ATOM 22
1 C8y C 14.6300 -18.0600
2 C8y C 14.6300 -19.4600
3 C8x C 15.8424 -20.1600
4 C8y C 17.0549 -19.4600
5 C8y C 17.0549 -18.0600
6 C8y C 15.8424 -17.3600
7 C5x C 18.3864 -19.8926
8 N1y N 19.2093 -18.7600
9 C1x C 18.3864 -17.6274
10 C1a C 13.4176 -17.3600
11 O2a O 15.8424 -15.9602
12 C1a C 14.6132 -15.2503
13 O5x O 18.8175 -21.2194
14 O2a O 13.4176 -20.1600
15 C1b C 12.2221 -19.4696
16 C2b C 11.0347 -20.1551
17 C2c C 9.8435 -19.4671
18 C1a C 8.6540 -20.1538
19 C1a C 9.8435 -18.0603
20 C1b C 20.5800 -18.7600
21 C1b C 21.2800 -19.9724
22 O1a O 22.6798 -19.9724
BOND 23
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 5 9 1
11 1 10 1
12 6 11 1
13 11 12 1
14 7 13 2
15 2 14 1
16 14 15 1
17 15 16 1
18 16 17 2
19 17 18 1
20 17 19 1
21 8 20 1
22 20 21 1
23 21 22 1
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