ATOM 34
1 N5x N 10.7210 -16.6950
2 C8y C 10.0597 -17.9275
3 N4x N 10.7349 -19.0100
4 C8y C 12.1944 -19.0732
5 C8y C 12.7957 -17.8760
6 C8y C 12.1192 -16.6513
7 N1x N 12.8699 -20.2957
8 C1x C 14.3291 -20.2889
9 C1y C 14.9303 -19.0216
10 N1y N 14.2539 -17.8673
11 C1x C 16.2793 -18.7932
12 N1y N 16.4523 -17.2582
13 C1x C 15.1574 -16.7291
14 O5x O 12.7806 -15.4191
15 N1a N 8.6616 -17.9008
16 C8y C 17.7035 -16.5658
17 C8x C 18.8900 -17.2799
18 C8x C 20.1838 -16.6027
19 C8y C 20.1392 -15.2040
20 C8x C 18.9527 -14.4900
21 C8x C 17.7290 -15.1673
22 C5a C 21.3703 -14.5229
23 N1b N 22.5801 -15.2509
24 O5a O 21.3253 -13.1375
25 C1c C 23.7811 -14.5863
26 C1b C 24.9529 -15.2917
27 C1b C 26.1781 -14.6138
28 C6a C 23.8073 -13.1721
29 O6a O 25.0442 -12.4881 #-
30 O6a O 22.6164 -12.4550
31 C6a C 27.3417 -15.3138
32 O6a O 28.5793 -14.6289 #-
33 O6a O 27.3869 -16.6832
34 Z Ca 27.0809 -12.1072 #2+
BOND 36
1 1 2 2
2 2 3 1
3 3 4 1
4 4 5 2
5 5 6 1
6 1 6 1
7 4 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 5 10 1
12 9 11 1
13 11 12 1
14 12 13 1
15 10 13 1
16 6 14 2
17 2 15 1
18 12 16 1
19 16 17 2
20 17 18 1
21 18 19 2
22 19 20 1
23 20 21 2
24 16 21 1
25 19 22 1
26 22 23 1
27 22 24 2
28 23 25 1
29 25 26 1
30 26 27 1
31 25 28 1 #Down
32 28 29 1
33 28 30 2
34 27 31 1
35 31 32 1
36 31 33 2
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