ATOM 24
1 C1y C 38.5700 -25.2000
2 C1x C 38.5700 -26.6700
3 C1x C 39.7600 -27.3700
4 C1y C 40.9500 -26.6700
5 C1x C 40.9500 -25.2000
6 C5x C 39.7600 -24.5000
7 O5x O 39.7600 -23.1000
8 C1a C 42.2100 -27.3700
9 C1d C 37.3100 -24.5000
10 C1b C 36.1200 -25.2000
11 C1a C 37.3100 -23.1000
12 O2a O 34.9300 -24.5700
13 C1y C 33.7400 -25.2000
14 O2x O 32.5500 -24.5700
15 C1y C 31.3600 -25.2700
16 C1y C 31.3600 -26.6700
17 C1y C 32.5500 -27.3000
18 C1y C 33.7400 -26.6000
19 O1a O 35.0000 -27.3700
20 O1a O 32.5500 -28.7700
21 O1a O 30.1000 -27.3700
22 C1b C 30.1000 -24.5000
23 O1a O 28.9800 -25.2000
24 O1a O 37.3100 -26.0400
BOND 25
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 6 7 2
8 4 8 1
9 1 9 1
10 9 10 1
11 9 11 1
12 10 12 1
13 12 13 1
14 13 14 1
15 14 15 1
16 15 16 1
17 16 17 1
18 17 18 1
19 13 18 1
20 18 19 1
21 17 20 1
22 16 21 1
23 15 22 1
24 22 23 1
25 9 24 1
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