ATOM 20
1 N4y N 24.2953 -16.0569
2 C8y C 22.9955 -15.6257
3 C1y C 23.7818 -17.8767
4 C8x C 25.1070 -14.9727
5 C8y C 23.0145 -14.2562
6 N2x N 21.9049 -16.4754
7 O2x O 22.6721 -17.0713
8 C1y C 23.3633 -19.1955
9 N5x N 24.3270 -13.8503
10 C1y C 21.9557 -13.3811
11 C2x C 20.5670 -16.1457
12 C1y C 21.5499 -17.8767
13 C1y C 21.9746 -19.1955
14 O1a O 24.1749 -20.3114
15 C1x C 20.6114 -13.6538
16 O1a O 22.4316 -11.9032
17 N1x N 19.9965 -14.8966
18 C1b C 20.2373 -17.4455
19 O1a O 21.1630 -20.3114
20 O1a O 19.2102 -18.3649
BOND 22
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 8 14 1 #Down
14 10 15 1
15 10 16 1 #Up
16 11 17 1
17 12 18 1 #Up
18 13 19 1 #Down
19 18 20 1
20 5 9 1
21 12 13 1
22 15 17 1
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