ATOM 18
1 C8y C 18.4100 -27.7200
2 C8y C 17.7100 -28.9100
3 C8x C 17.7100 -26.5300
4 C8x C 16.2400 -28.9100
5 C8x C 16.3100 -26.5300
6 C8x C 15.5400 -27.7200
7 N4x N 18.6200 -29.8900
8 C8x C 19.7400 -29.4700
9 C8y C 19.7400 -28.0000
10 O6a O 20.9300 -30.1700
11 C6a C 22.1200 -29.4700
12 C2c C 22.1200 -28.0700
13 C2b C 20.9300 -27.3700
14 O6a O 23.3100 -30.1700
15 R R 24.5700 -29.4700
16 C5a C 24.5700 -28.0700
17 N1b N 23.3800 -27.3700
18 O5a O 25.7600 -27.3700
BOND 19
1 1 2 2
2 1 3 1
3 2 4 1
4 3 5 2
5 4 6 2
6 5 6 1
7 2 7 1
8 7 8 1
9 8 9 2
10 1 9 1
11 10 11 1
12 11 12 1
13 12 13 2
14 9 13 1
15 11 14 2
16 15 16 1
17 16 17 1
18 12 17 1
19 16 18 2
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