13.7417
BOND 27
1 1 2 1
2 1 3 1 #Up
3 1 4 1
4 2 5 1
5 2 6 1 #Down
6 7 3 1 #Down
7 4 8 1
8 5 9 1
9 5 10 1 #Up
10 7 11 1
11 7 12 1
12 8 13 1 #Up
13 9 14 1 #Down
14 11 15 1
15 11 16 1 #Up
16 12 17 1
17 12 18 1 #Up
18 13 19 1
19 15 20 1
20 16 21 1
21 17 22 1 #Down
22 20 23 1 #Either
23 8 9 1
24 17 20 1
25 22 24 1
26 24 25 1
27 24 26 2
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