ATOM 25
1 C1z C 27.3700 -17.7800
2 C5x C 26.2500 -16.9400
3 N1x N 28.4900 -16.9400
4 N1y N 26.7400 -15.6100
5 C5x C 28.0700 -15.6100
6 O5x O 28.9100 -14.4900
7 C1b C 25.8300 -14.5600
8 O5x O 24.8500 -16.9400
9 C8x C 23.9400 -18.6900
10 C8x C 23.9400 -20.0900
11 C8x C 25.1300 -20.7900
12 C8x C 26.3200 -20.0900
13 C8y C 26.3200 -18.6900
14 C8x C 25.1300 -17.9900
15 C8y C 28.4900 -18.6900
16 C8x C 28.4900 -20.0900
17 C8x C 29.7500 -20.7900
18 C8x C 30.9400 -20.0900
19 C8x C 30.9400 -18.6900
20 C8x C 29.7500 -17.9900
21 O2b O 24.4300 -14.7700
22 P1b P 23.5200 -13.7200
23 O1c O 22.5400 -12.7400
24 O1c O 24.5000 -12.8100
25 O1c O 22.4700 -14.7700
BOND 27
1 1 2 1
2 1 3 1
3 2 4 1
4 3 5 1
5 5 6 2
6 4 5 1
7 4 7 1
8 2 8 2
9 9 10 2
10 10 11 1
11 11 12 2
12 12 13 1
13 13 14 2
14 9 14 1
15 1 13 1
16 15 16 2
17 16 17 1
18 17 18 2
19 18 19 1
20 19 20 2
21 15 20 1
22 1 15 1
23 7 21 1
24 21 22 1
25 22 23 2
26 22 24 1
27 22 25 1
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