ATOM 26
1 C1y C 26.6772 -19.5933
2 C1y C 26.6772 -20.9979
3 C1x C 27.8712 -21.7003
4 C1y C 29.1354 -20.9979
5 C1y C 29.1354 -19.5933
6 O2x O 27.8712 -18.8910
7 C1a C 25.4833 -18.8910
8 N1a N 30.3293 -21.7003
9 O2a O 30.3293 -18.8910
10 N1b N 25.4833 -21.7003
11 C2c C 24.2893 -20.9979
12 C6a C 23.0954 -21.7003
13 O6a O 21.9014 -20.9979
14 O6a O 23.0954 -23.1049
15 N2a N 24.2893 -19.5933
16 C1y C 29.1354 -15.3793
17 C1y C 29.1354 -16.7840
18 C1y C 30.3293 -17.4863
19 C1y C 31.5935 -16.7840
20 C1y C 31.5935 -15.3793
21 C1y C 30.3293 -14.6770
22 O1a O 30.3293 -13.2723
23 O1a O 27.9414 -14.6770
24 O1a O 32.7875 -14.6770
25 O1a O 27.9414 -17.4863
26 O1a O 32.7875 -17.4863
BOND 27
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 1 7 1 #Up
8 4 8 1 #Up
9 5 9 1 #Down
10 2 10 1 #Down
11 10 11 1
12 11 12 1
13 12 13 1
14 12 14 2
15 11 15 2
16 16 17 1
17 17 18 1
18 18 19 1
19 19 20 1
20 20 21 1
21 16 21 1
22 21 22 1 #Down
23 16 23 1 #Up
24 20 24 1 #Down
25 18 9 1 #Down
26 17 25 1 #Up
27 19 26 1 #Up
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