ATOM 19
1 C8y C 25.5670 -31.9206
2 C8y C 25.5553 -33.3193
3 C5x C 24.3547 -31.2212
4 C8y C 26.7850 -31.2387
5 C5x C 24.3430 -34.0244
6 C8x C 26.7617 -34.0360
7 C8y C 23.1367 -31.9147
8 O5x O 24.3606 -29.8166
9 C8y C 27.9914 -31.9439
10 O1a O 26.7967 -29.8342
11 C8y C 23.2009 -33.3134
12 O5x O 24.3430 -35.4231
13 C8y C 27.9797 -33.3424
14 C8x C 21.9362 -31.2153
15 C1a C 29.2094 -31.2562
16 C8x C 21.9362 -34.0185
17 O1a O 29.1861 -34.0594
18 C8x C 20.7182 -31.9147
19 C8x C 20.7182 -33.3134
BOND 21
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 3 8 2
8 4 9 2
9 4 10 1
10 5 11 1
11 5 12 2
12 6 13 2
13 7 14 1
14 9 15 1
15 11 16 1
16 13 17 1
17 14 18 2
18 16 19 2
19 7 11 2
20 9 13 1
21 18 19 1
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