ATOM 21
1 C2x C 14.8400 -19.8100
2 C2x C 14.8400 -21.2100
3 C1x C 16.0524 -21.9100
4 C1x C 17.2649 -21.2100
5 N1y N 17.2649 -19.8100
6 C5x C 16.0524 -19.1100
7 C5a C 18.5024 -19.1100
8 C2b C 19.7149 -19.8100
9 C2b C 20.9273 -19.1100
10 C8y C 22.1397 -19.8100
11 O5x O 16.0524 -17.7102
12 O5a O 18.5086 -17.7103
13 C8x C 22.1397 -21.2099
14 C8x C 23.3522 -21.9099
15 C8y C 24.5646 -21.2099
16 C8y C 24.5646 -19.8100
17 C8x C 23.3522 -19.1100
18 O2a O 25.7811 -19.1077
19 C1a C 26.9786 -19.7992
20 O2a O 25.7811 -21.9122
21 C1a C 26.9786 -21.2207
BOND 22
1 1 2 2
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 5 7 1
8 7 8 1
9 8 9 2
10 9 10 1
11 6 11 2
12 7 12 2
13 10 13 2
14 13 14 1
15 14 15 2
16 15 16 1
17 16 17 2
18 10 17 1
19 16 18 1
20 18 19 1
21 15 20 1
22 20 21 1
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