ATOM 26
1 C8x C 25.2700 -17.9900
2 C8y C 25.2700 -16.5900
3 C8x C 24.0800 -15.8900
4 C8y C 22.8200 -16.5900
5 C8x C 22.8200 -17.9900
6 C8y C 24.0800 -18.6900
7 C1a C 24.0800 -20.0900
8 C1a C 21.6300 -15.8900
9 C5a C 26.4600 -15.8900
10 N1c N 27.7200 -16.5900
11 N1b N 28.9100 -15.8900
12 C5a C 30.1000 -16.5900
13 C8y C 31.3600 -15.8900
14 O5a O 26.4600 -14.4900
15 C1d C 27.7200 -18.1300
16 C1a C 28.9100 -18.8300
17 C1a C 26.5300 -18.8300
18 C1a C 27.7200 -19.5300
19 O5a O 30.1000 -17.8500
20 C8x C 32.5500 -16.5900
21 C8x C 33.8100 -15.8900
22 C8y C 33.8100 -14.4900
23 C8x C 32.5500 -13.7900
24 C8x C 31.3600 -14.4900
25 C1b C 35.0000 -13.7900
26 C1a C 36.1900 -14.4900
BOND 27
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 6 7 1
8 4 8 1
9 2 9 1
10 9 10 1
11 10 11 1
12 11 12 1
13 12 13 1
14 9 14 2
15 10 15 1
16 15 16 1
17 15 17 1
18 15 18 1
19 12 19 2
20 13 20 2
21 20 21 1
22 21 22 2
23 22 23 1
24 23 24 2
25 13 24 1
26 22 25 1
27 25 26 1
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