ATOM 26
1 N4y N 31.6476 -15.4449
2 C1y C 30.6775 -17.7358
3 O2x O 29.5845 -16.9526
4 C1y C 30.2801 -18.9747
5 C1y C 28.5210 -17.7124
6 C1y C 28.9417 -18.9747
7 O1a O 31.0633 -20.0326
8 O1a O 28.1878 -20.0443
9 C1b C 27.2776 -17.0100
10 S2a S 26.0651 -17.7100
11 C1b C 24.8527 -17.0100
12 C1b C 23.6403 -17.7100
13 C1c C 22.4278 -17.0100
14 C6a C 21.2154 -17.7100
15 O6a O 20.0030 -17.0100
16 N1a N 22.4278 -15.6103
17 O6a O 21.2154 -19.1100
18 C8x C 32.4631 -14.3053
19 N5x N 31.6248 -13.1840
20 C8y C 30.2994 -13.6348
21 C8y C 30.3185 -15.0346
22 C8y C 29.0775 -12.9514
23 N5x N 27.8747 -13.6679
24 C8x C 27.8939 -15.0678
25 N5x N 29.1158 -15.7511
26 O1a O 29.0584 -11.5500
BOND 28
1 2 1 1 #Up
2 2 3 1
3 2 4 1
4 3 5 1
5 4 6 1
6 4 7 1 #Down
7 6 8 1 #Down
8 5 6 1
9 5 9 1 #Up
10 9 10 1
11 10 11 1
12 11 12 1
13 12 13 1
14 13 14 1
15 14 15 1
16 13 16 1 #Up
17 14 17 2
18 1 18 1
19 18 19 2
20 19 20 1
21 20 21 2
22 1 21 1
23 20 22 1
24 22 23 2
25 23 24 1
26 24 25 2
27 21 25 1
28 22 26 1
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