ATOM 66
1 C2y C 12.1589 -17.2899
2 C1z C 12.1589 -18.6731
3 C1y C 13.3346 -19.3647
4 C1x C 14.5104 -18.6731
5 C1y C 14.5104 -17.2899
6 C1y C 13.3346 -16.5982
7 C2x C 10.9831 -16.5982
8 C1y C 9.8074 -17.2899
9 C1z C 9.8074 -18.6731
10 O2x O 8.6317 -16.5982
11 C1z C 7.3868 -17.2899
12 C1y C 7.3868 -18.6731
13 C1a C 6.7643 -19.8488
14 O1a O 9.8074 -20.0563
15 C1z C 15.6861 -16.5982
16 C1y C 15.6861 -15.2842
17 C1x C 14.5104 -14.5926
18 C1y C 13.3346 -15.2842
19 C1x C 16.8619 -17.2899
20 C8y C 18.0376 -16.5982
21 C8y C 18.0376 -15.2842
22 C1x C 16.8619 -14.5926
23 N5x N 19.2133 -17.2899
24 C8y C 20.3891 -16.5982
25 C8y C 20.3891 -15.2842
26 N5x N 19.2133 -14.5926
27 C1x C 21.5648 -17.2899
28 C1y C 22.7406 -16.5982
29 C1z C 22.7406 -15.2842
30 C1x C 21.5648 -14.5926
31 C1x C 23.9163 -17.2899
32 C1x C 25.0920 -16.5982
33 C1y C 25.0920 -15.2842
34 C1y C 23.9163 -14.5926
35 C1a C 22.7406 -13.9010
36 C1a C 15.6861 -17.9815
37 C1a C 12.1589 -20.0563
38 O1a O 13.3346 -20.6788
39 O2x O 7.3868 -15.9066
40 C1x C 6.1889 -15.2150
41 C1z C 4.9909 -15.9066
42 C1x C 4.9909 -17.2899
43 C1x C 6.1889 -17.9815
44 C1a C 3.4288 -15.6191
45 O1a O 4.6330 -14.5705
46 O1a O 12.1339 -14.5974
47 C1z C 26.1127 -14.3813
48 C5x C 25.5685 -13.1291
49 C1x C 24.2107 -13.2606
50 C1x C 26.9223 -15.5029
51 C1y C 28.2392 -15.0795
52 C1y C 28.2433 -13.6962
53 C1z C 26.9292 -13.2648
54 O2x O 29.5533 -15.5109
55 C1z C 30.3698 -14.3944
56 C1y C 29.5602 -13.2728
57 O1a O 27.8283 -12.0669
58 C1a C 26.4450 -11.8594
59 O5x O 25.5685 -11.7459
60 C1x C 30.8147 -15.7073
61 C1x C 32.1979 -15.6865
62 C1z C 32.6055 -14.3647
63 O2x O 31.4743 -13.5686
64 C1a C 33.8034 -13.6731
65 C1a C 33.8034 -15.0563
66 C1a C 30.5383 -12.2947
BOND 78
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 1 7 2
8 7 8 1
9 8 9 1
10 2 9 1
11 8 10 1
12 10 11 1
13 11 12 1
14 9 12 1
15 12 13 1 #Down
16 9 14 1 #Down
17 5 15 1
18 15 16 1
19 16 17 1
20 17 18 1
21 6 18 1
22 15 19 1
23 19 20 1
24 20 21 1
25 21 22 1
26 16 22 1
27 20 23 2
28 23 24 1
29 24 25 2
30 25 26 1
31 21 26 2
32 24 27 1
33 27 28 1
34 28 29 1
35 29 30 1
36 25 30 1
37 28 31 1
38 31 32 1
39 32 33 1
40 33 34 1
41 29 34 1
42 29 35 1 #Up
43 15 36 1 #Up
44 2 37 1 #Up
45 3 38 1 #Up
46 11 39 1 #Down
47 39 40 1
48 40 41 1
49 41 42 1
50 42 43 1
51 11 43 1 #Up
52 41 44 1 #Up
53 41 45 1 #Down
54 18 46 1 #Up
55 33 47 1
56 47 48 1
57 48 49 1
58 34 49 1
59 47 50 1
60 50 51 1
61 51 52 1
62 52 53 1
63 47 53 1 #Up
64 51 54 1
65 55 54 1 #Down
66 56 55 1 #Up
67 52 56 1
68 53 57 1 #Up
69 53 58 1 #Down
70 48 59 2
71 55 60 1
72 60 61 1
73 61 62 1
74 62 63 1
75 55 63 1
76 62 64 1 #Up
77 62 65 1 #Down
78 56 66 1 #Down
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