ATOM 22
1 N4y N 40.2207 -23.7771
2 C8y C 38.9149 -23.3627
3 C1y C 39.4172 -25.8173
4 C8x C 41.0179 -22.6723
5 C8y C 38.9149 -21.9943
6 N5x N 37.7347 -24.0407
7 O2x O 38.3123 -25.0137
8 C1x C 38.9903 -27.1167
9 N5x N 40.2143 -21.5736
10 C8y C 37.7347 -21.3100
11 C8x C 36.5484 -23.3564
12 C1y C 37.2075 -25.8173
13 C1y C 37.6280 -27.1167
14 N4x N 36.5484 -21.9943
15 O5x O 37.7159 -19.9478
16 C1b C 36.0212 -25.1268
17 O1a O 37.2639 -28.4287
18 O2b O 34.8346 -25.8047
19 P1b P 33.4726 -25.8047
20 O1c O 33.4662 -24.4361
21 O1c O 32.1039 -25.8047
22 O1c O 33.4662 -27.1670
BOND 24
1 1 2 1
2 3 1 1 #Up
3 1 4 1
4 2 5 2
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 2
9 5 10 1
10 6 11 2
11 7 12 1
12 8 13 1
13 10 14 1
14 10 15 2
15 12 16 1 #Up
16 13 17 1 #Down
17 16 18 1
18 18 19 1
19 19 20 1
20 19 21 1
21 19 22 2
22 5 9 1
23 11 14 1
24 12 13 1
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