ATOM 25
1 C1y C 26.1118 -17.3723
2 O2x O 25.0308 -16.5969
3 C1y C 25.7025 -18.6423
4 C1y C 23.9685 -17.3723
5 C1y C 24.3714 -18.6423
6 O1a O 26.4140 -19.7169
7 C1b C 22.7045 -16.9571
8 O1a O 23.5838 -19.7109
9 O2b O 22.4359 -15.6564
10 P1b P 21.0986 -15.6504
11 O1c O 19.7735 -15.6504
12 O1c O 21.0986 -14.3254
13 O1c O 21.0925 -16.9815
14 N4y N 27.6534 -16.5834
15 C8y C 28.9786 -16.1329
16 C8y C 28.9599 -14.7330
17 N4x N 27.6228 -14.3181
18 C8y C 26.8151 -15.4616
19 N4x N 30.2003 -16.8166
20 C8y C 31.3333 -16.1005
21 N4x N 31.3846 -14.7006
22 C8y C 30.1629 -14.0169
23 O5x O 30.1439 -12.6002
24 O5x O 32.5666 -16.8100
25 O5x O 25.4100 -15.4804
BOND 27
1 1 2 1
2 1 3 1
3 2 4 1
4 3 5 1
5 3 6 1 #Down
6 4 7 1 #Up
7 5 8 1 #Down
8 7 9 1
9 9 10 1
10 10 11 1
11 10 12 1
12 10 13 2
13 4 5 1
14 1 14 1 #Up
15 14 15 1
16 15 16 2
17 16 17 1
18 17 18 1
19 14 18 1
20 15 19 1
21 19 20 1
22 20 21 1
23 21 22 1
24 16 22 1
25 22 23 2
26 20 24 2
27 18 25 2
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