ATOM 28
1 C1y C 23.9681 -15.8359
2 C8y C 23.9564 -18.2346
3 C2y C 25.1147 -15.1866
4 C2y C 22.8213 -15.1866
5 C8y C 22.8038 -18.8958
6 C8x C 25.0972 -18.8958
7 C2y C 25.1147 -13.8642
8 C7a C 26.2614 -15.8359
9 C2y C 22.8213 -13.8642
10 C7a C 21.6862 -15.8359
11 C8x C 22.8038 -20.2063
12 N2b N 21.6805 -18.2346 #+
13 C8x C 25.0972 -20.2063
14 N1x N 23.9681 -13.2032
15 C1a C 26.2614 -13.2032
16 O7a O 27.3965 -15.1866
17 O6a O 26.2614 -17.1640
18 C1a C 21.6862 -13.2032
19 O7a O 20.5454 -15.1866
20 O6a O 21.6922 -17.0644
21 C8x C 23.9564 -20.8790
22 O3a O 23.1841 -17.2400
23 O3a O 19.8142 -19.4749 #-
24 C1b C 28.5314 -15.8359
25 C1a C 19.4046 -15.8359
26 C1c C 29.6664 -15.1806
27 C1a C 30.8073 -15.8301
28 C1a C 29.6605 -13.8642
BOND 29
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 2
6 3 7 2
7 3 8 1
8 4 9 2
9 4 10 1
10 5 11 2
11 5 12 1
12 6 13 1
13 7 14 1
14 7 15 1
15 8 16 1
16 8 17 2
17 9 18 1
18 10 19 1
19 10 20 2
20 11 21 1
21 12 22 2
22 12 23 1
23 16 24 1
24 19 25 1
25 24 26 1
26 26 27 1
27 26 28 1
28 9 14 1
29 13 21 2
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