ATOM 73
1 C1y C 38.6503 -12.2373
2 O2x O 38.6503 -13.6200
3 C1y C 39.8438 -11.5429
4 C1y C 39.8438 -14.3014
5 C1y C 41.0313 -12.2373
6 O1a O 39.8438 -10.1728
7 C1y C 41.0313 -13.6200
8 C1b C 39.8379 -15.6783
9 O1a O 42.2247 -11.5615
10 O1a O 42.2189 -14.3014
11 C1y C 14.7363 -21.7735
12 C1y C 14.7878 -23.1571
13 O2x O 13.5447 -21.0717
14 C1y C 13.5322 -23.8317
15 O1a O 15.9173 -23.8611
16 C1y C 12.3491 -21.7520
17 C1y C 12.3321 -23.1265
18 O1a O 13.5139 -25.2153
19 C1a C 11.1744 -21.0539
20 O1a O 11.1387 -23.7989
21 C1y C 21.9062 -21.8747
22 C1y C 23.1011 -21.1926
23 O2x O 21.9104 -23.2432
24 C1y C 24.2936 -21.8679
25 O1a O 23.0926 -19.8050
26 C1y C 23.1072 -23.9376
27 C1y C 24.2794 -23.2535
28 O1a O 25.4806 -21.1837
29 C1a C 23.0974 -25.3075
30 O1a O 25.4816 -23.9315
31 C1y C 19.5585 -19.0900
32 C1y C 19.5468 -20.4751
33 O2x O 18.3902 -18.3747
34 C1y C 18.3396 -21.1287
35 O2a O 20.7043 -21.1835
36 C1y C 17.1812 -19.0561
37 C1y C 17.1601 -20.4204
38 O1a O 18.3057 -22.5139
39 C1b C 16.0068 -18.3372
40 O2a O 15.9438 -21.0888
41 O1a O 16.0295 -16.9589
42 C1z C 27.9323 -14.3114
43 C1y C 27.9078 -15.6694
44 C1y C 29.1200 -13.6356
45 C1x C 26.7449 -13.6112
46 C1a C 27.9078 -12.9354
47 C1y C 26.7144 -16.3579
48 C1x C 30.2831 -15.7058
49 C1y C 30.3133 -14.3357
50 C1y C 29.1200 -12.2657
51 C1x C 25.5513 -14.2867
52 C1y C 25.5396 -15.6636
53 C1x C 26.7144 -17.7277
54 O2x O 31.4950 -13.6415
55 C1z C 31.4950 -12.2716
56 C1a C 28.1452 -11.2850
57 C1z C 24.3522 -16.3391
58 C2x C 25.5339 -18.4035
59 C1b C 32.6944 -11.5715
60 O1a O 31.4822 -10.8958
61 C2y C 24.3463 -17.7091
62 C1x C 23.1588 -15.6636
63 C1a C 24.3405 -14.9635
64 C1b C 33.8632 -12.2469
65 C1x C 23.1588 -18.4035
66 C1x C 21.9712 -16.3391
67 C1c C 35.0694 -11.5715
68 C1y C 21.9712 -17.7091
69 C1b C 36.2442 -12.2469
70 C1a C 35.0566 -10.2016
71 O2a O 20.7719 -18.4035
72 O2a O 37.4447 -11.5464
73 O1a O 38.6261 -16.3712
BOND 81
1 1 3 1
2 2 4 1
3 3 5 1
4 3 6 1 #Down
5 4 7 1
6 4 8 1 #Up
7 5 9 1 #Up
8 7 10 1 #Down
9 5 7 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 31 32 1
17 31 33 1
18 32 34 1
19 32 35 1 #Down
20 33 36 1
21 34 37 1
22 34 38 1 #Up
23 36 39 1 #Up
24 37 40 1 #Down
25 39 41 1
26 36 37 1
27 21 22 1
28 21 23 1
29 22 24 1
30 22 25 1 #Down
31 23 26 1
32 24 27 1
33 24 28 1 #Down
34 26 29 1 #Down
35 27 30 1 #Up
36 26 27 1
37 16 17 1
38 11 12 1
39 11 13 1
40 12 14 1
41 42 43 1
42 42 44 1
43 42 45 1
44 42 46 1 #Up
45 43 47 1
46 43 48 1
47 44 49 1
48 44 50 1
49 45 51 1
50 47 52 1
51 47 53 1
52 49 54 1
53 50 55 1
54 50 56 1 #Down
55 52 57 1
56 53 58 1
57 55 59 1
58 55 60 1 #Down
59 57 61 1
60 57 62 1
61 57 63 1 #Up
62 59 64 1
63 61 65 1
64 62 66 1
65 64 67 1
66 65 68 1
67 67 69 1
68 67 70 1 #Down
69 68 71 1 #Up
70 48 49 1
71 51 52 1
72 54 55 1
73 58 61 2
74 66 68 1
75 31 71 1 #Up
76 21 35 1 #Up
77 11 40 1 #Up
78 69 72 1
79 1 72 1 #Up
80 1 2 1
81 8 73 1
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