ATOM 36
1 C1y C 28.3661 -18.0408
2 C1y C 28.3661 -19.4415
3 C1z C 29.5729 -20.1384
4 O2x O 30.7870 -19.4415
5 C8y C 29.5729 -17.3368
6 C8y C 30.7833 -18.0470
7 N4x N 30.7980 -15.2458
8 C8y C 29.5104 -15.9362
9 C8y C 32.0082 -15.9489
10 C8y C 31.9977 -17.3434
11 C8x C 33.2012 -18.0531
12 C8x C 34.4150 -17.3615
13 C8x C 34.4254 -15.9670
14 C8x C 33.2220 -15.2642
15 C1y C 26.9629 -19.4343
16 C1y C 26.9653 -18.0408
17 O2x O 25.6367 -19.8605
18 C8y C 24.8169 -18.5998
19 C8y C 25.6492 -17.5347
20 C8y C 24.9318 -16.1756
21 N5x N 23.4144 -18.5926
22 C8y C 22.8439 -17.3035
23 C8y C 23.6735 -16.1720
24 C8x C 22.9683 -14.7407
25 C8x C 21.5665 -14.7982
26 C8y C 20.8700 -15.9999
27 C8y C 21.5121 -17.2910
28 O2a O 19.4831 -16.0609
29 O2a O 20.6093 -18.2730
30 O5x O 28.3661 -15.2394
31 O2a O 25.8884 -15.1760
32 C1a C 30.4222 -21.4808
33 C1a C 29.0636 -21.4898
34 C1a C 25.3132 -13.9065
35 C1a C 21.1632 -19.5518
36 C1a C 18.2192 -14.7863
BOND 42
1 7 8 1
2 8 5 1
3 18 19 1
4 19 20 2
5 20 23 1
6 22 21 1
7 21 18 2
8 2 3 1
9 3 4 1
10 4 6 1
11 5 1 1
12 16 1 1
13 2 15 1
14 22 23 2
15 23 24 1
16 24 25 2
17 25 26 1
18 26 27 2
19 27 22 1
20 9 10 2
21 26 28 1
22 10 11 1
23 11 12 2
24 27 29 1
25 12 13 1
26 13 14 2
27 8 30 2
28 14 9 1
29 20 31 1
30 1 2 1
31 5 6 2
32 15 16 1
33 16 19 1
34 18 17 1
35 3 32 1
36 17 15 1
37 3 33 1
38 31 34 1
39 6 10 1
40 29 35 1
41 9 7 1
42 28 36 1
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