ATOM 53
1 C8y C 13.1600 -15.1900
2 C1b C 14.3724 -14.4900
3 C5a C 15.5849 -15.1900
4 N1b N 16.7973 -14.4900
5 C1c C 18.0097 -15.1900
6 C5a C 19.2222 -14.4900
7 N1b N 20.4346 -15.1900
8 C1b C 21.6470 -14.4900
9 C1b C 22.8595 -15.1900
10 C1b C 24.0719 -14.4900
11 C1b C 25.2844 -15.1900
12 C1b C 26.4968 -14.4900
13 N1b N 27.7092 -15.1900
14 C5a C 28.9217 -14.4900
15 C1c C 30.1341 -15.1900
16 C1b C 31.3465 -14.4900
17 C1b C 32.5590 -15.1900
18 C8y C 11.8810 -14.6206
19 C8y C 10.9442 -15.6610
20 N4x N 11.6442 -16.8734
21 C8x C 13.0137 -16.5823
22 C8x C 11.4484 -13.2891
23 C8x C 10.0790 -12.9980
24 C8x C 9.1422 -14.0384
25 C8x C 9.5748 -15.3699
26 O5a O 15.5849 -16.5898
27 O5a O 19.2222 -13.0903
28 C1b C 18.0097 -16.5899
29 C5a C 19.2074 -17.2814
30 N1a N 19.2074 -18.6814
31 O5a O 20.3955 -16.5953
32 C1b C 33.7624 -14.4900
33 C1b C 34.9749 -15.1900
34 N1d N 36.1873 -14.4900 #+
35 C1b C 37.3997 -15.1900
36 C1b C 38.6122 -14.4900
37 C1b C 39.8246 -15.1900
38 N1b N 41.0370 -14.4900
39 C5a C 42.2495 -15.1900
40 C1c C 43.4924 -14.4900
41 C1b C 44.7049 -15.1900
42 C1b C 45.9173 -14.4900
43 C1b C 47.1297 -15.1900
44 N1b N 48.3422 -14.4900
45 O5a O 28.9217 -13.0900
46 O5a O 42.3120 -16.5895
47 N1a N 30.1341 -16.5896
48 N1a N 43.4999 -13.0903
49 C2c C 49.5753 -15.2022
50 N1a N 50.7815 -14.5060
51 N2a N 49.5750 -16.5899
52 C1a C 37.4573 -13.1501
53 C1a C 35.1274 -13.1501
BOND 54
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 6 7 1
7 7 8 1
8 8 9 1
9 9 10 1
10 10 11 1
11 11 12 1
12 12 13 1
13 13 14 1
14 14 15 1
15 15 16 1
16 16 17 1
17 1 18 1
18 18 19 1
19 19 20 1
20 20 21 1
21 1 21 2
22 18 22 2
23 22 23 1
24 23 24 2
25 24 25 1
26 19 25 2
27 3 26 2
28 6 27 2
29 5 28 1
30 28 29 1
31 29 30 1
32 29 31 2
33 17 32 1
34 32 33 1
35 33 34 1
36 34 35 1
37 35 36 1
38 36 37 1
39 37 38 1
40 38 39 1
41 39 40 1
42 40 41 1
43 41 42 1
44 42 43 1
45 43 44 1
46 14 45 2
47 39 46 2
48 15 47 1
49 40 48 1
50 44 49 1
51 49 50 1
52 49 51 2
53 34 52 1
54 34 53 1
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