ATOM 25
1 C8y C 26.6758 -14.6363
2 C1c C 26.6758 -16.0207
3 O2x O 25.3149 -14.3502
4 C8x C 27.3650 -13.4273
5 N2b N 25.4726 -16.7274
6 C6a C 27.8848 -16.7216
7 N5x N 25.1630 -12.9718
8 C8y C 26.4305 -12.3993
9 C2b C 25.4726 -18.1350
10 O6a O 27.8791 -18.1175
11 O6a O 29.0881 -16.0148
12 O1a O 26.4888 -11.0791
13 C2b C 26.6874 -18.8418
14 C2y C 26.6874 -20.2494
15 C1x C 25.4669 -20.9446
16 C2x C 27.9024 -20.9446
17 C1y C 25.4669 -22.3521
18 C2y C 27.9024 -22.3521
19 N1x N 26.6874 -23.0588
20 C6a C 24.2519 -23.0588
21 C6a C 29.1173 -23.0588
22 O6a O 23.0311 -22.3521
23 O6a O 24.2519 -24.4606
24 O6a O 29.1173 -24.4606
25 O6a O 30.3380 -22.3521
BOND 26
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 1
5 2 6 1 #Up
6 3 7 1
7 4 8 1
8 5 9 2
9 6 10 1
10 6 11 2
11 8 12 1
12 9 13 1
13 13 14 2
14 14 15 1
15 14 16 1
16 15 17 1
17 16 18 2
18 17 19 1
19 17 20 1 #Down
20 18 21 1
21 20 22 1
22 20 23 2
23 21 24 1
24 21 25 2
25 7 8 2
26 18 19 1
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