ATOM 25
1 C8y C 28.1588 -17.3253
2 N4y N 27.1074 -16.5859
3 C8y C 29.3834 -16.4183
4 N5x N 28.2916 -18.7290
5 C1y C 25.8365 -17.0077
6 C8x C 27.5811 -15.2110
7 N5y N 29.0136 -15.2168 #+
8 C8y C 30.6195 -16.9730
9 C8y C 29.5971 -19.3010
10 O2x O 24.7158 -16.1585
11 C1y C 25.4090 -18.2439
12 C1a C 30.1922 -13.8131
13 N4x N 30.7814 -18.4402
14 O5x O 31.7172 -16.1526
15 N1a N 29.7474 -20.6701
16 C1y C 23.6240 -16.9499
17 C1y C 24.0400 -18.2439
18 O1a O 26.2119 -19.3588
19 C1b C 22.3185 -16.5167
20 O1a O 23.6066 -19.5437
21 O2b O 21.2843 -17.4409
22 P1b P 19.9094 -17.4409
23 O1c O 19.9037 -18.8158
24 O1c O 18.5346 -17.4409
25 O1c O 19.9037 -16.0660
BOND 27
1 1 2 1
2 1 3 2
3 1 4 1
4 5 2 1 #Up
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 2
9 5 10 1
10 5 11 1
11 7 12 1
12 8 13 1
13 8 14 2
14 9 15 1
15 10 16 1
16 11 17 1
17 11 18 1 #Down
18 16 19 1 #Up
19 17 20 1 #Down
20 19 21 1
21 21 22 1
22 22 23 1
23 22 24 1
24 22 25 2
25 6 7 2
26 9 13 1
27 16 17 1
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