ATOM 25
1 C1x C 23.5794 -17.7707
2 C5x C 23.5794 -19.1698
3 N1y N 24.9785 -19.1698
4 C1y C 24.9785 -17.7707
5 C1x C 26.3090 -19.6019
6 C1y C 27.1312 -18.4702
7 O2x O 26.3090 -17.3385
8 O5x O 22.5903 -20.1589
9 C1c C 28.3584 -17.7707
10 C1c C 29.5700 -18.4702
11 N1a N 30.7997 -17.7598
12 C5a C 29.5701 -19.8696
13 O1a O 28.3621 -16.3801
14 N1b N 30.7641 -20.5593
15 O5a O 28.3306 -20.5853
16 C1c C 30.7644 -22.9596
17 C6a C 31.9510 -23.6449
18 C1c C 29.5263 -23.6749
19 C1c C 28.3177 -22.9774
20 O1a O 29.5268 -25.0599
21 C1b C 27.1372 -23.6594
22 N1a N 25.9421 -22.9696
23 O6a O 33.1337 -22.9622
24 O6a O 31.9513 -25.0597
25 O1a O 28.3169 -21.7004
BOND 26
1 1 2 1
2 2 3 1
3 3 4 1
4 1 4 1
5 3 5 1
6 5 6 1
7 6 7 1
8 4 7 1
9 2 8 2
10 6 9 1 #Up
11 9 10 1
12 10 11 1
13 10 12 1 #Up
14 9 13 1
15 12 14 1
16 12 15 2
17 14 16 1
18 16 17 1 #Up
19 16 18 1
20 18 19 1
21 18 20 1
22 19 21 1
23 21 22 1
24 17 23 1
25 17 24 2
26 19 25 1 #Up
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