ATOM 31
1 C1y C 10.7800 -16.5200
2 C1x C 10.7800 -17.9200
3 C1y C 11.9924 -18.6200
4 C1z C 13.2049 -17.9200
5 C1y C 13.2049 -16.5200
6 C5x C 11.9924 -15.8200
7 C1x C 14.4173 -18.6200
8 C1x C 15.6297 -17.9200
9 C1y C 15.6297 -16.5200
10 C1z C 14.4173 -15.8200
11 C7x C 16.8422 -15.8200
12 O7x O 16.8422 -14.4200
13 C1y C 15.6297 -13.7200
14 C1x C 14.4173 -14.4200
15 O6a O 18.0753 -16.5322
16 O7a O 9.5676 -15.8200
17 C7a C 8.3551 -16.5200
18 C1a C 7.1427 -15.8200
19 O6a O 8.3551 -17.9198
20 O5x O 11.9924 -14.4202
21 C7a C 11.9924 -20.0198
22 C1a C 13.2049 -19.3200
23 C1a C 13.5773 -14.0476
24 C8y C 15.6297 -12.3201
25 C8x C 16.7494 -11.5065
26 C8x C 16.3216 -10.1902
27 O2x O 14.9375 -10.1903
28 C8x C 14.5099 -11.5067
29 O7a O 10.7632 -20.7297
30 O6a O 13.1880 -20.7102
31 C1a C 9.5592 -20.0346
BOND 34
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 4 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 5 10 1
12 9 11 1
13 11 12 1
14 12 13 1
15 13 14 1
16 10 14 1
17 11 15 2
18 1 16 1 #Down
19 16 17 1
20 17 18 1
21 17 19 2
22 6 20 2
23 3 21 1 #Down
24 4 22 1 #Down
25 10 23 1 #Down
26 13 24 1 #Up
27 24 25 1
28 25 26 2
29 26 27 1
30 27 28 1
31 24 28 2
32 21 29 1
33 21 30 2
34 29 31 1
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