ATOM 25
1 C1a C 12.3900 -18.3400
2 C5a C 13.6500 -17.6400
3 N1b N 14.8400 -18.3400
4 C1b C 16.1000 -17.6400
5 C1b C 17.2900 -18.3400
6 C1b C 18.4800 -17.6400
7 C1b C 19.7400 -18.3400
8 C1b C 20.9300 -17.6400
9 O5a O 13.6500 -16.1700
10 C6a C 22.1200 -18.2700
11 O6a O 23.3100 -17.6400 #-
12 O6a O 22.1200 -19.7400
13 C1a C 41.2163 -17.3445
14 C5a C 39.9760 -18.0788
15 N1b N 38.7673 -17.4118
16 C1b C 37.5269 -18.1461
17 C1b C 36.3182 -17.4790
18 C1b C 35.1478 -18.2114
19 C1b C 33.8691 -17.5463
20 C1b C 32.6988 -18.2787
21 O5a O 40.0164 -19.5483
22 C6a C 31.4919 -17.6816
23 O6a O 30.3197 -18.3440 #-
24 O6a O 31.4516 -16.2121
25 Z Zn 25.9700 -18.2700 #2+
BOND 22
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 6 7 1
7 7 8 1
8 2 9 2
9 8 10 1
10 10 11 1
11 10 12 2
12 13 14 1
13 14 15 1
14 15 16 1
15 16 17 1
16 17 18 1
17 18 19 1
18 19 20 1
19 14 21 2
20 20 22 1
21 22 23 1
22 22 24 2
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