ATOM 40
1 C2b C 25.1963 -16.1891
2 C1c C 26.8562 -21.2852
3 C1b C 26.8491 -22.6496
4 C1c C 25.7459 -23.5548
5 C1a C 25.7340 -25.0872
6 C1a C 24.3115 -23.4876
7 C8y C 28.5473 -20.3070
8 C8y C 29.7288 -20.9949
9 C8y C 28.5413 -18.9382
10 C8y C 30.9174 -20.3010
11 O1a O 29.7288 -22.3635
12 C8y C 29.7230 -18.2574
13 O1a O 27.3458 -18.2574
14 C8y C 30.9114 -18.9324
15 C1b C 32.0931 -21.0007
16 C5a C 29.7230 -16.8888
17 O1a O 32.0988 -18.2516
18 C2b C 33.2757 -20.3127
19 C1a C 30.9114 -16.1951
20 O5a O 28.5356 -16.1951
21 C2c C 34.4643 -21.0066
22 C1a C 35.6470 -20.3187
23 C1a C 34.4584 -22.3752
24 C8y C 25.1583 -20.3070
25 C8y C 25.1583 -18.9324
26 C8y C 23.9766 -21.0007
27 C8y C 23.9766 -18.2574
28 C8y C 22.7940 -20.3070
29 O1a O 23.9826 -22.3693
30 C8y C 22.7940 -18.9324
31 C1b C 23.9826 -16.8830
32 C5a C 21.5995 -21.0007
33 O2a O 21.5995 -18.2516
34 O5a O 21.5995 -22.3693
35 C1a C 20.4110 -20.3070
36 C1a C 20.4110 -18.9324
37 O1a O 26.3408 -18.2514
38 C2c C 25.2056 -14.7966
39 C1a C 26.4154 -14.1121
40 C1a C 24.0053 -14.0956
BOND 41
1 18 21 2
2 21 22 1
3 21 23 1
4 12 14 2
5 7 2 1
6 4 5 1
7 4 6 1
8 3 4 1
9 2 3 1
10 7 8 1
11 7 9 2
12 8 10 2
13 8 11 1
14 9 12 1
15 9 13 1
16 10 14 1
17 10 15 1
18 24 25 1
19 24 26 2
20 25 27 2
21 26 28 1
22 26 29 1
23 27 30 1
24 27 31 1
25 28 32 1
26 30 33 1
27 32 34 2
28 32 35 1
29 33 36 1
30 28 30 2
31 12 16 1
32 25 37 1
33 24 2 1
34 14 17 1
35 31 1 1
36 15 18 1
37 1 38 2
38 16 19 1
39 38 39 1
40 16 20 2
41 38 40 1
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