ATOM 30
1 C8x C 25.5176 -16.9395
2 C8y C 25.5176 -18.3459
3 C8y C 26.7394 -19.0455
4 C8y C 27.9541 -18.3459
5 C8x C 27.9541 -16.9395
6 C8y C 26.7394 -16.2330
7 C8x C 24.3227 -14.8215
8 C8x C 24.3227 -12.0088
9 C8y C 25.5374 -12.7156
10 C8y C 25.5313 -14.1219
11 C1y C 26.7472 -14.8266
12 C1y C 26.7593 -12.0141
13 C1y C 27.9750 -12.7259
14 C1y C 28.0350 -14.1387
15 C7x C 29.3059 -14.5829
16 O7x O 30.1401 -13.4443
17 C1x C 29.3221 -12.2939
18 C8y C 23.1009 -14.1219
19 C8y C 23.1075 -12.7201
20 O2x O 21.7760 -12.2758
21 C1x C 20.9512 -13.4075
22 O2x O 21.7655 -14.5466
23 O6a O 30.1457 -15.4926
24 O1a O 26.7226 -10.5229
25 O2a O 29.1734 -19.0446
26 O2a O 26.7411 -20.4517
27 O2a O 24.2992 -19.0462
28 C1a C 30.3847 -18.3440
29 C1a C 23.0801 -18.3471
30 C1a C 27.9609 -21.1569
BOND 34
1 13 14 1
2 14 15 1
3 15 16 1
4 16 17 1
5 17 13 1
6 9 8 1
7 8 19 2
8 2 3 1
9 3 4 2
10 4 5 1
11 18 19 1
12 19 20 1
13 20 21 1
14 21 22 1
15 22 18 1
16 5 6 2
17 15 23 2
18 11 6 1 #Down
19 9 10 2
20 12 24 1 #Down
21 10 11 1
22 11 14 1
23 13 12 1
24 12 9 1
25 4 25 1
26 6 1 1
27 3 26 1
28 2 27 1
29 1 2 2
30 25 28 1
31 18 7 2
32 27 29 1
33 7 10 1
34 26 30 1
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