ATOM 20
1 C8y C 27.6146 -16.6538
2 C8y C 28.8286 -17.3660
3 C8y C 26.4005 -17.3484
4 C1b C 27.5563 -15.2472
5 C8y C 28.8112 -18.7553
6 C8x C 30.0486 -16.6889
7 C8y C 26.3888 -18.7436
8 C8x C 25.0754 -16.9049
9 C2b C 28.7762 -14.5524
10 C8y C 27.5912 -19.4557
11 O7x O 30.0078 -19.4732
12 C8x C 31.2452 -17.3951
13 O2x O 25.0578 -19.1696
14 C8x C 24.2407 -18.0314
15 C2c C 28.7879 -13.1458
16 O1a O 27.5855 -20.8624
17 C8y C 31.2278 -18.7903
18 C1a C 30.0079 -12.4570
19 C1a C 27.5737 -12.4394
20 O6a O 32.4302 -19.5141
BOND 22
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 2
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 1
9 5 10 1
10 5 11 1
11 6 12 2
12 7 13 1
13 8 14 2
14 9 15 2
15 10 16 1
16 11 17 1
17 15 18 1
18 15 19 1
19 17 20 2
20 7 10 2
21 12 17 1
22 13 14 1
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