ATOM 23
1 C8x C 14.4200 -18.4100
2 C8x C 14.4200 -19.8100
3 C8x C 15.6100 -20.5100
4 C8y C 16.8700 -19.8100
5 C8y C 16.8700 -18.4100
6 C8x C 15.6100 -17.7100
7 C1x C 18.0600 -20.5100
8 C1x C 19.2500 -19.8100
9 N1y N 19.2500 -18.4100
10 C1y C 18.0600 -17.7100
11 C5x C 20.5100 -17.7100
12 C1x C 20.5100 -16.3100
13 N1y N 19.2500 -15.6100
14 C1x C 18.0600 -16.3100
15 C5a C 19.2500 -14.2100
16 O5a O 18.0600 -13.5100
17 C1y C 20.5100 -13.5100
18 O5x O 21.7000 -18.4100
19 C1x C 21.7000 -14.2100
20 C1x C 22.8900 -13.5100
21 C1x C 22.8900 -12.1100
22 C1x C 21.7000 -11.4100
23 C1x C 20.5100 -12.1100
BOND 26
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 4 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 5 10 1
12 9 11 1
13 11 12 1
14 12 13 1
15 13 14 1
16 10 14 1
17 13 15 1
18 15 16 2
19 15 17 1
20 11 18 2
21 17 19 1
22 19 20 1
23 20 21 1
24 21 22 1
25 22 23 1
26 17 23 1
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