ATOM 29
1 C1z C 18.5858 -16.0755
2 C1y C 19.7523 -15.3977
3 C1y C 18.5918 -17.4191
4 C8y C 16.2648 -16.0755
5 C1x C 17.7246 -14.9701
6 C1z C 20.9250 -16.0695
7 N1y N 19.7400 -14.0356
8 C1z C 19.7645 -18.0972
9 N1y N 17.4253 -18.0972
10 C8y C 16.2648 -17.4191
11 C8x C 15.0982 -15.4159
12 C1x C 18.4086 -13.9563
13 C1y C 20.9066 -17.4925
14 C2x C 22.1037 -15.3854
15 C1b C 22.0671 -16.7291
16 C1x C 20.9188 -13.3516
17 C7a C 20.6928 -19.0317
18 O1a O 19.2636 -19.9937
19 C1a C 16.5270 -19.4019
20 C8x C 15.0982 -18.1032
21 C8x C 13.9500 -16.0755
22 O1a O 22.0853 -18.0910
23 C2x C 22.1097 -14.0234
24 C1a C 23.2153 -16.0633
25 O7a O 20.6041 -20.4726
26 O6a O 21.9755 -19.3248
27 C8y C 13.9500 -17.4191
28 C1a C 19.4714 -21.4978
29 O1a O 12.7957 -18.0787
BOND 33
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1 #Up
5 2 6 1
6 2 7 1
7 3 8 1
8 3 9 1
9 4 10 2
10 4 11 1
11 5 12 1
12 6 13 1
13 6 14 1
14 6 15 1 #Down
15 7 16 1
16 8 17 1 #Down
17 8 18 1 #Up
18 9 19 1
19 10 20 1
20 11 21 2
21 13 22 1 #Up
22 14 23 2
23 15 24 1
24 17 25 1
25 17 26 2
26 20 27 2
27 25 28 1
28 27 29 1
29 7 12 1
30 8 13 1
31 9 10 1
32 16 23 1
33 21 27 1
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