ATOM 25
1 C1y C 21.6546 -20.2658
2 C1z C 20.9479 -19.0503
3 C1y C 20.2519 -20.2772
4 O2x O 28.3255 -21.6014
5 C8y C 28.7611 -20.2716
6 C8x C 27.6259 -19.4460
7 C8y C 26.4910 -20.2716
8 C8x C 26.9263 -21.6014
9 C8y C 31.1807 -20.2728
10 C8x C 31.1807 -21.6720
11 C8x C 32.3954 -22.3716
12 C8x C 33.6029 -21.6720
13 C8x C 33.6029 -20.2728
14 C8x C 32.3954 -19.5732
15 C1b C 29.9723 -19.5732
16 C1b C 25.2798 -19.5662
17 O7a O 24.0714 -20.2658
18 C7a C 22.8630 -19.5662
19 C2b C 19.0399 -19.5732
20 C2c C 17.8314 -20.2728
21 C1a C 16.6230 -19.5732
22 C1a C 17.8244 -21.6720
23 C1a C 20.2413 -17.8347
24 C1a C 21.6405 -17.8347
25 O6a O 22.8559 -18.1670
BOND 27
1 11 12 2
2 12 13 1
3 13 14 2
4 14 9 1
5 6 7 1
6 9 15 1
7 15 5 1
8 7 8 2
9 7 16 1
10 8 4 1
11 16 17 1
12 1 2 1
13 17 18 1
14 18 1 1
15 1 3 1
16 3 19 1
17 3 2 1
18 19 20 2
19 20 21 1
20 4 5 1
21 20 22 1
22 5 6 2
23 2 23 1
24 9 10 2
25 2 24 1
26 10 11 1
27 18 25 2
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