ATOM 17
1 C8x C 19.2500 -18.9000
2 C8x C 19.2500 -20.3000
3 C8x C 20.4624 -21.0000
4 C8x C 21.6749 -20.3000
5 C8y C 21.6749 -18.9000
6 C8x C 20.4624 -18.2000
7 C8y C 22.9060 -18.1890
8 C8x C 24.1112 -18.8847
9 C8x C 25.3235 -18.1846
10 C8y C 25.3235 -16.7846
11 C8x C 24.1183 -16.0889
12 C8x C 22.9059 -16.7890
13 N1c N 26.5524 -16.1000
14 C5a C 27.7649 -16.8000
15 C1a C 28.9773 -16.1000
16 O1b O 26.5632 -14.7004
17 O5a O 27.7649 -18.1998
BOND 18
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 5 7 1
8 7 8 2
9 8 9 1
10 9 10 2
11 10 11 1
12 11 12 2
13 7 12 1
14 10 13 1
15 13 14 1
16 14 15 1
17 13 16 1
18 14 17 2
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