ATOM 23
1 N2y N 25.5447 -15.1509 #+
2 C1y C 26.3667 -14.0201
3 C2b C 25.5564 -16.5616
4 C1x C 24.2157 -14.7197
5 C1x C 25.5447 -12.8892
6 C6a C 27.7657 -14.0142
7 C2b C 26.7631 -17.2671
8 C1y C 24.2157 -13.3264
9 O6a O 28.4536 -12.7959
10 O6a O 28.7567 -15.0111 #-
11 C2y C 26.7572 -18.6602
12 O1a O 23.0031 -12.6211
13 C1x C 25.5331 -19.3481
14 C2x C 27.9581 -19.3714
15 C1y C 25.5214 -20.7529
16 C2y C 27.9465 -20.7705
17 N1x N 26.7338 -21.4641
18 C6a C 24.3031 -21.4467
19 C6a C 29.1472 -21.4875
20 O6a O 23.1023 -20.7296
21 O6a O 24.2857 -22.8458
22 O6a O 29.1298 -22.8865
23 O6a O 30.3656 -20.7938
BOND 24
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 1
5 2 6 1 #Up
6 3 7 1
7 4 8 1
8 6 9 2
9 6 10 1
10 7 11 2
11 8 12 1 #Down
12 11 13 1
13 11 14 1
14 13 15 1
15 14 16 2
16 15 17 1
17 15 18 1 #Down
18 16 19 1
19 18 20 1
20 18 21 2
21 19 22 1
22 19 23 2
23 5 8 1
24 16 17 1
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