ATOM 29
1 C1y C 25.9051 -19.9028
2 C5x C 27.0803 -20.5927
3 O7x O 25.9051 -18.5524
4 C1x C 24.7943 -21.1014
5 C2y C 28.2612 -19.9262
6 O5x O 27.0569 -19.2189
7 C7x C 24.7124 -17.8682
8 C1x C 25.8232 -22.2942
9 C1x C 28.2612 -18.5581
10 C2x C 29.2902 -21.1014
11 C2y C 24.7124 -16.5001
12 O6a O 23.5372 -18.5581
13 N1y N 27.0978 -21.6509
14 O7x O 29.4481 -17.8799
15 C1x C 28.3373 -22.2942
16 C2x C 25.9051 -15.8162
17 C2b C 23.5372 -15.8162
18 C1a C 27.0861 -23.0366
19 C7x C 29.4540 -16.5061
20 C1y C 27.0978 -16.5001
21 C2a C 22.3504 -16.5001
22 C1z C 28.2729 -15.8219
23 O6a O 30.6408 -15.8162
24 C1a C 27.0920 -17.5182
25 O7a O 28.6354 -14.4949
26 C1a C 27.5772 -14.3493
27 C7a C 29.8282 -13.8050
28 C1a C 29.8282 -12.4252
29 O6a O 31.0208 -14.4949
BOND 30
1 1 2 1
2 1 3 1 #Up
3 1 4 1
4 2 5 1
5 2 6 2
6 3 7 1
7 4 8 1
8 5 9 1
9 5 10 2
10 7 11 1
11 7 12 2
12 8 13 1
13 9 14 1
14 10 15 1
15 11 16 2
16 11 17 1
17 13 18 1
18 14 19 1
19 16 20 1
20 17 21 2
21 19 22 1
22 19 23 2
23 20 24 1 #Down
24 22 25 1 #Down
25 22 26 1 #Up
26 25 27 1
27 27 28 1
28 27 29 2
29 13 15 1
30 20 22 1
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