ATOM 48
1 C2y C 32.4739 -20.2025
2 C2y C 32.4739 -21.5372
3 C5x C 33.6313 -22.2009
4 C2y C 34.7814 -21.5372
5 C2y C 34.7814 -20.2025
6 C1z C 33.6313 -19.5387
7 O5x O 33.6330 -23.5286
8 C5a C 35.9293 -22.2000
9 C1b C 37.0831 -21.5353
10 C1b C 38.2381 -22.1982
11 C1a C 39.3919 -21.5335
12 O5a O 35.9303 -23.5276
13 O1a O 35.9293 -19.5395
14 O1a O 31.3199 -19.5380
15 C1a C 32.5454 -18.1900
16 C1a C 34.5704 -18.1215
17 C1b C 30.8327 -22.3922
18 C8y C 26.8387 -20.1883
19 C8y C 26.8387 -21.5230
20 C8y C 27.9961 -22.1868
21 C8y C 29.1462 -21.5230
22 C8y C 29.1462 -20.1883
23 C8y C 27.9961 -19.5246
24 C5a C 27.9978 -18.1969
25 O5a O 26.8443 -17.5246
26 C1b C 29.1531 -17.5277
27 C1b C 29.1548 -16.2001
28 C1a C 30.3102 -15.5378
29 O1a O 30.3012 -19.5255
30 O1a O 25.6917 -19.5240
31 O1a O 27.9978 -23.5215
32 C1b C 25.2468 -22.4629
33 C2y C 21.2671 -20.1742
34 C2y C 21.2671 -21.5089
35 C5x C 22.4244 -22.1728
36 C2y C 23.5745 -21.5089
37 C2y C 23.5745 -20.1742
38 C1z C 22.4244 -19.5104
39 O5x O 22.4261 -23.5074
40 C5a C 20.1200 -22.1733
41 C1b C 18.9653 -21.5101
42 O5a O 20.1209 -23.5079
43 C1b C 17.8114 -22.1746
44 C1a C 16.6565 -21.5114
45 O1a O 20.1200 -19.5099
46 O1a O 24.7295 -19.5114
47 C1a C 21.4021 -18.2959
48 C1a C 23.2930 -18.2274
BOND 50
1 23 24 1
2 8 12 2
3 24 25 2
4 6 1 1
5 24 26 1
6 5 13 1
7 26 27 1
8 27 28 1
9 1 14 1
10 22 29 1
11 3 7 2
12 18 30 1
13 6 15 1
14 20 31 1
15 1 2 2
16 19 32 1
17 6 16 1
18 4 8 1
19 2 17 1
20 2 3 1
21 8 9 1
22 3 4 1
23 33 34 2
24 34 35 1
25 35 36 1
26 36 37 2
27 37 38 1
28 38 33 1
29 9 10 1
30 35 39 2
31 4 5 2
32 34 40 1
33 10 11 1
34 40 41 1
35 18 19 2
36 40 42 2
37 19 20 1
38 41 43 1
39 20 21 2
40 43 44 1
41 21 22 1
42 33 45 1
43 22 23 2
44 37 46 1
45 23 18 1
46 38 47 1
47 5 6 1
48 38 48 1
49 36 32 1
50 21 17 1
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