ATOM 60
1 C8y C 22.6708 -13.7890
2 C8y C 21.6733 -14.7673
3 C8y C 23.9128 -14.4456
4 C1b C 22.6966 -12.3927
5 C8y C 22.2975 -16.0286
6 C1b C 20.2704 -14.7545
7 C1x C 25.1871 -13.9628
8 N4x N 23.6812 -15.8227
9 C1b C 21.4866 -11.6719
10 C1x C 21.6348 -17.3221
11 C6a C 19.5754 -13.5382
12 C8y C 26.4291 -14.4840
13 C6a C 21.5189 -10.2754
14 C8y C 22.2975 -18.5964
15 O6a O 18.1725 -13.5382
16 O6a O 20.2833 -12.3283
17 C8y C 27.6391 -13.7698
18 N4x N 26.7251 -15.8548
19 O6a O 20.3219 -9.5481
20 O6a O 22.7481 -9.5996
21 C8y C 21.6669 -19.8513
22 N4x N 23.6877 -18.8088
23 C8y C 28.6752 -14.7030
24 C1b C 27.6327 -12.3669
25 C8y C 28.1153 -15.9899
26 C8y C 22.6645 -20.8296
27 C1b C 20.2704 -19.8707
28 C8y C 23.9128 -20.1925
29 C1b C 30.0716 -14.6964
30 C6a C 28.8424 -11.6654
31 C1x C 28.6429 -17.2837
32 C1b C 22.6516 -22.2260
33 C1b C 19.5946 -21.0998
34 C1x C 25.1871 -20.6622
35 C1b C 30.7731 -13.4802
36 O6a O 28.8361 -10.2560
37 O6a O 30.0523 -12.3669
38 C8y C 28.0830 -18.5772
39 C6a C 21.4288 -22.9210
40 C6a C 18.1917 -21.0427
41 C8y C 26.4420 -20.1344
42 C6a C 32.1697 -13.4802
43 C8y C 28.6816 -19.8449
44 N4x N 26.6930 -18.7573
45 O6a O 21.4224 -24.3304
46 O6a O 20.2254 -22.2002
47 O6a O 17.5161 -22.3419
48 O6a O 17.4838 -19.9091
49 C8y C 27.6712 -20.8038
50 O6a O 32.8647 -12.2574
51 O6a O 32.8647 -14.6901
52 C1b C 30.0144 -19.8007
53 C1b C 27.8065 -22.1939
54 C6a C 30.7668 -21.0933
55 C1b C 29.0871 -22.7730
56 O6a O 32.1760 -21.0362
57 O6a O 30.0395 -22.2969
58 C6a C 29.2857 -24.1695
59 O6a O 30.4963 -24.7423
60 O6a O 28.0702 -24.9675
BOND 64
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 2
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 1
9 5 10 1
10 6 11 1
11 7 12 1
12 9 13 1
13 10 14 1
14 11 15 1
15 11 16 2
16 12 17 2
17 12 18 1
18 13 19 1
19 13 20 2
20 14 21 2
21 14 22 1
22 17 23 1
23 17 24 1
24 18 25 1
25 21 26 1
26 21 27 1
27 22 28 1
28 23 29 1
29 24 30 1
30 25 31 1
31 26 32 1
32 27 33 1
33 28 34 1
34 29 35 1
35 30 36 1
36 30 37 2
37 31 38 1
38 32 39 1
39 33 40 1
40 34 41 1
41 35 42 1
42 38 43 2
43 38 44 1
44 39 45 1
45 39 46 2
46 40 47 1
47 40 48 2
48 41 49 2
49 42 50 1
50 42 51 2
51 43 52 1
52 49 53 1
53 52 54 1
54 53 55 1
55 54 56 1
56 54 57 2
57 55 58 1
58 58 59 1
59 58 60 2
60 5 8 1
61 23 25 2
62 26 28 2
63 41 44 1
64 43 49 1
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