ATOM 48
1 C8y C 27.3071 -13.8119
2 C8y C 28.4891 -14.4954
3 C1y C 26.1323 -14.4896
4 C8y C 27.3131 -12.4559
5 C8y C 29.6697 -13.8119
6 O2x O 30.7392 -15.8340
7 C1x C 26.1263 -15.8399
8 N1y N 24.9574 -13.8002
9 C8x C 28.4891 -11.7712
10 C1x C 26.1440 -11.7654
11 C8y C 29.6697 -12.4559
12 O2a O 30.8446 -14.4954
13 C8y C 30.7566 -18.2903
14 C8y C 24.9516 -16.5186
15 C1x C 24.9868 -12.4559
16 C1a C 23.7827 -14.4603
17 O2a O 30.8446 -11.7712
18 C1a C 32.0020 -13.8119
19 C8y C 30.7450 -19.6407
20 C8y C 29.4709 -17.6641
21 C8x C 24.9516 -17.8689
22 C8x C 23.7827 -15.8223
23 C1a C 32.0137 -12.4441
24 C8y C 29.6812 -20.3766
25 C1x C 31.9551 -20.2361
26 C8y C 28.4011 -18.4002
27 O2a O 29.4647 -16.3138
28 C8y C 23.7710 -18.5465
29 C8x C 22.6019 -16.5069
30 C1y C 29.6814 -21.7327
31 C8x C 28.4014 -19.7622
32 C1x C 32.0137 -21.5864
33 O2a O 27.1269 -17.7870
34 C1a C 28.1906 -15.6994
35 C8y C 22.5960 -17.8630
36 O2x O 23.7651 -19.9085
37 C1x C 28.5417 -22.4759
38 N1y N 30.8972 -22.3413
39 O2a O 21.4271 -18.5290
40 C8y C 25.0216 -20.5580
41 C8y C 27.3305 -21.8615
42 C1a C 30.9732 -23.6918
43 C8x C 26.1148 -19.8501
44 C8x C 24.9808 -21.9200
45 C8x C 27.3071 -20.4995
46 C8x C 26.1732 -22.5624
47 C1a C 26.0664 -18.7685
48 C1a C 20.2226 -17.8245
BOND 54
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 2
5 2 6 1
6 3 7 1 #Down
7 3 8 1
8 4 9 1
9 4 10 1
10 5 11 1
11 5 12 1
12 6 13 1
13 7 14 1
14 8 15 1
15 8 16 1
16 11 17 1
17 12 18 1
18 13 19 1
19 13 20 2
20 14 21 1
21 14 22 2
22 17 23 1
23 19 24 2
24 19 25 1
25 20 26 1
26 20 27 1
27 21 28 2
28 22 29 1
29 24 30 1
30 24 31 1
31 25 32 1
32 26 33 1
33 27 34 1
34 28 35 1
35 28 36 1
36 30 37 1 #Up
37 30 38 1
38 35 39 1
39 36 40 1
40 37 41 1
41 38 42 1
42 40 43 2
43 40 44 1
44 41 45 2
45 41 46 1
46 9 11 2
47 10 15 1
48 26 31 2
49 29 35 2
50 32 38 1
51 43 45 1
52 44 46 2
53 33 47 1
54 39 48 1
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