ATOM 76
1 C1y C 34.2460 -14.2163
2 C1x C 35.6466 -14.2163
3 C1y C 36.6271 -15.2668
4 C1y C 36.6271 -16.6674
5 O2x O 35.6466 -17.6479
6 C1x C 33.2655 -15.2668
7 C1x C 37.8877 -17.3677
8 C1y C 39.0782 -16.6674
9 O2x O 37.8877 -14.5665
10 C2x C 24.5816 -21.6397
11 C2x C 25.9122 -21.2195
12 O2x O 26.1923 -24.3009
13 O2x O 22.7607 -22.5501
14 C1y C 24.0913 -22.9003
15 C1y C 24.7216 -24.1609
16 C2x C 24.0913 -25.4214
17 C2x C 22.7607 -25.7016
18 C1y C 27.3128 -23.4605
19 C1y C 27.1727 -22.0599
20 O2x O 27.8030 -20.9394
21 C2x C 30.3942 -23.8107
22 C2x C 13.7966 -24.2309
23 C2x C 14.3569 -23.0403
24 C1x C 15.6875 -22.6902
25 C1y C 16.8080 -23.5306
26 C1y C 14.3569 -25.4915
27 C1y C 16.8080 -24.9312
28 O2x O 15.7575 -25.8416
29 C1y C 18.0686 -25.6315
30 C1y C 19.2591 -24.8612
31 C1y C 19.1891 -23.4605
32 O2x O 17.9985 -22.8302
33 C2b C 13.5165 -26.6120
34 C2b C 12.3259 -25.9117
35 C2b C 11.1354 -26.6120
36 C2a C 9.9448 -25.9117
37 O2x O 20.4497 -25.5615
38 C1y C 21.6402 -24.8612
39 C1y C 21.6402 -23.4605
40 C1x C 20.4497 -22.7602
41 O1a O 18.0686 -27.0322
42 C1x C 28.1532 -24.1609
43 C2x C 29.2737 -24.3710
44 C1x C 31.0245 -22.6902
45 C1x C 29.0636 -19.1886
46 C1y C 29.9740 -18.1381
47 C1z C 31.3747 -18.1381
48 C1y C 32.2151 -19.1886
49 C1y C 29.4138 -20.5892
50 O2x O 31.9349 -20.5892
51 C1y C 30.6744 -21.2195
52 C1x C 33.6157 -19.0485
53 C1y C 34.1760 -17.7179
54 O2x O 31.8649 -16.8075
55 C1y C 33.2655 -16.6674
56 C1y C 39.1482 -15.1967
57 C1y C 40.2688 -14.3564
58 C1y C 41.5994 -14.6365
59 C1y C 42.2297 -15.8971
60 C1y C 41.5994 -17.2277
61 O2x O 40.2688 -17.5078
62 C1y C 42.4397 -18.3482
63 C1y C 43.8404 -18.2081
64 C1z C 44.4006 -16.9475
65 O2x O 43.6303 -15.8270
66 C1a C 44.8208 -19.1886
67 C1x C 45.3811 -18.0681
68 C1x C 46.6417 -17.5078
69 C1x C 46.5716 -16.1072
70 O2x O 45.1710 -15.7570
71 C1a C 41.8095 -19.6088
72 C1a C 39.9186 -12.9557
73 O1a O 29.3437 -16.8075
74 C1a C 30.6744 -16.8775
75 O1a O 42.5098 -13.5860
76 C1a C 33.6857 -12.9557
BOND 88
1 1 2 1
2 2 3 1
3 4 5 1
4 6 1 1
5 4 7 1
6 7 8 1
7 3 9 1
8 3 4 1
9 10 11 2
10 15 16 1
11 13 14 1
12 16 17 2
13 10 14 1
14 15 12 1
15 14 15 1
16 20 19 1
17 11 19 1
18 18 12 1
19 19 18 1
20 22 26 1
21 25 27 1
22 23 24 1
23 26 28 1
24 22 23 2
25 29 30 1
26 31 32 1
27 26 33 1 #Up
28 33 34 2
29 34 35 1
30 35 36 2
31 30 37 1
32 37 38 1
33 39 40 1
34 31 40 1
35 29 41 1 #Down
36 31 30 1
37 28 27 1
38 29 27 1
39 24 25 1
40 32 25 1
41 13 39 1
42 17 38 1
43 39 38 1
44 18 42 1
45 42 43 1
46 43 21 2
47 44 21 1
48 47 48 1
49 45 49 1
50 48 50 1
51 46 47 1
52 49 51 1
53 45 46 1
54 50 51 1
55 20 49 1
56 51 44 1
57 48 52 1
58 52 53 1
59 47 54 1
60 54 55 1
61 6 55 1
62 55 53 1
63 53 5 1
64 58 59 1
65 59 60 1
66 57 58 1
67 56 57 1
68 60 61 1
69 9 56 1
70 56 8 1
71 8 61 1
72 60 62 1
73 62 63 1
74 63 64 1
75 64 65 1
76 59 65 1
77 63 66 1 #Up
78 64 67 1
79 67 68 1
80 68 69 1
81 69 70 1
82 64 70 1 #Up
83 62 71 1 #Down
84 57 72 1 #Up
85 46 73 1 #Up
86 47 74 1 #Up
87 58 75 1 #Down
88 1 76 1 #Down
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