ATOM 21
1 N4y N 29.0786 -15.5928
2 C8y C 27.7851 -15.1844
3 C1y C 28.2059 -18.0190
4 C8x C 29.8708 -14.5097
5 C8y C 27.7851 -13.8227
6 N5x N 26.6093 -15.8713
7 O2x O 27.1105 -17.2329
8 C1y C 27.7913 -19.3063
9 N5x N 29.0849 -13.4081
10 C8y C 26.6093 -13.1482
11 C8y C 25.4393 -15.1844
12 C1y C 26.0274 -18.0190
13 C1y C 26.4359 -19.3063
14 O1a O 28.5835 -20.3253
15 N5x N 25.4393 -13.8227
16 N1a N 26.6030 -11.8051
17 N1b N 24.2697 -15.8528
18 C1b C 24.7462 -17.5981
19 O1a O 25.6375 -20.3192
20 C1a C 23.1061 -15.1720
21 O1a O 23.7436 -18.4955
BOND 23
1 1 2 1
2 3 1 1 #Up
3 1 4 1
4 2 5 2
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 2
9 5 10 1
10 6 11 2
11 7 12 1
12 8 13 1
13 8 14 1 #Down
14 10 15 2
15 10 16 1
16 11 17 1
17 12 18 1 #Up
18 13 19 1 #Down
19 17 20 1
20 18 21 1
21 5 9 1
22 11 15 1
23 12 13 1
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