ATOM 27
1 C1y C 19.2130 -15.4873
2 C1y C 20.4330 -14.7784
3 O2a O 19.2067 -16.8733
4 C1y C 18.0122 -14.7784
5 C1y C 20.4330 -13.3730
6 N1b N 21.6338 -15.4681
7 C1y C 18.0059 -17.5696
8 C1y C 18.0122 -13.3730
9 O1a O 16.8050 -15.4681
10 O2x O 19.2130 -12.6769
11 O2a O 21.6338 -12.6769
12 O2x O 16.7923 -16.8797
13 C1y C 18.0059 -18.9747
14 C1b C 16.8050 -12.6769
15 R R 21.6275 -11.2846
16 C1y C 15.5852 -17.5696
17 C1y C 16.7923 -19.6901
18 O1a O 19.2130 -19.6710
19 C1y C 15.5852 -18.9747
20 C1b C 14.3844 -16.8797
21 O1a O 16.7860 -21.0761
22 O1a O 14.3780 -19.6645
23 O1a O 13.1568 -17.5917
24 O1a O 15.5675 -13.3924
25 C5a C 22.8687 -14.7308
26 C1a C 24.0889 -15.4352
27 O5a O 22.8687 -13.3218
BOND 28
1 1 2 1
2 1 3 1 #Up
3 1 4 1
4 2 5 1
5 2 6 1 #Down
6 7 3 1 #Up
7 4 8 1
8 4 9 1 #Up
9 5 10 1
10 5 11 1 #Up
11 7 12 1
12 7 13 1
13 8 14 1 #Up
14 11 15 1
15 12 16 1
16 13 17 1
17 13 18 1 #Down
18 16 19 1
19 16 20 1 #Up
20 17 21 1 #Up
21 19 22 1 #Up
22 8 10 1
23 17 19 1
24 20 23 1
25 14 24 1
26 6 25 1
27 25 26 1
28 25 27 2
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