ATOM 26
1 C1y C 25.3361 -18.4083
2 C1y C 26.5457 -17.7128
3 O2a O 25.3361 -19.8048
4 C1y C 24.1265 -17.7188
5 C1y C 26.5457 -16.3163
6 N1b N 27.7553 -18.4083
7 C1y C 24.1265 -20.5120
8 C1y C 24.1207 -16.3163
9 O1a O 22.9168 -18.4200
10 O2x O 25.3303 -15.6150
11 O1a O 27.7553 -15.6093
12 O2x O 22.8994 -19.8048
13 C1y C 24.1265 -21.9145
14 C1b C 22.9111 -15.6210
15 C1y C 21.6955 -20.5120
16 C1y C 22.8994 -22.6157
17 O1a O 25.3361 -22.6157
18 O1a O 21.7014 -16.3222
19 C1y C 21.6955 -21.9145
20 C1b C 20.4861 -19.8048
21 O1a O 22.9111 -24.0180
22 O1a O 20.4861 -22.6157
23 O1a O 19.4108 -20.7166
24 C5a C 29.0024 -17.7100
25 C1a C 30.2149 -18.4100
26 O5a O 29.0116 -16.5904
BOND 27
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 #Down
9 5 10 1
10 5 11 1 #Either
11 7 12 1
12 7 13 1
13 8 14 1 #Up
14 12 15 1
15 13 16 1
16 13 17 1 #Down
17 14 18 1
18 15 19 1
19 15 20 1 #Up
20 16 21 1 #Up
21 19 22 1 #Up
22 20 23 1
23 8 10 1
24 16 19 1
25 6 24 1
26 24 25 1
27 24 26 2
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