ATOM 25
1 N1y N 20.2134 -16.5611
2 C1y C 20.2134 -15.1547
3 C5x C 18.8070 -16.5611
4 C2y C 21.4273 -17.2673
5 C1y C 18.8070 -15.1547
6 C1x C 21.4273 -14.4602
7 O5x O 17.8091 -17.5532
8 C2y C 22.6353 -16.5611
9 C6a C 21.4273 -18.6620
10 N1b N 17.5990 -14.4661
11 C1x C 22.6353 -15.1547
12 X Cl 23.8434 -17.2673
13 O6a O 20.2134 -19.3506
14 O6a O 22.6294 -19.3506
15 C5a C 16.3853 -15.1664
16 C1c C 15.1713 -14.4719
17 O5a O 16.3793 -16.5670
18 C8y C 13.9633 -15.1722
19 N1a N 15.1656 -13.0712
20 C8x C 13.9633 -16.5728
21 C8x C 12.7496 -14.4719
22 C8x C 12.7496 -17.2790
23 C8x C 11.5416 -15.1722
24 C8x C 11.5416 -16.5728
25 O0 O 25.7683 -14.4428
BOND 26
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 2
7 4 8 2
8 4 9 1
9 5 10 1 #Up
10 6 11 1
11 8 12 1
12 9 13 1
13 9 14 2
14 10 15 1
15 15 16 1
16 15 17 2
17 16 18 1
18 16 19 1 #Up
19 18 20 1
20 18 21 2
21 20 22 2
22 21 23 1
23 22 24 1
24 3 5 1
25 8 11 1
26 23 24 2
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