ATOM 78
1 C1y C 12.8722 -15.3174
2 C1x C 14.0834 -14.6181
3 C1z C 15.3647 -15.3174
4 C1b C 16.5059 -14.6181
5 C1c C 17.7171 -15.3174
6 C1b C 18.9284 -14.6181
7 C1c C 20.1396 -15.3174
8 C1b C 21.3510 -14.6181
9 C1b C 22.5621 -15.3174
10 C1b C 23.7735 -14.6181
11 C1c C 24.9847 -15.3174
12 C1b C 26.1960 -14.6181
13 C1c C 27.4073 -15.3174
14 C1b C 28.6184 -14.6181
15 C5a C 29.8297 -15.3174
16 C1b C 31.0409 -14.6181
17 C7a C 32.2523 -15.3174
18 C1y C 12.8722 -16.7160
19 O7a O 32.2900 -16.7160
20 C1c C 33.4383 -17.4028
21 C1y C 14.0834 -17.4153
22 C1b C 14.0843 -18.8140
23 C1c C 15.2956 -19.5133
24 C2b C 16.5069 -18.8140
25 C2b C 17.7181 -19.5133
26 C2b C 18.9293 -18.8140
27 C2b C 20.1406 -19.5133
28 C2b C 21.3519 -18.8140
29 C2b C 22.5631 -19.5133
30 C2b C 23.7744 -18.8140
31 C2b C 24.9857 -19.5133
32 C2b C 26.1970 -18.8140
33 C2b C 27.4082 -19.5133
34 C2b C 28.6194 -18.8140
35 C2b C 29.8306 -19.5133
36 C2b C 31.0419 -18.8140
37 C2b C 32.2532 -19.5133
38 C6a C 11.6609 -17.4153
39 O6a O 10.4491 -16.7156
40 O6a O 11.6609 -18.8140
41 O1a O 11.6630 -14.6193
42 O2x O 15.2986 -16.7193
43 O1a O 15.2988 -13.9217
44 O1a O 17.7171 -16.7196
45 O1a O 20.1396 -16.7196
46 O1a O 24.9847 -16.7196
47 O1a O 27.4072 -16.7196
48 O5a O 29.8296 -16.7195
49 O6a O 33.4743 -14.6032
50 C1c C 34.6880 -16.7037
51 C1b C 35.9162 -17.4079
52 C1a C 34.7307 -15.3208
53 C1b C 37.1223 -16.7197
54 C1c C 38.3339 -17.4192
55 C1b C 39.5454 -16.7197
56 C5a C 40.7569 -17.4192
57 C8y C 41.9686 -16.7197
58 C8x C 43.1834 -17.4211
59 C8x C 44.3951 -16.7216
60 C8y C 44.3951 -15.3227
61 C8x C 43.1800 -14.6212
62 C8x C 41.9686 -15.3207
63 N1a N 45.6096 -14.6214
64 O2a O 15.2956 -20.9166
65 C1y C 14.0863 -21.6149
66 O2x O 12.8754 -20.9157
67 C1y C 11.6637 -21.6152
68 C1y C 11.6637 -23.0142
69 C1y C 12.8749 -23.7133
70 C1y C 14.0863 -23.0139
71 C1a C 10.4509 -20.9149
72 N1a N 12.8749 -25.1137
73 O1a O 15.2985 -23.7136
74 O1a O 10.4500 -23.7149
75 O5a O 40.7569 -18.8182
76 O1a O 38.3339 -18.8182
77 C1c C 33.4502 -18.8223
78 C1a C 34.6690 -19.5460
BOND 81
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 6 7 1
7 7 8 1
8 8 9 1
9 9 10 1
10 10 11 1
11 11 12 1
12 12 13 1
13 13 14 1
14 14 15 1
15 15 16 1
16 16 17 1
17 1 18 1
18 17 19 1
19 19 20 1
20 18 21 1
21 21 22 1
22 22 23 1
23 23 24 1
24 24 25 2
25 25 26 1
26 26 27 2
27 27 28 1
28 28 29 2
29 29 30 1
30 30 31 2
31 31 32 1
32 32 33 2
33 33 34 1
34 34 35 2
35 35 36 1
36 36 37 2
37 18 38 1
38 38 39 1
39 38 40 2
40 1 41 1
41 3 42 1
42 42 21 1
43 3 43 1
44 5 44 1
45 7 45 1
46 11 46 1
47 13 47 1
48 15 48 2
49 17 49 2
50 20 50 1
51 50 51 1
52 50 52 1
53 51 53 1
54 53 54 1
55 54 55 1
56 55 56 1
57 56 57 1
58 57 58 2
59 58 59 1
60 59 60 2
61 60 61 1
62 61 62 2
63 57 62 1
64 60 63 1
65 23 64 1
66 65 64 1 #Up
67 65 66 1
68 66 67 1
69 67 68 1
70 68 69 1
71 69 70 1
72 65 70 1
73 67 71 1 #Up
74 69 72 1 #Up
75 70 73 1 #Up
76 68 74 1 #Down
77 56 75 2
78 54 76 1
79 37 77 1
80 20 77 1
81 77 78 1
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