ATOM 26
1 C1x C 34.6075 -7.5803
2 C5x C 34.6075 -8.9817
3 N1y N 36.0088 -8.9817
4 C1y C 36.0088 -7.5803
5 C1x C 37.3415 -9.4145
6 C1y C 38.1651 -8.2809
7 O2x O 37.3415 -7.1474
8 O5x O 33.6169 -9.9724
9 C1c C 39.3942 -7.5803
10 C1c C 40.6078 -8.2809
11 C6a C 41.8395 -7.5694
12 O6a O 43.0461 -8.2659
13 N1b N 40.6079 -9.6826
14 O6a O 41.8390 -6.1790
15 C5a C 41.8038 -10.3735
16 O5a O 42.9838 -9.6925
17 C1c C 41.8041 -11.7960
18 N1a N 42.9926 -12.4824
19 C1b C 40.5640 -12.5125
20 O1a O 39.3979 -6.1874
21 C1b C 39.3176 -11.8300
22 C1b C 38.1051 -12.5300
23 N1b N 36.8927 -11.8300
24 C5a C 35.6803 -12.5300
25 C1a C 34.4827 -11.8385
26 O5a O 35.6802 -13.9299
BOND 27
1 1 2 1
2 2 3 1
3 3 4 1
4 1 4 1
5 3 5 1
6 5 6 1
7 6 7 1
8 4 7 1
9 2 8 2
10 6 9 1 #Up
11 9 10 1
12 10 11 1
13 11 12 1
14 10 13 1 #Up
15 11 14 2
16 13 15 1
17 15 16 2
18 15 17 1
19 17 18 1 #Up
20 17 19 1
21 9 20 1
22 19 21 1
23 21 22 1
24 22 23 1
25 23 24 1
26 24 25 1
27 24 26 2
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