ATOM 21
1 C8y C 24.6709 -21.2085
2 C8y C 24.6066 -19.8101
3 C8y C 23.4004 -21.9078
4 C8x C 25.8128 -21.9137
5 O2x O 25.8244 -19.1109 #+
6 C8x C 23.4004 -19.1051
7 C8y C 22.1828 -21.2085
8 O1a O 23.4004 -23.3062
9 C8y C 27.0248 -21.2202
10 C8y C 27.0306 -19.8160
11 C8y C 22.1828 -19.8101
12 O1a O 20.9766 -21.9078
13 O1a O 28.2310 -21.9194
14 C8y C 28.2484 -19.1168
15 O1a O 20.9650 -19.1051
16 C8x C 29.4546 -19.8334
17 C8x C 28.2484 -17.7242
18 C8x C 30.6724 -19.1342
19 C8x C 29.4662 -17.0307
20 C8y C 30.6781 -17.7300
21 O1a O 31.8960 -17.0424
BOND 23
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 2
9 5 10 2
10 6 11 2
11 7 12 1
12 9 13 1
13 10 14 1
14 11 15 1
15 14 16 2
16 14 17 1
17 16 18 1
18 17 19 2
19 18 20 2
20 20 21 1
21 7 11 1
22 9 10 1
23 19 20 1
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