ATOM 27
1 C8x C 24.7100 -17.0800
2 C8y C 24.7100 -18.4800
3 C8x C 25.9000 -19.1800
4 C8x C 27.1600 -18.4800
5 C8y C 27.1600 -17.0800
6 C8x C 25.9000 -16.3800
7 S2a S 28.3500 -16.3800
8 C8y C 29.5400 -17.0800
9 C8x C 29.5400 -18.4800
10 C8x C 30.8000 -19.1800
11 C8y C 31.9900 -18.4800
12 C8x C 31.9900 -17.0800
13 C8x C 30.8000 -16.3800
14 O2b O 23.5200 -19.1800
15 O2b O 33.1800 -19.1800
16 P1a P 22.3300 -18.4800
17 O2b O 21.0700 -17.7800
18 S0 S 23.0300 -17.2900
19 O2b O 21.6300 -19.6700
20 P1a P 34.3700 -18.4800
21 O2b O 35.5600 -17.7100
22 O2b O 35.1400 -19.6700
23 S0 S 33.6700 -17.2900
24 C1a C 19.8800 -18.4800
25 C1a C 20.2300 -19.6700
26 C1a C 36.8200 -18.3400
27 C1a C 36.5400 -19.6700
BOND 28
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 5 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 2 14 1
16 11 15 1
17 14 16 1
18 16 17 1
19 16 18 2
20 16 19 1
21 15 20 1
22 20 21 1
23 20 22 1
24 20 23 2
25 17 24 1
26 19 25 1
27 21 26 1
28 22 27 1
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