ATOM 71
1 C2y C 27.4646 -20.2006
2 C2y C 27.4089 -18.8116
3 C2y C 28.5973 -20.9165
4 C5x C 26.1775 -20.8878
5 C2y C 28.6260 -18.1244
6 C5x C 26.2132 -18.1028
7 C5x C 29.8144 -20.2220
8 C2y C 28.6602 -22.3197
9 C8y C 24.9819 -20.1790
10 O5x O 26.1632 -22.2911
11 C5x C 29.8360 -18.8260
12 C2y C 28.6260 -16.7211
13 C8y C 24.9962 -18.7830
14 O5x O 26.1578 -16.6997
15 C8y C 31.0314 -20.9308
16 O5x O 28.5902 -19.5134
17 C5x C 29.8000 -23.0286
18 O1a O 27.3732 -23.0142
19 C8y C 23.7721 -20.8807
20 C8y C 31.0530 -18.1244
21 O5x O 31.0530 -19.5277
22 C5x C 29.8430 -16.0196
23 O1a O 27.4162 -16.0196
24 C8x C 23.7864 -18.0814
25 C8y C 31.0171 -22.3268
26 C8x C 32.2485 -20.2436
27 O5x O 29.8000 -24.4316
28 C8y C 22.5621 -20.1719
29 C2x C 23.7721 -22.2838
30 C8y C 31.0530 -16.7284
31 C8x C 32.2628 -18.8260
32 O5x O 29.8430 -14.6163
33 C8x C 22.5693 -18.7687
34 C8y C 32.2200 -23.0286
35 C8x C 33.4514 -20.9524
36 O2x O 21.3380 -20.8735
37 C2x C 22.5621 -22.9783
38 C8y C 32.2701 -16.0267
39 C8x C 33.4728 -18.1315
40 C8y C 33.4371 -22.3555
41 C2x C 32.1984 -24.4316
42 C1z C 21.3380 -22.2838
43 C8y C 33.4657 -16.7355
44 C2x C 32.2771 -14.6306
45 O2x O 34.6398 -23.0643
46 C2x C 33.4012 -25.1477
47 C1b C 20.1209 -22.9783
48 C1a C 20.1209 -21.5752
49 O2x O 34.7528 -16.0482
50 C2x C 33.4871 -13.9505
51 C1z C 34.6182 -24.4603
52 C1b C 18.9039 -22.2911
53 C1z C 34.6898 -14.6522
54 C1b C 35.8282 -25.1834
55 C1a C 34.6039 -25.8636
56 C2b C 17.7009 -22.9856
57 C1b C 35.9142 -13.9648
58 C1a C 34.6828 -13.2419
59 C1b C 37.0237 -24.4746
60 C2c C 16.4839 -22.2982
61 C1b C 37.1169 -14.6666
62 C2b C 38.2409 -25.1834
63 C1a C 15.2741 -22.9926
64 C1a C 16.4839 -20.8878
65 C2b C 38.3339 -13.9791
66 C2c C 39.4507 -24.4746
67 C2c C 39.5367 -14.6879
68 C1a C 40.6678 -25.1834
69 C1a C 39.4507 -23.0715
70 C1a C 40.7610 -14.0007
71 C1a C 39.5223 -16.0912
BOND 79
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 3 8 2
8 4 9 1
9 4 10 2
10 5 11 1
11 5 12 2
12 6 13 1
13 6 14 2
14 7 15 1
15 7 16 2
16 8 17 1
17 8 18 1
18 9 19 1
19 11 20 1
20 11 21 2
21 12 22 1
22 12 23 1
23 13 24 1
24 15 25 2
25 15 26 1
26 17 27 2
27 19 28 2
28 19 29 1
29 20 30 2
30 20 31 1
31 22 32 2
32 24 33 2
33 25 34 1
34 26 35 2
35 28 36 1
36 29 37 2
37 30 38 1
38 31 39 2
39 34 40 2
40 34 41 1
41 36 42 1
42 38 43 2
43 38 44 1
44 40 45 1
45 41 46 2
46 42 47 1 #Up
47 42 48 1 #Down
48 43 49 1
49 44 50 2
50 45 51 1
51 47 52 1
52 49 53 1
53 51 54 1 #Down
54 51 55 1 #Up
55 52 56 1
56 53 57 1 #Up
57 53 58 1 #Down
58 54 59 1
59 56 60 2
60 57 61 1
61 59 62 1
62 60 63 1
63 60 64 1
64 61 65 1
65 62 66 2
66 65 67 2
67 66 68 1
68 66 69 1
69 67 70 1
70 67 71 1
71 9 13 2
72 17 25 1
73 22 30 1
74 28 33 1
75 35 40 1
76 37 42 1
77 39 43 1
78 46 51 1
79 50 53 1
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