ATOM 32
1 C1z C 22.1281 -22.9022
2 C1z C 23.4064 -22.2106
3 C1y C 20.9251 -22.1931
4 C1x C 22.1281 -24.2968
5 C1a C 21.5589 -21.5018
6 C2y C 23.3542 -20.8218
7 C1x C 24.5338 -22.9196
8 C1a C 23.3250 -23.5995
9 C1z C 19.7223 -22.8905
10 C5x C 20.9368 -20.7986
11 C1x C 20.9135 -24.9883
12 C1y C 24.5686 -20.1420
13 C2x C 22.1513 -20.1188
14 C1x C 25.7480 -22.2396
15 C1y C 19.7164 -24.2851
16 C1x C 18.5136 -22.1874
17 C1a C 19.7048 -21.4901
18 C1z C 25.7597 -20.8510
19 C1x C 24.5861 -18.7532
20 C1z C 18.5136 -24.9824
21 C1x C 17.2992 -22.8905
22 C1x C 27.0440 -20.1769
23 C1a C 26.9626 -21.5483
24 C1z C 25.8005 -18.0733
25 C1y C 17.2992 -24.2851
26 C1a C 19.0016 -26.4699
27 C1a C 17.7989 -26.1911
28 C1x C 26.9918 -18.7880
29 C1a C 25.0857 -16.8588
30 C1a C 26.4803 -16.8588
31 O1a O 16.0848 -24.9767
32 O5x O 19.7138 -20.0749
BOND 36
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 2 8 1 #Down
8 3 9 1
9 3 10 1
10 4 11 1
11 6 12 1
12 6 13 2
13 7 14 1
14 9 15 1
15 9 16 1
16 9 17 1 #Up
17 12 18 1
18 12 19 1
19 15 20 1
20 16 21 1
21 18 22 1
22 18 23 1 #Up
23 19 24 1
24 20 25 1
25 20 26 1
26 20 27 1
27 22 28 1
28 24 29 1
29 24 30 1
30 25 31 1 #Up
31 10 13 1
32 11 15 1
33 14 18 1
34 21 25 1
35 24 28 1
36 10 32 2
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