ATOM 22
1 C8y C 23.1412 -19.9156
2 C8y C 23.1412 -21.3175
3 C8x C 24.3503 -19.2147
4 O2a O 21.9205 -19.2205
5 C8x C 24.3444 -22.0067
6 O2a O 21.9205 -22.0124
7 C8y C 25.5651 -19.9097
8 C1a C 20.7114 -19.9156
9 C8x C 25.5651 -21.3115
10 C1a C 20.7114 -21.3058
11 C1b C 26.7799 -19.2147
12 C1b C 27.9949 -19.9040
13 C1c C 29.2040 -19.2030
14 C1b C 29.2040 -17.8070
15 N1b N 30.4188 -19.8980
16 C1b C 30.4188 -17.1003
17 C2b C 31.6338 -19.1971
18 C1b C 31.6338 -17.8012
19 N2a N 32.8486 -19.8923
20 N1b N 32.8486 -17.0944
21 C2b C 34.0517 -17.7953
22 N2a N 35.2667 -17.0886
BOND 22
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 2
5 2 6 1
6 3 7 1
7 4 8 1
8 5 9 1
9 6 10 1
10 7 11 1
11 11 12 1
12 12 13 1
13 13 14 1
14 13 15 1
15 14 16 1
16 15 17 1
17 16 18 1
18 17 19 2
19 18 20 1
20 20 21 1
21 21 22 2
22 7 9 2
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