ATOM 28
1 C8y C 23.7551 -16.5618
2 C8y C 24.9611 -15.8976
3 C8y C 22.5957 -15.8510
4 O2x O 23.7260 -17.9949
5 C5x C 26.1206 -16.6199
6 C8x C 24.9904 -14.5342
7 C8y C 22.6306 -14.4876
8 C2x C 21.4072 -16.5092
9 C1y C 24.8854 -18.6417
10 C1y C 26.0857 -17.9892
11 O5x O 27.3442 -15.9557
12 C8x C 23.8250 -13.8292
13 O2x O 21.4596 -13.7825
14 C2x C 20.3119 -15.7984
15 C1x C 24.9147 -20.0284
16 C8y C 27.2685 -18.7174
17 C1z C 20.2711 -14.4350
18 O2x O 26.0099 -20.7449
19 C8y C 27.2976 -20.0924
20 C8x C 28.4803 -18.0649
21 C1a C 19.1000 -13.7244
22 C1a C 19.0010 -15.4372
23 C8x C 28.3929 -20.8265
24 C8y C 29.6573 -18.7933
25 C8y C 29.6806 -20.1798
26 O2x O 30.9914 -18.4087
27 O2x O 30.9098 -20.6518
28 C1x C 31.7663 -19.5565
BOND 33
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 1
10 5 11 2
11 6 12 2
12 7 13 1
13 8 14 2
14 9 15 1
15 10 16 1
16 13 17 1
17 15 18 1
18 16 19 2
19 16 20 1
20 17 21 1
21 17 22 1
22 19 23 1
23 20 24 2
24 23 25 2
25 24 26 1
26 25 27 1
27 26 28 1
28 7 12 1
29 9 10 1
30 14 17 1
31 18 19 1
32 24 25 1
33 27 28 1
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