ATOM 27
1 C8y C 27.0502 -27.9768
2 C8y C 27.0443 -29.3750
3 C8y C 25.8443 -27.2720
4 O2x O 28.2619 -27.2779
5 C8y C 25.8443 -30.0741
6 C8y C 28.2503 -30.0800
7 C8y C 24.6267 -27.9768
8 O2a O 25.8443 -25.8737
9 C8y C 29.4738 -27.9885
10 C8y C 24.6267 -29.3750
11 O1a O 25.8443 -31.4782
12 C8x C 29.4679 -29.3867
13 O5x O 28.3145 -31.4782
14 O2a O 23.4091 -27.2720
15 C1a C 24.6384 -25.1746
16 C8y C 30.6914 -27.2895
17 O2a O 23.4091 -30.0741
18 C1a C 22.1974 -27.9768
19 C8y C 31.8973 -28.0001
20 C8y C 30.6914 -25.8913
21 C1a C 22.1974 -29.3809
22 C8x C 33.1148 -27.3010
23 O2a O 31.8914 -29.4042
24 C8x C 31.9090 -25.1980
25 O1a O 29.4795 -25.1922
26 C8x C 33.1207 -25.9030
27 C1a C 33.0974 -30.1033
BOND 29
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 2
7 3 8 1
8 4 9 1
9 5 10 2
10 5 11 1
11 6 12 1
12 6 13 2
13 7 14 1
14 8 15 1
15 9 16 1
16 10 17 1
17 14 18 1
18 16 19 2
19 16 20 1
20 17 21 1
21 19 22 1
22 19 23 1
23 20 24 2
24 20 25 1
25 22 26 2
26 23 27 1
27 7 10 1
28 9 12 2
29 24 26 1
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