ATOM 28
1 C8y C 35.5600 -18.4100
2 C8x C 35.5600 -19.8100
3 C8x C 36.8200 -20.5100
4 C8x C 38.0100 -19.8100
5 C8x C 38.0100 -18.4100
6 C8x C 36.8200 -17.7100
7 O2a O 34.3700 -17.7100
8 C8y C 33.1800 -18.4100
9 C8x C 31.9900 -17.7100
10 C8y C 30.7300 -18.4100
11 C8x C 30.7300 -19.8100
12 C8x C 31.9200 -20.5100
13 C8x C 33.1800 -19.8100
14 C1b C 29.4700 -17.7100
15 O2a O 28.2800 -18.4100
16 C1b C 27.0900 -17.7100
17 C1d C 25.9000 -18.4100
18 C8y C 24.7100 -17.7100
19 C8x C 24.7100 -16.2400
20 C8x C 23.5200 -15.5400
21 C8y C 22.2600 -16.2400
22 C8x C 22.2600 -17.7100
23 C8x C 23.5200 -18.4100
24 O2a O 21.0700 -15.5400
25 C1b C 19.8800 -16.2400
26 C1a C 18.6900 -15.5400
27 C1a C 25.1300 -19.5300
28 C1a C 26.8100 -19.6000
BOND 30
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 1 7 1
8 7 8 1
9 8 9 2
10 9 10 1
11 10 11 2
12 11 12 1
13 12 13 2
14 8 13 1
15 10 14 1
16 14 15 1
17 15 16 1
18 16 17 1
19 17 18 1
20 18 19 2
21 19 20 1
22 20 21 2
23 21 22 1
24 22 23 2
25 18 23 1
26 21 24 1
27 24 25 1
28 25 26 1
29 17 27 1
30 17 28 1
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