ATOM 39
1 C1b C 26.8317 -22.5507
2 C8y C 28.5091 -21.5794
3 C8y C 29.6908 -22.2603
4 C8y C 28.5032 -20.2174
5 C8x C 30.8726 -21.5734
6 O1a O 29.6908 -23.6223
7 C8y C 29.6851 -19.5364
8 O1a O 27.3214 -19.5364
9 C8y C 30.8666 -20.2116
10 C5a C 29.6851 -18.1745
11 O2a O 32.0472 -19.5307
12 O5a O 28.4974 -17.4878
13 C2y C 25.1404 -21.5794
14 C2y C 25.1404 -20.2116
15 C5x C 23.9656 -22.2661
16 C1z C 23.9656 -19.5364
17 C2y C 22.7827 -21.5794
18 O5x O 23.9715 -23.6280
19 C2y C 22.7827 -20.2116
20 C5a C 21.5950 -22.2661
21 O1a O 21.5950 -19.5307
22 O5a O 21.5950 -23.6280
23 C1c C 20.4204 -21.5794
24 O1a O 26.3162 -19.5305
25 C1a C 19.2234 -22.2664
26 C1a C 20.4270 -20.4735
27 C1a C 23.2655 -18.3435
28 C1a C 24.6513 -18.3435
29 C8y C 30.8841 -17.4830
30 C8x C 30.8817 -16.1026
31 C8x C 32.0809 -15.4112
32 C8x C 33.2854 -16.1056
33 C8x C 33.3535 -17.4915
34 C8x C 32.0774 -18.1828
35 C1b C 33.2489 -20.2242
36 C2b C 34.4439 -19.5314
37 C2c C 35.6388 -20.2242
38 C1a C 35.6372 -21.6101
39 C1a C 36.8379 -19.5327
BOND 41
1 15 17 1
2 15 18 2
3 16 19 1
4 17 20 1
5 19 21 1
6 20 22 2
7 20 23 1
8 17 19 2
9 7 9 2
10 14 24 1
11 13 1 1
12 2 1 1
13 23 25 1
14 23 26 1
15 2 3 1
16 16 27 1
17 2 4 2
18 16 28 1
19 3 5 2
20 10 29 1
21 3 6 1
22 4 7 1
23 4 8 1
24 5 9 1
25 7 10 1
26 29 30 2
27 30 31 1
28 31 32 2
29 32 33 1
30 33 34 2
31 34 29 1
32 9 11 1
33 11 35 1
34 10 12 2
35 35 36 1
36 13 14 2
37 36 37 2
38 13 15 1
39 37 38 1
40 14 16 1
41 37 39 1
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