ATOM 48
1 C8y C 32.5361 -20.2084
2 C8y C 32.5361 -21.5735
3 C8y C 33.7246 -22.2631
4 C8y C 34.8989 -21.5735
5 C8y C 34.8989 -20.2084
6 C8y C 33.7246 -19.5257
7 O1a O 33.7263 -23.6284
8 C1a C 33.7263 -18.1606
9 O1a O 31.3508 -19.5250
10 O2a O 36.0850 -19.5266
11 C5a C 36.0850 -22.2622
12 C1a C 37.2630 -20.2101
13 C1b C 30.9146 -22.4678
14 C1b C 37.2630 -21.5788
15 C1b C 38.4491 -22.2604
16 C1a C 39.6341 -21.5769
17 O5a O 36.0160 -23.6274
18 C1b C 25.1004 -22.4463
19 C8y C 26.7560 -21.4936
20 C8y C 27.9039 -22.1645
21 C8y C 26.7501 -20.1594
22 C8y C 29.0732 -21.4877
23 O1a O 27.9039 -23.4989
24 C8y C 27.8982 -19.4886
25 O1a O 25.5881 -19.4886
26 C8y C 29.0673 -20.1537
27 C5a C 27.8982 -18.1542
28 O1a O 30.2280 -19.4899
29 O5a O 26.7443 -17.4776
30 C8y C 23.4525 -21.4936
31 C8y C 23.4525 -20.1537
32 C8y C 22.2904 -22.1702
33 C8y C 22.2904 -19.4886
34 C8y C 21.1409 -21.4936
35 O1a O 22.2263 -23.5046
36 C8y C 21.1409 -20.1537
37 C1a C 22.2263 -18.1484
38 O2a O 19.9730 -19.4899
39 O1a O 24.6086 -19.4897
40 C1b C 29.0855 -17.4747
41 C5a C 19.9531 -22.1721
42 C1b C 18.7769 -21.4854
43 O5a O 19.9482 -23.5374
44 C1b C 17.5890 -22.1638
45 C1a C 16.4057 -21.4771
46 C1b C 29.0890 -16.1094
47 C1a C 30.2765 -15.4300
48 C1a C 18.7618 -20.2004
BOND 50
1 14 15 1
2 1 2 2
3 15 16 1
4 6 8 1
5 11 17 2
6 2 3 1
7 1 9 1
8 3 4 2
9 5 10 1
10 19 18 1
11 19 20 1
12 19 21 2
13 20 22 2
14 20 23 1
15 21 24 1
16 21 25 1
17 22 26 1
18 22 13 1
19 24 27 1
20 26 28 1
21 30 31 1
22 30 32 2
23 31 33 2
24 32 34 1
25 32 35 1
26 33 36 1
27 33 37 1
28 36 38 1
29 34 36 2
30 27 29 2
31 31 39 1
32 30 18 1
33 24 26 2
34 4 5 1
35 27 40 1
36 4 11 1
37 34 41 1
38 5 6 2
39 10 12 1
40 41 42 1
41 6 1 1
42 41 43 2
43 2 13 1
44 42 44 1
45 44 45 1
46 11 14 1
47 40 46 1
48 3 7 1
49 46 47 1
50 38 48 1
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