ATOM 30
1 C8x C 33.9184 -17.3854
2 C8x C 33.9184 -18.7852
3 C8y C 32.7031 -19.4852
4 C8x C 32.7031 -16.6854
5 C8y C 31.4950 -17.3854
6 N4y N 31.5011 -18.7852
7 C1x C 30.2917 -19.4905
8 C1y C 29.0763 -18.7956
9 C1x C 29.0703 -17.3957
10 C1y C 30.2797 -16.6907
11 C1x C 29.0754 -15.9785
12 N1y N 27.8593 -16.6642
13 C1x C 27.8734 -18.0853
14 O5x O 32.7165 -20.8851
15 C8x C 19.3822 -17.3925
16 C8x C 19.3822 -18.7924
17 C8y C 20.5975 -19.4923
18 C8x C 20.5975 -16.6925
19 C8y C 21.8056 -17.3925
20 N4y N 21.8695 -18.7924
21 C1x C 23.0089 -19.4974
22 C1y C 24.2243 -18.8027
23 C1x C 24.2302 -17.4028
24 C1y C 23.0209 -16.6978
25 C1x C 24.2252 -15.9855
26 N1y N 25.4413 -16.6713
27 C1x C 25.4272 -18.0924
28 O5x O 20.5841 -20.8922
29 C5a C 26.6503 -15.9714
30 O5a O 26.6432 -14.5715
BOND 35
1 3 14 2
2 5 4 2
3 4 1 1
4 5 6 1
5 6 7 1
6 15 16 2
7 16 17 1
8 17 20 1
9 19 18 2
10 18 15 1
11 7 8 1
12 8 9 1 #Up
13 10 9 1 #Up
14 10 5 1
15 10 11 1
16 19 20 1
17 20 21 1
18 21 22 1
19 22 23 1 #Down
20 24 23 1 #Down
21 24 19 1
22 8 13 1
23 24 25 1
24 22 27 1
25 25 26 1
26 11 12 1
27 1 2 2
28 26 27 1
29 2 3 1
30 17 28 2
31 12 13 1
32 26 29 1
33 29 12 1
34 3 6 1
35 29 30 2
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