ATOM 21
1 C8y C 27.3988 -20.6040
2 C8y C 28.6015 -19.9034
3 C8y C 26.1902 -19.8974
4 C8x C 27.4045 -22.0053
5 C8y C 28.6191 -18.5080
6 C5x C 29.8043 -20.6157
7 C8y C 24.9699 -20.5981
8 C8x C 26.1959 -18.4963
9 C8x C 26.1902 -22.7000
10 C5x C 29.8334 -17.8307
11 C8x C 27.4162 -17.8073
12 C2x C 31.0187 -19.9267
13 O5x O 29.7867 -22.0170
14 C8y C 24.9699 -22.0053
15 O2a O 23.7555 -19.8917
16 C2y C 31.0304 -18.5371
17 O5x O 29.8511 -16.4235
18 O1a O 23.7555 -22.7060
19 C1a C 22.5352 -20.5981
20 O2a O 32.2566 -17.8481
21 C1a C 33.4650 -18.5605
BOND 23
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 2
9 5 10 1
10 5 11 1
11 6 12 1
12 6 13 2
13 7 14 2
14 7 15 1
15 10 16 1
16 10 17 2
17 14 18 1
18 15 19 1
19 16 20 1
20 20 21 1
21 8 11 2
22 9 14 1
23 12 16 2
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