ATOM 42
1 C1y C 31.7783 -20.2292
2 C1y C 32.2683 -18.8992
3 C1x C 33.6683 -18.8992
4 C1z C 34.0882 -20.2292
5 O2x O 32.9683 -20.9992
6 C1y C 35.4182 -20.2292
7 C1x C 36.1882 -18.9692
8 C1x C 37.5881 -18.9692
9 C1z C 38.2881 -20.2292
10 C1y C 37.5881 -21.4191
11 O2x O 36.1882 -21.4191
12 C1b C 34.7882 -19.0392
13 C1a C 38.2181 -22.6091
14 C1b C 39.2680 -19.2492
15 O1a O 39.2680 -21.2091
16 C1a C 40.5980 -19.5992
17 C1a C 34.0882 -17.8493
18 C1c C 30.5184 -19.5292
19 C5a C 29.3284 -20.2292
20 C1b C 30.5184 -17.9193
21 C1c C 28.1385 -19.5292
22 O5a O 29.3284 -21.6291
23 C1c C 26.9485 -20.2292
24 C1a C 28.1385 -18.1293
25 C1c C 25.7586 -19.5292
26 O1a O 26.9485 -21.6291
27 C1b C 24.5686 -20.2292
28 C1a C 25.7586 -18.1293
29 C1b C 23.3787 -19.5292
30 C8y C 22.1887 -20.2292
31 C8y C 20.9988 -19.5292
32 C8y C 19.8088 -20.2292
33 C8y C 19.8088 -21.6291
34 C8x C 20.9988 -22.3291
35 C8x C 22.1887 -21.6291
36 C6a C 20.9988 -18.1293
37 O1a O 18.5489 -19.5292
38 C1a C 18.5489 -22.3291
39 O6a O 19.8088 -17.4293
40 O6a O 22.2587 -17.4293
41 C1a C 32.2683 -17.4992
42 C1a C 29.6575 -16.7302
BOND 44
1 2 3 1
2 3 4 1
3 4 5 1
4 1 5 1
5 4 6 1
6 6 7 1
7 7 8 1
8 8 9 1
9 9 10 1
10 10 11 1
11 6 11 1
12 1 2 1
13 4 12 1 #Down
14 10 13 1 #Down
15 9 14 1 #Down
16 9 15 1 #Up
17 14 16 1
18 12 17 1
19 1 18 1
20 18 19 1
21 18 20 1 #Down
22 19 21 1
23 19 22 2
24 21 23 1
25 21 24 1 #Down
26 23 25 1
27 23 26 1 #Up
28 25 27 1
29 25 28 1 #Up
30 27 29 1
31 29 30 1
32 30 31 2
33 31 32 1
34 32 33 2
35 33 34 1
36 34 35 2
37 30 35 1
38 31 36 1
39 32 37 1
40 33 38 1
41 36 39 1
42 36 40 2
43 2 41 1 #Up
44 20 42 1
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