ATOM 23
1 C1z C 25.6378 -16.4901
2 C8y C 25.6321 -15.1734
3 C1y C 26.7621 -17.1572
4 C1y C 24.4904 -17.1396
5 C1x C 26.7621 -15.8171
6 C8y C 24.4904 -14.5251
7 C8y C 26.7678 -14.5251
8 C1y C 27.9037 -16.5018
9 C2x C 26.7561 -18.4668
10 O2x O 23.1796 -15.7427
11 C1y C 24.4845 -18.4494
12 C1x C 29.0408 -15.8405
13 C8y C 24.4904 -13.1969
14 C1x C 27.9095 -15.1793
15 C8x C 26.7678 -13.1969
16 N1y N 29.0525 -17.1620
17 C2x C 25.6145 -19.1165
18 O2a O 23.3299 -19.1106
19 C8x C 25.6378 -12.5427
20 O1a O 23.3416 -12.5427
21 C1a C 30.3212 -16.8144
22 C1b C 22.1659 -18.4305
23 C1a C 20.9977 -19.1035
BOND 27
1 1 3 1
2 1 4 1
3 1 5 1 #Up
4 2 6 2
5 2 7 1
6 3 8 1
7 3 9 1
8 4 10 1 #Down
9 4 11 1
10 5 12 1
11 6 13 1
12 7 14 1
13 7 15 2
14 8 16 1 #Up
15 9 17 2
16 11 18 1 #Down
17 13 19 2
18 13 20 1
19 16 21 1
20 6 10 1
21 8 14 1
22 11 17 1
23 12 16 1
24 15 19 1
25 18 22 1
26 1 2 1
27 22 23 1
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