ATOM 28
1 C1y C 25.6268 -19.3833
2 N1y N 25.5978 -20.7849
3 C2y C 26.8708 -18.9103
4 C1y C 24.1961 -19.0096
5 C1x C 24.2896 -21.2756
6 C1x C 26.9467 -21.1704
7 C2x C 27.7293 -20.0142
8 C1b C 26.8651 -17.5087
9 C1x C 23.4135 -20.1836
10 O7a O 24.1845 -17.5964
11 O7a O 28.0739 -16.8021
12 C7a C 29.2886 -17.5030
13 C1d C 30.5032 -16.7964
14 O6a O 29.2827 -18.9046
15 C1c C 31.7121 -17.4913
16 C7a C 22.9686 -16.9078
17 O6a O 21.7645 -17.6164
18 C2c C 22.9571 -15.5106
19 C1a C 24.1614 -14.8020
20 C2b C 21.7415 -14.8220
21 C1a C 20.5372 -15.5306
22 O1a O 31.7895 -15.9233
23 C1d C 30.5242 -15.5013
24 C1a C 31.7341 -14.8027
25 C1a C 29.3142 -14.8027
26 O1a O 30.5224 -14.1588
27 O1a O 31.7131 -18.8885
28 C1a C 32.9211 -16.7910
BOND 29
1 12 14 2
2 13 15 1
3 5 9 1
4 6 7 1
5 10 16 1
6 1 2 1
7 16 17 2
8 1 3 1
9 16 18 1
10 1 4 1
11 18 19 1
12 2 5 1
13 18 20 2
14 2 6 1
15 20 21 1
16 3 7 2
17 13 22 1 #Down
18 3 8 1
19 13 23 1
20 4 9 1
21 23 24 1
22 4 10 1 #Down
23 23 25 1
24 8 11 1
25 23 26 1
26 11 12 1
27 15 27 1 #Down
28 12 13 1
29 15 28 1
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