ATOM 74
1 C1y C 38.6869 -12.2369
2 O2x O 38.6869 -13.6033
3 C1y C 39.8827 -11.5509
4 C1y C 39.8653 -14.3023
5 C1y C 41.0800 -12.2428
6 O1a O 39.8827 -10.1787
7 C1y C 41.0671 -13.6219
8 C1b C 39.8466 -15.6684
9 O1a O 42.2573 -11.5626
10 O1a O 42.2456 -14.3080
11 C1y C 21.9563 -21.8550
12 C1y C 23.1332 -21.1498
13 O2x O 21.9879 -23.2316
14 C1y C 24.3391 -21.8163
15 O1a O 23.1071 -19.7713
16 C1y C 23.1981 -23.8939
17 C1y C 24.3577 -23.1708
18 O1a O 25.5156 -21.0964
19 C1a C 23.2212 -25.2675
20 O1a O 25.5784 -23.8485
21 C1y C 14.6367 -21.4538
22 O2x O 13.4384 -20.7569
23 C1y C 14.6272 -22.8409
24 C1y C 12.2500 -21.4430
25 C1y C 13.4216 -23.5084
26 O1a O 15.8311 -23.5480
27 C1y C 12.2343 -22.8189
28 C1b C 11.0597 -20.7484
29 O1a O 13.4189 -24.8837
30 O1a O 11.0365 -23.4887
31 O1a O 11.0663 -19.3563
32 C1y C 19.5915 -19.0821
33 C1y C 19.5702 -20.4586
34 O2x O 18.4100 -18.3842
35 C1y C 18.3845 -21.1336
36 O2a O 20.7546 -21.1651
37 C1y C 17.2097 -19.0587
38 C1y C 17.2058 -20.4307
39 O1a O 18.3515 -22.5183
40 C1b C 16.0343 -18.3507
41 O2a O 15.9946 -21.0988
42 O1a O 16.0464 -16.9756
43 C1z C 27.9583 -14.2999
44 C1y C 27.9409 -15.6791
45 C1y C 29.1426 -13.6442
46 C1x C 26.7682 -13.6081
47 C1a C 27.9469 -12.9279
48 C1y C 26.7565 -16.3593
49 C1x C 30.3153 -15.6967
50 C1y C 30.3400 -14.3302
51 C1y C 29.0913 -12.2592
52 C1x C 25.5780 -14.2824
53 C1y C 25.5721 -15.6546
54 C1x C 26.7565 -17.7315
55 O2x O 31.5171 -13.6442
56 C1z C 31.5171 -12.2720
57 C1a C 28.1837 -11.2813
58 C1z C 24.3693 -16.3348
59 C2x C 25.5595 -18.3989
60 C1b C 32.7013 -11.5730
61 O1a O 31.5114 -10.8928
62 C2y C 24.3693 -17.7070
63 C1x C 23.1849 -15.6489
64 C1a C 24.3634 -14.9687
65 C1b C 33.8917 -12.2592
66 C1x C 23.1849 -18.3989
67 C1x C 21.9948 -16.3348
68 C1c C 35.0828 -11.5673
69 C1y C 21.9948 -17.7070
70 C1b C 36.2731 -12.2475
71 C1a C 35.0828 -10.1951
72 O2a O 20.8046 -18.3989
73 O2a O 37.4770 -11.5453
74 O1a O 38.6303 -16.3485
BOND 82
1 2 4 1
2 3 5 1
3 3 6 1 #Down
4 4 7 1
5 4 8 1 #Up
6 5 9 1 #Up
7 7 10 1 #Down
8 5 7 1
9 12 14 1
10 12 15 1 #Down
11 13 16 1
12 14 17 1
13 14 18 1 #Down
14 16 19 1 #Down
15 17 20 1 #Up
16 16 17 1
17 32 33 1
18 32 34 1
19 33 35 1
20 33 36 1 #Down
21 34 37 1
22 35 38 1
23 35 39 1 #Up
24 37 40 1 #Up
25 38 41 1 #Down
26 40 42 1
27 37 38 1
28 21 22 1
29 21 23 1
30 22 24 1
31 23 25 1
32 23 26 1 #Down
33 24 27 1
34 24 28 1 #Up
35 25 29 1 #Up
36 27 30 1 #Down
37 28 31 1
38 25 27 1
39 11 12 1
40 11 13 1
41 43 44 1
42 43 45 1
43 43 46 1
44 43 47 1 #Up
45 44 48 1
46 44 49 1
47 45 50 1
48 45 51 1
49 46 52 1
50 48 53 1
51 48 54 1
52 50 55 1
53 51 56 1
54 51 57 1 #Down
55 53 58 1
56 54 59 1
57 56 60 1
58 56 61 1 #Down
59 58 62 1
60 58 63 1
61 58 64 1 #Up
62 60 65 1
63 62 66 1
64 63 67 1
65 65 68 1
66 66 69 1
67 68 70 1
68 68 71 1 #Up
69 69 72 1 #Up
70 49 50 1
71 52 53 1
72 55 56 1
73 59 62 2
74 67 69 1
75 32 72 1 #Up
76 21 41 1 #Up
77 11 36 1 #Up
78 1 2 1
79 70 73 1
80 1 73 1 #Up
81 1 3 1
82 8 74 1
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