ATOM 28
1 C8y C 26.8005 -17.0706
2 C2y C 28.0017 -17.7818
3 C8y C 26.8064 -15.6712
4 C8x C 25.5936 -17.7760
5 N1y N 29.2203 -17.0823
6 C2b C 27.9958 -19.1695
7 C8x C 25.5936 -14.9715
8 C1x C 28.0134 -14.9773
9 C8y C 24.3750 -17.0706
10 C1x C 29.1561 -15.6770
11 C4a C 30.4273 -17.7818
12 C8y C 29.2087 -19.8634
13 C8y C 24.3750 -15.6712
14 O2a O 23.1623 -17.7760
15 O4a O 31.6400 -17.0706
16 C8y C 29.2028 -21.2628
17 C8x C 30.4273 -19.1695
18 O2a O 23.1623 -14.9715
19 C1a C 21.9495 -17.0706
20 C8y C 30.4156 -21.9682
21 O1a O 27.9841 -21.9625
22 C8x C 31.6400 -19.8751
23 C1a C 21.9495 -15.6712
24 C8y C 31.6343 -21.2745
25 O2a O 30.4740 -23.3676
26 O2a O 32.8353 -21.9742
27 C1a C 31.6167 -24.0673
28 C1a C 34.0460 -21.2814
BOND 30
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 1
5 2 6 2
6 3 7 1
7 3 8 1
8 4 9 2
9 5 10 1
10 5 11 1
11 6 12 1
12 7 13 2
13 9 14 1
14 11 15 2
15 12 16 2
16 12 17 1
17 13 18 1
18 14 19 1
19 16 20 1
20 16 21 1
21 17 22 2
22 18 23 1
23 20 24 2
24 20 25 1
25 24 26 1
26 25 27 1
27 8 10 1
28 9 13 1
29 22 24 1
30 26 28 1
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