ATOM 25
1 N4y N 27.0420 -17.4792
2 C8y C 27.4628 -18.7884
3 C8y C 28.1642 -16.6376
4 C1b C 25.8263 -16.7778
5 N5x N 28.8655 -18.7884
6 C1b C 26.6212 -19.9573
7 C8y C 29.2863 -17.4792
8 C1b C 28.1642 -15.2349
9 C8y C 24.6107 -17.5260
10 C1b C 27.2290 -21.2197
11 X Cl 30.6422 -17.0584
12 C6a C 29.3798 -14.5335
13 C1b C 26.3874 -22.3418
14 C1a C 26.9484 -23.6509
15 C8y C 23.3982 -16.8260
16 C8x C 22.1858 -17.5260
17 C8x C 22.1858 -18.9260
18 C8x C 23.3982 -19.6260
19 C8x C 24.6107 -18.9260
20 N2b N 23.3986 -15.4001 #+
21 O3a O 24.5972 -14.7084 #-
22 O3a O 22.1724 -14.6917
23 O6a O 30.6188 -15.2489 #-
24 O6a O 29.3804 -13.1601
25 Z Na 32.7600 -15.1200 #+
BOND 25
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 2
5 2 6 1
6 3 7 2
7 3 8 1
8 4 9 1
9 6 10 1
10 7 11 1
11 8 12 1
12 10 13 1
13 13 14 1
14 5 7 1
15 9 15 2
16 15 16 1
17 16 17 2
18 17 18 1
19 18 19 2
20 9 19 1
21 15 20 1
22 20 21 1
23 20 22 2
24 12 23 1
25 12 24 2
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