NMR Restraints Grid
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NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
24392 |
2k2d   |
15701 | cing | 1-original | 4 | XEASY | peak |
# Number of dimensions 3
#FORMAT xeasy3D
#INAME 1 N
#INAME 2 H
#INAME 3 HN
#CYANAFORMAT NhH
1 121.045 2.027 8.072 1 U 0.127E+08 0.000E+00 e 0 0 0 0
2 115.758 4.788 8.356 1 U 0.312E+08 0.000E+00 e 0 0 0 0
3 115.758 3.576 8.354 1 U 0.128E+08 0.000E+00 e 0 0 0 0
4 115.758 3.729 8.354 1 U 0.124E+08 0.000E+00 e 0 0 0 0
6 115.758 0.892 8.356 1 U 0.166E+08 0.000E+00 e 0 0 0 0
7 115.758 0.684 8.354 1 U 0.985E+07 0.000E+00 e 0 0 0 0
8 115.758 0.510 8.356 1 U 0.118E+08 0.000E+00 e 0 0 0 0
9 128.721 5.069 8.927 1 U 0.255E+08 0.000E+00 e 0 0 0 0
11 128.721 1.212 8.927 1 U 0.343E+08 0.000E+00 e 0 0 0 0
12 128.721 2.543 8.927 1 U 0.601E+07 0.000E+00 e 0 0 0 0
13 128.721 1.523 8.927 1 U 0.705E+07 0.000E+00 e 0 0 0 0
14 128.721 0.689 8.927 1 U 0.883E+07 0.000E+00 e 0 0 0 0
15 128.516 9.126 7.450 1 U 0.193E+08 0.000E+00 e 0 0 0 0
16 128.516 4.016 7.448 1 U 0.174E+08 0.000E+00 e 0 0 0 0
17 128.516 3.743 7.452 1 U 0.121E+08 0.000E+00 e 0 0 0 0
18 128.516 1.860 7.452 1 U 0.187E+08 0.000E+00 e 0 0 0 0
19 128.516 1.690 7.452 1 U 0.328E+08 0.000E+00 e 0 0 0 0
20 128.516 1.528 7.450 1 U 0.162E+08 0.000E+00 e 0 0 0 0
21 128.516 1.484 7.450 1 U 0.104E+08 0.000E+00 e 0 0 0 0
22 128.516 0.507 7.456 1 U 0.122E+08 0.000E+00 e 0 0 0 0
23 128.516 0.871 7.452 1 U 0.113E+08 0.000E+00 e 0 0 0 0
24 128.516 0.933 7.454 1 U 0.803E+07 0.000E+00 e 0 0 0 0
25 127.494 9.235 8.461 1 U 0.879E+07 0.000E+00 e 0 0 0 0
26 127.494 5.427 8.459 1 U 0.155E+08 0.000E+00 e 0 0 0 0
27 127.494 4.371 8.459 1 U 0.176E+08 0.000E+00 e 0 0 0 0
28 127.494 3.256 8.457 1 U 0.391E+08 0.000E+00 e 0 0 0 0
29 127.494 2.637 8.459 1 U 0.292E+08 0.000E+00 e 0 0 0 0
30 127.494 0.927 8.463 1 U 0.848E+07 0.000E+00 e 0 0 0 0
31 127.494 1.625 8.461 1 U 0.564E+07 0.000E+00 e 0 0 0 0
33 126.486 4.268 8.213 1 U 0.824E+07 0.000E+00 e 0 0 0 0
34 126.486 4.480 8.215 1 U 0.734E+07 0.000E+00 e 0 0 0 0
35 126.486 1.349 8.209 1 U 0.986E+07 0.000E+00 e 0 0 0 0
36 126.325 8.443 9.281 1 U 0.103E+08 0.000E+00 e 0 0 0 0
37 126.325 6.958 9.281 1 U 0.112E+08 0.000E+00 e 0 0 0 0
38 126.325 4.969 9.285 1 U 0.419E+08 0.000E+00 e 0 0 0 0
39 126.325 4.620 9.283 1 U 0.228E+08 0.000E+00 e 0 0 0 0
40 126.325 3.922 9.283 1 U 0.664E+07 0.000E+00 e 0 0 0 0
41 126.325 2.796 9.281 1 U 0.296E+08 0.000E+00 e 0 0 0 0
42 126.325 2.567 9.285 1 U 0.448E+08 0.000E+00 e 0 0 0 0
43 126.325 0.930 9.285 1 U 0.182E+08 0.000E+00 e 0 0 0 0
44 125.015 8.522 8.688 1 U 0.774E+07 0.000E+00 e 0 0 0 0
45 125.015 6.885 8.692 1 U 0.747E+07 0.000E+00 e 0 0 0 0
46 125.015 6.988 8.690 1 U 0.747E+07 0.000E+00 e 0 0 0 0
47 125.015 5.037 8.696 1 U 0.150E+08 0.000E+00 e 0 0 0 0
48 125.015 2.901 8.694 1 U 0.253E+08 0.000E+00 e 0 0 0 0
49 125.015 2.816 8.694 1 U 0.311E+08 0.000E+00 e 0 0 0 0
50 125.015 0.871 8.692 1 U 0.978E+07 0.000E+00 e 0 0 0 0
52 126.109 6.970 6.484 1 U 0.979E+07 0.000E+00 e 0 0 0 0
53 126.109 7.152 6.486 1 U 0.760E+07 0.000E+00 e 0 0 0 0
55 126.109 4.089 6.480 1 U 0.800E+07 0.000E+00 e 0 0 0 0
56 126.109 3.115 6.480 1 U 0.695E+07 0.000E+00 e 0 0 0 0
57 126.109 2.743 6.482 1 U 0.745E+07 0.000E+00 e 0 0 0 0
58 126.109 2.508 6.482 1 U 0.887E+07 0.000E+00 e 0 0 0 0
59 126.109 2.444 6.484 1 U 0.769E+07 0.000E+00 e 0 0 0 0
60 126.109 2.247 6.484 1 U 0.956E+07 0.000E+00 e 0 0 0 0
61 124.926 9.220 8.610 1 U 0.102E+08 0.000E+00 e 0 0 0 0
62 124.926 8.364 8.606 1 U 0.124E+08 0.000E+00 e 0 0 0 0
63 124.926 5.430 8.606 1 U 0.265E+08 0.000E+00 e 0 0 0 0
64 124.926 4.767 8.608 1 U 0.146E+08 0.000E+00 e 0 0 0 0
65 124.926 3.121 8.606 1 U 0.619E+07 0.000E+00 e 0 0 0 0
66 124.926 1.836 8.606 1 U 0.332E+08 0.000E+00 e 0 0 0 0
68 124.926 1.613 8.604 1 U 0.688E+08 0.000E+00 e 0 0 0 0
69 124.926 1.481 8.606 1 U 0.163E+08 0.000E+00 e 0 0 0 0
70 124.926 0.798 8.608 1 U 0.261E+08 0.000E+00 e 0 0 0 0
71 125.143 6.498 7.853 1 U 0.110E+08 0.000E+00 e 0 0 0 0
72 125.143 3.503 7.855 1 U 0.181E+08 0.000E+00 e 0 0 0 0
73 125.143 0.977 7.857 1 U 0.306E+08 0.000E+00 e 0 0 0 0
74 125.143 0.684 7.857 1 U 0.344E+08 0.000E+00 e 0 0 0 0
75 125.143 0.537 7.857 1 U 0.136E+08 0.000E+00 e 0 0 0 0
76 125.143 0.305 7.857 1 U 0.927E+07 0.000E+00 e 0 0 0 0
77 124.592 8.082 9.410 1 U 0.879E+07 0.000E+00 e 0 0 0 0
78 124.592 6.862 9.416 1 U 0.956E+07 0.000E+00 e 0 0 0 0
79 124.592 5.016 9.416 1 U 0.949E+07 0.000E+00 e 0 0 0 0
81 124.592 3.039 9.414 1 U 0.151E+08 0.000E+00 e 0 0 0 0
82 124.592 2.667 9.418 1 U 0.137E+08 0.000E+00 e 0 0 0 0
84 124.592 0.939 9.416 1 U 0.884E+07 0.000E+00 e 0 0 0 0
87 123.338 4.494 8.358 1 U 0.689E+07 0.000E+00 e 0 0 0 0
88 123.338 1.684 8.364 1 U 0.879E+07 0.000E+00 e 0 0 0 0
89 123.580 9.255 8.332 1 U 0.920E+07 0.000E+00 e 0 0 0 0
90 123.580 9.308 8.330 1 U 0.735E+07 0.000E+00 e 0 0 0 0
91 123.580 5.477 8.328 1 U 0.182E+08 0.000E+00 e 0 0 0 0
92 123.580 4.362 8.332 1 U 0.727E+07 0.000E+00 e 0 0 0 0
93 123.580 2.579 8.326 1 U 0.625E+08 0.000E+00 e 0 0 0 0
94 123.580 2.461 8.330 1 U 0.862E+07 0.000E+00 e 0 0 0 0
95 123.580 0.725 8.326 1 U 0.714E+07 0.000E+00 e 0 0 0 0
97 123.079 9.276 9.365 1 U 0.794E+08 0.000E+00 e 0 0 0 0
99 123.079 4.952 9.367 1 U 0.297E+08 0.000E+00 e 0 0 0 0
100 123.079 4.374 9.365 1 U 0.804E+07 0.000E+00 e 0 0 0 0
101 123.079 2.634 9.363 1 U 0.410E+08 0.000E+00 e 0 0 0 0
103 122.822 8.249 8.043 1 U 0.821E+07 0.000E+00 e 0 0 0 0
105 122.822 4.066 8.049 1 U 0.154E+08 0.000E+00 e 0 0 0 0
106 122.822 1.317 8.045 1 U 0.318E+08 0.000E+00 e 0 0 0 0
107 122.822 1.194 8.047 1 U 0.107E+08 0.000E+00 e 0 0 0 0
108 122.836 8.897 9.126 1 U 0.614E+08 0.000E+00 e 0 0 0 0
109 122.836 7.445 9.124 1 U 0.298E+08 0.000E+00 e 0 0 0 0
110 122.836 7.246 9.124 1 U 0.111E+08 0.000E+00 e 0 0 0 0
111 122.836 3.849 9.124 1 U 0.293E+08 0.000E+00 e 0 0 0 0
112 122.836 3.638 9.126 1 U 0.133E+08 0.000E+00 e 0 0 0 0
114 122.836 1.921 9.126 1 U 0.582E+08 0.000E+00 e 0 0 0 0
115 122.836 1.361 9.126 1 U 0.369E+08 0.000E+00 e 0 0 0 0
116 122.836 1.033 9.126 1 U 0.184E+08 0.000E+00 e 0 0 0 0
117 122.836 0.816 9.124 1 U 0.204E+08 0.000E+00 e 0 0 0 0
118 121.592 9.376 9.269 1 U 0.395E+08 0.000E+00 e 0 0 0 0
119 121.592 7.651 9.267 1 U 0.431E+08 0.000E+00 e 0 0 0 0
121 121.592 4.773 9.267 1 U 0.111E+08 0.000E+00 e 0 0 0 0
122 121.592 3.265 9.273 1 U 0.132E+08 0.000E+00 e 0 0 0 0
123 121.592 3.215 9.269 1 U 0.103E+08 0.000E+00 e 0 0 0 0
124 121.592 2.681 9.269 1 U 0.243E+08 0.000E+00 e 0 0 0 0
126 121.574 8.572 8.841 1 U 0.205E+08 0.000E+00 e 0 0 0 0
128 121.574 4.834 8.843 1 U 0.118E+08 0.000E+00 e 0 0 0 0
129 121.574 4.389 8.841 1 U 0.187E+08 0.000E+00 e 0 0 0 0
130 121.574 5.430 8.847 1 U 0.604E+07 0.000E+00 e 0 0 0 0
131 121.574 1.238 8.839 1 U 0.423E+08 0.000E+00 e 0 0 0 0
132 121.574 0.874 8.839 1 U 0.806E+07 0.000E+00 e 0 0 0 0
134 120.947 4.729 8.579 1 U 0.264E+08 0.000E+00 e 0 0 0 0
135 120.947 2.376 8.578 1 U 0.738E+07 0.000E+00 e 0 0 0 0
136 120.947 1.895 8.578 1 U 0.147E+08 0.000E+00 e 0 0 0 0
137 120.407 4.356 7.799 1 U 0.737E+07 0.000E+00 e 0 0 0 0
138 120.407 4.177 7.793 1 U 0.619E+07 0.000E+00 e 0 0 0 0
139 120.407 2.851 7.797 1 U 0.211E+08 0.000E+00 e 0 0 0 0
142 120.636 7.868 8.646 1 U 0.634E+07 0.000E+00 e 0 0 0 0
143 120.636 6.782 8.648 1 U 0.971E+07 0.000E+00 e 0 0 0 0
144 120.636 4.500 8.650 1 U 0.152E+08 0.000E+00 e 0 0 0 0
145 120.636 2.535 8.644 1 U 0.774E+07 0.000E+00 e 0 0 0 0
146 120.636 2.441 8.648 1 U 0.108E+08 0.000E+00 e 0 0 0 0
147 120.636 1.998 8.650 1 U 0.919E+07 0.000E+00 e 0 0 0 0
148 120.636 1.857 8.650 1 U 0.232E+08 0.000E+00 e 0 0 0 0
149 120.636 1.672 8.646 1 U 0.124E+08 0.000E+00 e 0 0 0 0
151 120.658 9.123 8.897 1 U 0.638E+08 0.000E+00 e 0 0 0 0
152 120.658 7.428 8.904 1 U 0.992E+07 0.000E+00 e 0 0 0 0
153 120.658 7.246 8.900 1 U 0.477E+08 0.000E+00 e 0 0 0 0
154 120.658 4.964 8.906 1 U 0.200E+08 0.000E+00 e 0 0 0 0
156 120.658 4.362 8.910 1 U 0.111E+08 0.000E+00 e 0 0 0 0
157 120.658 3.177 8.900 1 U 0.155E+08 0.000E+00 e 0 0 0 0
158 120.658 2.866 8.910 1 U 0.481E+07 0.000E+00 e 0 0 0 0
159 120.658 2.435 8.904 1 U 0.227E+08 0.000E+00 e 0 0 0 0
160 120.658 2.121 8.914 1 U 0.137E+08 0.000E+00 e 0 0 0 0
161 120.658 1.980 8.906 1 U 0.172E+08 0.000E+00 e 0 0 0 0
162 120.658 0.880 8.906 1 U 0.124E+08 0.000E+00 e 0 0 0 0
163 120.420 8.842 8.574 1 U 0.263E+08 0.000E+00 e 0 0 0 0
164 120.420 5.216 8.568 1 U 0.202E+08 0.000E+00 e 0 0 0 0
165 120.420 5.078 8.568 1 U 0.127E+08 0.000E+00 e 0 0 0 0
166 120.420 4.679 8.574 1 U 0.316E+08 0.000E+00 e 0 0 0 0
167 120.420 4.371 8.570 1 U 0.126E+08 0.000E+00 e 0 0 0 0
168 120.420 1.531 8.570 1 U 0.213E+08 0.000E+00 e 0 0 0 0
169 120.420 1.434 8.570 1 U 0.486E+08 0.000E+00 e 0 0 0 0
170 120.420 1.126 8.570 1 U 0.112E+08 0.000E+00 e 0 0 0 0
171 120.420 0.886 8.570 1 U 0.114E+08 0.000E+00 e 0 0 0 0
172 120.420 0.701 8.574 1 U 0.131E+08 0.000E+00 e 0 0 0 0
173 120.420 0.510 8.572 1 U 0.971E+07 0.000E+00 e 0 0 0 0
176 120.415 2.074 8.061 1 U 0.817E+07 0.000E+00 e 0 0 0 0
177 120.262 2.051 8.044 1 U 0.119E+08 0.000E+00 e 0 0 0 0
178 120.262 1.558 8.046 1 U 0.660E+07 0.000E+00 e 0 0 0 0
179 120.262 1.329 8.048 1 U 0.674E+07 0.000E+00 e 0 0 0 0
180 119.390 8.689 8.318 1 U 0.647E+07 0.000E+00 e 0 0 0 0
181 119.390 4.474 8.316 1 U 0.247E+08 0.000E+00 e 0 0 0 0
182 119.390 2.450 8.320 1 U 0.247E+08 0.000E+00 e 0 0 0 0
183 119.390 2.039 8.318 1 U 0.964E+08 0.000E+00 e 0 0 0 0
184 119.325 9.255 9.026 1 U 0.208E+08 0.000E+00 e 0 0 0 0
185 119.325 8.387 9.024 1 U 0.629E+07 0.000E+00 e 0 0 0 0
186 119.325 4.793 9.026 1 U 0.165E+08 0.000E+00 e 0 0 0 0
187 119.325 5.465 9.024 1 U 0.105E+08 0.000E+00 e 0 0 0 0
188 119.325 0.880 9.024 1 U 0.258E+08 0.000E+00 e 0 0 0 0
189 119.325 0.686 9.026 1 U 0.467E+08 0.000E+00 e 0 0 0 0
192 117.882 9.029 9.245 1 U 0.180E+08 0.000E+00 e 0 0 0 0
193 117.882 8.317 9.243 1 U 0.106E+08 0.000E+00 e 0 0 0 0
194 117.882 4.573 9.245 1 U 0.159E+08 0.000E+00 e 0 0 0 0
195 117.882 4.444 9.249 1 U 0.810E+07 0.000E+00 e 0 0 0 0
196 117.882 2.097 9.245 1 U 0.803E+07 0.000E+00 e 0 0 0 0
197 117.882 1.135 9.245 1 U 0.845E+07 0.000E+00 e 0 0 0 0
198 117.882 0.865 9.243 1 U 0.433E+08 0.000E+00 e 0 0 0 0
199 117.882 0.689 9.243 1 U 0.111E+08 0.000E+00 e 0 0 0 0
200 118.000 9.358 7.651 1 U 0.202E+08 0.000E+00 e 0 0 0 0
201 118.000 9.261 7.653 1 U 0.785E+08 0.000E+00 e 0 0 0 0
203 118.000 4.758 7.651 1 U 0.140E+09 0.000E+00 e 0 0 0 0
205 118.000 3.271 7.651 1 U 0.106E+08 0.000E+00 e 0 0 0 0
206 118.000 3.077 7.647 1 U 0.184E+08 0.000E+00 e 0 0 0 0
207 118.000 2.957 7.651 1 U 0.191E+08 0.000E+00 e 0 0 0 0
208 118.000 2.631 7.655 1 U 0.181E+08 0.000E+00 e 0 0 0 0
210 116.758 5.028 8.286 1 U 0.209E+08 0.000E+00 e 0 0 0 0
211 116.758 3.919 8.286 1 U 0.157E+08 0.000E+00 e 0 0 0 0
215 116.758 1.015 8.284 1 U 0.229E+08 0.000E+00 e 0 0 0 0
216 116.259 8.366 9.315 1 U 0.127E+08 0.000E+00 e 0 0 0 0
217 116.259 5.225 9.313 1 U 0.119E+08 0.000E+00 e 0 0 0 0
218 116.259 5.069 9.315 1 U 0.125E+08 0.000E+00 e 0 0 0 0
219 116.259 1.473 9.311 1 U 0.237E+08 0.000E+00 e 0 0 0 0
220 116.259 1.124 9.315 1 U 0.100E+08 0.000E+00 e 0 0 0 0
221 116.259 0.892 9.313 1 U 0.282E+08 0.000E+00 e 0 0 0 0
222 116.259 0.684 9.313 1 U 0.208E+08 0.000E+00 e 0 0 0 0
223 116.259 0.519 9.319 1 U 0.665E+07 0.000E+00 e 0 0 0 0
224 115.758 9.311 8.353 1 U 0.194E+08 0.000E+00 e 0 0 0 0
225 115.758 8.455 8.353 1 U 0.131E+08 0.000E+00 e 0 0 0 0
226 114.690 8.713 8.140 1 U 0.811E+07 0.000E+00 e 0 0 0 0
227 114.690 7.249 8.142 1 U 0.782E+07 0.000E+00 e 0 0 0 0
228 114.690 4.116 8.140 1 U 0.168E+08 0.000E+00 e 0 0 0 0
229 114.690 3.798 8.140 1 U 0.257E+08 0.000E+00 e 0 0 0 0
230 114.690 2.846 8.140 1 U 0.196E+08 0.000E+00 e 0 0 0 0
231 114.690 2.555 8.142 1 U 0.956E+07 0.000E+00 e 0 0 0 0
232 114.653 8.149 7.240 1 U 0.120E+08 0.000E+00 e 0 0 0 0
233 114.653 8.903 7.242 1 U 0.381E+08 0.000E+00 e 0 0 0 0
234 114.653 3.840 7.242 1 U 0.595E+08 0.000E+00 e 0 0 0 0
235 114.653 2.851 7.240 1 U 0.791E+07 0.000E+00 e 0 0 0 0
236 114.653 2.012 7.242 1 U 0.116E+08 0.000E+00 e 0 0 0 0
237 114.653 1.913 7.242 1 U 0.112E+08 0.000E+00 e 0 0 0 0
238 114.653 2.156 7.242 1 U 0.674E+07 0.000E+00 e 0 0 0 0
239 111.328 8.455 9.217 1 U 0.172E+08 0.000E+00 e 0 0 0 0
240 111.328 8.592 9.219 1 U 0.816E+07 0.000E+00 e 0 0 0 0
241 111.328 7.657 9.219 1 U 0.302E+08 0.000E+00 e 0 0 0 0
242 111.328 4.931 9.217 1 U 0.847E+07 0.000E+00 e 0 0 0 0
243 111.328 4.221 9.217 1 U 0.423E+08 0.000E+00 e 0 0 0 0
244 111.328 3.509 9.217 1 U 0.664E+08 0.000E+00 e 0 0 0 0
245 111.328 3.256 9.217 1 U 0.356E+08 0.000E+00 e 0 0 0 0
246 111.328 2.649 9.219 1 U 0.186E+08 0.000E+00 e 0 0 0 0
247 111.328 0.780 9.217 1 U 0.167E+08 0.000E+00 e 0 0 0 0
248 110.133 9.399 8.054 1 U 0.809E+07 0.000E+00 e 0 0 0 0
250 110.133 4.600 8.054 1 U 0.617E+07 0.000E+00 e 0 0 0 0
252 110.133 0.933 8.056 1 U 0.323E+08 0.000E+00 e 0 0 0 0
253 110.133 3.916 8.059 1 U 0.655E+07 0.000E+00 e 0 0 0 0
254 110.133 4.400 8.056 1 U 0.688E+07 0.000E+00 e 0 0 0 0
255 106.001 3.767 7.105 1 U 0.215E+08 0.000E+00 e 0 0 0 0
256 106.001 3.107 7.103 1 U 0.103E+08 0.000E+00 e 0 0 0 0
257 106.001 4.301 7.101 1 U 0.879E+07 0.000E+00 e 0 0 0 0
258 126.788 4.113 7.979 1 U 0.395E+08 0.000E+00 e 0 0 0 0
259 126.788 1.892 7.987 1 U 0.431E+08 0.000E+00 e 0 0 0 0
260 126.788 2.271 7.987 1 U 0.275E+08 0.000E+00 e 0 0 0 0
261 118.918 8.058 8.241 1 U 0.153E+08 0.000E+00 e 0 0 0 0
262 118.918 4.482 8.243 1 U 0.748E+07 0.000E+00 e 0 0 0 0
263 118.918 4.315 8.243 1 U 0.244E+08 0.000E+00 e 0 0 0 0
264 118.918 2.796 8.245 1 U 0.177E+08 0.000E+00 e 0 0 0 0
265 118.918 2.681 8.247 1 U 0.179E+08 0.000E+00 e 0 0 0 0
267 119.928 4.541 8.243 1 U 0.186E+08 0.000E+00 e 0 0 0 0
268 119.928 4.482 8.243 1 U 0.145E+08 0.000E+00 e 0 0 0 0
269 119.928 2.675 8.247 1 U 0.894E+07 0.000E+00 e 0 0 0 0
270 119.928 2.564 8.249 1 U 0.147E+08 0.000E+00 e 0 0 0 0
271 119.928 1.977 8.245 1 U 0.716E+07 0.000E+00 e 0 0 0 0
272 121.045 8.501 8.079 1 U 0.172E+08 0.000E+00 e 0 0 0 0
273 121.045 7.806 8.079 1 U 0.167E+08 0.000E+00 e 0 0 0 0
274 121.045 4.039 8.077 1 U 0.361E+08 0.000E+00 e 0 0 0 0
275 121.045 4.221 8.063 1 U 0.119E+08 0.000E+00 e 0 0 0 0
276 121.045 2.271 8.083 1 U 0.163E+08 0.000E+00 e 0 0 0 0
278 121.045 1.971 8.081 1 U 0.529E+08 0.000E+00 e 0 0 0 0
279 119.880 7.897 7.745 1 U 0.645E+07 0.000E+00 e 0 0 0 0
280 119.880 4.157 7.747 1 U 0.660E+07 0.000E+00 e 0 0 0 0
281 119.880 2.379 7.741 1 U 0.724E+07 0.000E+00 e 0 0 0 0
282 119.880 2.045 7.745 1 U 0.121E+08 0.000E+00 e 0 0 0 0
283 117.753 7.745 7.897 1 U 0.133E+08 0.000E+00 e 0 0 0 0
284 117.753 6.997 7.899 1 U 0.114E+08 0.000E+00 e 0 0 0 0
285 117.753 4.667 7.901 1 U 0.128E+08 0.000E+00 e 0 0 0 0
286 117.753 3.297 7.907 1 U 0.942E+07 0.000E+00 e 0 0 0 0
287 117.753 2.746 7.907 1 U 0.243E+08 0.000E+00 e 0 0 0 0
288 117.753 2.391 7.903 1 U 0.887E+07 0.000E+00 e 0 0 0 0
289 113.772 4.186 8.124 1 U 0.478E+07 0.000E+00 e 0 0 0 0
290 113.772 4.016 8.122 1 U 0.521E+07 0.000E+00 e 0 0 0 0
291 126.477 8.141 8.683 1 U 0.743E+07 0.000E+00 e 0 0 0 0
292 126.477 7.856 8.683 1 U 0.111E+08 0.000E+00 e 0 0 0 0
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570 111.937 1.430 6.636 1 U 0.885E+07 0.000E+00 e 0 0 0 0
571 111.937 1.427 6.966 1 U 0.724E+07 0.000E+00 e 0 0 0 0
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576 112.222 2.950 7.447 1 U 0.203E+08 0.000E+00 e 0 0 0 0
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578 112.222 2.953 6.747 1 U 0.957E+07 0.000E+00 e 0 0 0 0
579 112.222 3.088 6.745 1 U 0.946E+07 0.000E+00 e 0 0 0 0
580 112.222 1.835 7.449 1 U 0.581E+07 0.000E+00 e 0 0 0 0
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585 112.269 2.445 7.670 1 U 0.152E+08 0.000E+00 e 0 0 0 0
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602 112.150 7.596 7.588 1 U 0.492E+09 0.000E+00 e 0 0 0 0
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610 118.918 7.816 8.240 1 U 0.535E+07 0.000E+00 e 0 0 0 0
611 113.200 4.705 6.918 1 U 0.176E+08 0.000E+00 e 0 0 0 0
612 119.325 3.928 9.021 1 U 0.473E+07 0.000E+00 e 0 0 0 0
613 119.325 1.027 9.025 1 U 0.606E+07 0.000E+00 e 0 0 0 0
614 125.015 1.003 8.688 1 U 0.569E+07 0.000E+00 e 0 0 0 0
615 125.015 2.081 8.692 1 U 0.894E+07 0.000E+00 e 0 0 0 0
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618 116.259 4.833 9.325 1 U 0.548E+07 0.000E+00 e 0 0 0 0
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620 111.328 0.735 9.216 1 U 0.637E+07 0.000E+00 e 0 0 0 0
621 120.575 8.870 8.901 1 U 0.148E+09 0.000E+00 e 0 0 0 0
622 128.721 8.841 8.925 1 U 0.140E+08 0.000E+00 e 0 0 0 0
623 121.574 8.466 8.843 1 U 0.767E+07 0.000E+00 e 0 0 0 0
624 120.405 8.460 8.576 1 U 0.165E+08 0.000E+00 e 0 0 0 0
625 111.900 4.616 6.964 1 U 0.598E+07 0.000E+00 e 0 0 0 0
626 126.325 6.638 9.296 1 U 0.452E+07 0.000E+00 e 0 0 0 0
627 123.079 2.662 9.371 1 U 0.221E+08 0.000E+00 e 0 0 0 0
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630 112.208 4.770 6.750 1 U 0.218E+08 0.000E+00 e 0 0 0 0
631 112.208 4.770 6.750 1 U 0.218E+08 0.000E+00 e 0 0 0 0
632 112.208 4.770 7.442 1 U 0.381E+08 0.000E+00 e 0 0 0 0
633 118.000 6.750 7.654 1 U 0.508E+07 0.000E+00 e 0 0 0 0
634 118.000 6.750 7.654 1 U 0.508E+07 0.000E+00 e 0 0 0 0
635 118.000 7.442 7.656 1 U 0.686E+07 0.000E+00 e 0 0 0 0
637 115.758 8.599 8.351 1 U 0.696E+07 0.000E+00 e 0 0 0 0
638 116.259 9.047 9.321 1 U 0.614E+07 0.000E+00 e 0 0 0 0
639 120.420 9.012 8.572 1 U 0.460E+07 0.000E+00 e 0 0 0 0
640 112.206 4.496 6.888 1 U 0.829E+07 0.000E+00 e 0 0 0 0
641 117.882 8.694 9.249 1 U 0.731E+07 0.000E+00 e 0 0 0 0
642 120.636 7.094 8.653 1 U 0.643E+07 0.000E+00 e 0 0 0 0
643 106.001 4.515 7.094 1 U 0.538E+07 0.000E+00 e 0 0 0 0
644 120.658 4.022 8.900 1 U 0.662E+07 0.000E+00 e 0 0 0 0
645 128.516 1.711 7.450 1 U 0.246E+08 0.000E+00 e 0 0 0 0
646 126.477 7.465 8.686 1 U 0.512E+07 0.000E+00 e 0 0 0 0
647 114.690 8.900 8.139 1 U 0.612E+07 0.000E+00 e 0 0 0 0
648 121.574 0.939 8.837 1 U 0.412E+07 0.000E+00 e 0 0 0 0
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650 127.494 8.569 8.460 1 U 0.896E+07 0.000E+00 e 0 0 0 0
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653 127.494 8.580 8.460 1 U 0.896E+07 0.000E+00 e 0 0 0 0
654 124.926 8.478 8.610 1 U 0.118E+08 0.000E+00 e 0 0 0 0
655 123.580 5.236 8.330 1 U 0.520E+07 0.000E+00 e 0 0 0 0
# Number of dimensions 3
#FORMAT xeasy3D
#INAME 1 C
#INAME 2 H
#INAME 3 HC
#CYANAFORMAT ChH
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978 33.081 3.066 1.861 1 U 0.504E+07 0.000E+00 e 0 0 0 0
979 25.556 4.022 1.462 1 U 0.205E+08 0.000E+00 e 0 0 0 0
980 25.556 1.688 1.462 1 U 0.830E+08 0.000E+00 e 0 0 0 0
981 25.556 1.861 1.462 1 U 0.370E+08 0.000E+00 e 0 0 0 0
982 25.556 1.462 1.462 1 U 0.661E+09 0.000E+00 e 0 0 0 0
983 25.556 1.526 1.462 1 U 0.363E+09 0.000E+00 e 0 0 0 0
984 25.556 1.740 1.462 1 U 0.858E+08 0.000E+00 e 0 0 0 0
985 25.556 3.066 1.462 1 U 0.168E+08 0.000E+00 e 0 0 0 0
986 25.556 4.022 1.526 1 U 0.150E+08 0.000E+00 e 0 0 0 0
987 25.556 1.688 1.526 1 U 0.832E+08 0.000E+00 e 0 0 0 0
988 25.556 1.861 1.526 1 U 0.280E+08 0.000E+00 e 0 0 0 0
989 25.556 1.462 1.526 1 U 0.387E+09 0.000E+00 e 0 0 0 0
990 25.556 1.526 1.526 1 U 0.481E+09 0.000E+00 e 0 0 0 0
991 25.556 1.740 1.526 1 U 0.829E+08 0.000E+00 e 0 0 0 0
992 25.556 3.066 1.526 1 U 0.153E+08 0.000E+00 e 0 0 0 0
993 29.201 4.022 1.740 1 U 0.113E+08 0.000E+00 e 0 0 0 0
994 29.201 1.688 1.740 1 U 0.432E+09 0.000E+00 e 0 0 0 0
995 29.201 1.861 1.740 1 U 0.968E+08 0.000E+00 e 0 0 0 0
996 29.201 1.462 1.740 1 U 0.652E+08 0.000E+00 e 0 0 0 0
997 29.201 1.526 1.740 1 U 0.912E+08 0.000E+00 e 0 0 0 0
998 29.201 1.740 1.740 1 U 0.156E+10 0.000E+00 e 0 0 0 0
999 29.201 3.066 1.740 1 U 0.433E+08 0.000E+00 e 0 0 0 0
1000 41.969 4.022 3.066 1 U 0.372E+07 0.000E+00 e 0 0 0 0
1001 41.969 1.688 3.066 1 U 0.269E+08 0.000E+00 e 0 0 0 0
1002 41.969 1.861 3.066 1 U 0.180E+08 0.000E+00 e 0 0 0 0
1003 41.969 1.462 3.066 1 U 0.486E+08 0.000E+00 e 0 0 0 0
1004 41.969 1.526 3.066 1 U 0.354E+08 0.000E+00 e 0 0 0 0
1005 41.969 1.740 3.066 1 U 0.771E+08 0.000E+00 e 0 0 0 0
1006 41.969 3.066 3.066 1 U 0.460E+10 0.000E+00 e 0 0 0 0
1007 56.659 4.942 4.942 1 U 0.388E+09 0.000E+00 e 0 0 0 0
1008 56.659 2.629 4.942 1 U 0.239E+08 0.000E+00 e 0 0 0 0
1009 56.659 2.775 4.942 1 U 0.311E+08 0.000E+00 e 0 0 0 0
1010 56.659 9.262 4.948 1 U 0.184E+08 0.000E+00 e 0 0 0 0
1011 41.910 4.942 2.629 1 U 0.122E+08 0.000E+00 e 0 0 0 0
1012 41.910 2.629 2.629 1 U 0.152E+09 0.000E+00 e 0 0 0 0
1013 41.910 2.775 2.629 1 U 0.798E+08 0.000E+00 e 0 0 0 0
1014 41.910 9.268 2.629 1 U 0.105E+08 0.000E+00 e 0 0 0 0
1015 41.910 4.942 2.775 1 U 0.215E+08 0.000E+00 e 0 0 0 0
1016 41.910 2.629 2.775 1 U 0.924E+08 0.000E+00 e 0 0 0 0
1017 41.910 2.775 2.775 1 U 0.377E+09 0.000E+00 e 0 0 0 0
1018 41.910 9.268 2.775 1 U 0.123E+08 0.000E+00 e 0 0 0 0
1019 59.262 5.062 5.062 1 U 0.219E+09 0.000E+00 e 0 0 0 0
1020 59.262 1.536 5.062 1 U 0.486E+08 0.000E+00 e 0 0 0 0
1021 59.262 1.461 5.062 1 U 0.206E+08 0.000E+00 e 0 0 0 0
1022 59.262 0.685 5.062 1 U 0.586E+08 0.000E+00 e 0 0 0 0
1023 59.262 0.517 5.062 1 U 0.782E+07 0.000E+00 e 0 0 0 0
1024 59.262 8.841 5.062 1 U 0.670E+08 0.000E+00 e 0 0 0 0
1025 43.158 5.062 1.536 1 U 0.191E+08 0.000E+00 e 0 0 0 0
1026 43.158 1.536 1.536 1 U 0.154E+09 0.000E+00 e 0 0 0 0
1027 43.158 1.461 1.536 1 U 0.588E+08 0.000E+00 e 0 0 0 0
1028 43.158 0.688 1.532 1 U 0.375E+08 0.000E+00 e 0 0 0 0
1029 43.158 0.517 1.527 1 U 0.194E+08 0.000E+00 e 0 0 0 0
1030 43.158 8.841 1.536 1 U 0.180E+08 0.000E+00 e 0 0 0 0
1031 25.275 5.062 1.461 1 U 0.402E+07 0.000E+00 e 0 0 0 0
1032 25.275 1.536 1.461 1 U 0.236E+09 0.000E+00 e 0 0 0 0
1033 25.275 1.461 1.461 1 U 0.450E+09 0.000E+00 e 0 0 0 0
1034 25.275 0.685 1.461 1 U 0.198E+08 0.000E+00 e 0 0 0 0
1035 25.275 0.517 1.461 1 U 0.247E+08 0.000E+00 e 0 0 0 0
1036 25.275 8.841 1.461 1 U 0.361E+07 0.000E+00 e 0 0 0 0
1037 18.969 5.062 0.685 1 U 0.736E+08 0.000E+00 e 0 0 0 0
1038 18.969 1.536 0.685 1 U 0.118E+09 0.000E+00 e 0 0 0 0
1039 18.969 1.461 0.685 1 U 0.755E+08 0.000E+00 e 0 0 0 0
1040 18.969 0.685 0.685 1 U 0.394E+10 0.000E+00 e 0 0 0 0
1041 18.969 0.517 0.685 1 U 0.217E+09 0.000E+00 e 0 0 0 0
1042 18.969 8.841 0.685 1 U 0.257E+08 0.000E+00 e 0 0 0 0
1043 14.876 5.062 0.517 1 U 0.446E+07 0.000E+00 e 0 0 0 0
1044 14.876 1.536 0.517 1 U 0.461E+08 0.000E+00 e 0 0 0 0
1045 14.876 1.461 0.517 1 U 0.558E+08 0.000E+00 e 0 0 0 0
1046 14.876 0.685 0.517 1 U 0.134E+09 0.000E+00 e 0 0 0 0
1047 14.876 0.517 0.517 1 U 0.964E+09 0.000E+00 e 0 0 0 0
1048 62.760 4.506 4.506 1 U 0.454E+09 0.000E+00 e 0 0 0 0
1049 62.760 1.839 4.506 1 U 0.305E+08 0.000E+00 e 0 0 0 0
1050 62.760 2.253 4.506 1 U 0.506E+08 0.000E+00 e 0 0 0 0
1051 62.760 1.975 4.506 1 U 0.199E+08 0.000E+00 e 0 0 0 0
1052 62.760 3.722 4.506 1 U 0.390E+07 0.000E+00 e 0 0 0 0
1053 62.760 3.760 4.506 1 U 0.398E+07 0.000E+00 e 0 0 0 0
1054 62.760 8.584 4.506 1 U 0.378E+08 0.000E+00 e 0 0 0 0
1055 32.045 4.503 1.849 1 U 0.273E+08 0.000E+00 e 0 0 0 0
1056 32.045 1.839 1.839 1 U 0.808E+09 0.000E+00 e 0 0 0 0
1057 32.045 2.253 1.839 1 U 0.183E+09 0.000E+00 e 0 0 0 0
1058 32.045 1.975 1.839 1 U 0.128E+09 0.000E+00 e 0 0 0 0
1059 32.045 3.710 1.849 1 U 0.160E+08 0.000E+00 e 0 0 0 0
1060 32.045 3.763 1.851 1 U 0.130E+08 0.000E+00 e 0 0 0 0
1061 32.045 8.584 1.839 1 U 0.121E+08 0.000E+00 e 0 0 0 0
1062 32.045 4.506 2.253 1 U 0.312E+08 0.000E+00 e 0 0 0 0
1063 32.045 1.839 2.253 1 U 0.207E+09 0.000E+00 e 0 0 0 0
1064 32.045 2.253 2.253 1 U 0.572E+09 0.000E+00 e 0 0 0 0
1065 32.045 1.975 2.253 1 U 0.694E+08 0.000E+00 e 0 0 0 0
1066 32.045 3.722 2.253 1 U 0.109E+08 0.000E+00 e 0 0 0 0
1067 32.045 3.760 2.253 1 U 0.127E+08 0.000E+00 e 0 0 0 0
1068 32.045 8.584 2.253 1 U 0.596E+07 0.000E+00 e 0 0 0 0
1069 27.353 4.506 1.975 1 U 0.787E+07 0.000E+00 e 0 0 0 0
1070 27.353 1.839 1.975 1 U 0.115E+09 0.000E+00 e 0 0 0 0
1071 27.353 2.253 1.975 1 U 0.464E+08 0.000E+00 e 0 0 0 0
1072 27.353 1.975 1.975 1 U 0.103E+10 0.000E+00 e 0 0 0 0
1073 27.353 3.722 1.975 1 U 0.429E+08 0.000E+00 e 0 0 0 0
1074 27.353 3.760 1.975 1 U 0.451E+08 0.000E+00 e 0 0 0 0
1075 50.943 4.506 3.722 1 U 0.911E+07 0.000E+00 e 0 0 0 0
1076 50.943 1.839 3.722 1 U 0.109E+08 0.000E+00 e 0 0 0 0
1077 50.943 2.253 3.722 1 U 0.662E+07 0.000E+00 e 0 0 0 0
1078 50.943 1.975 3.722 1 U 0.507E+08 0.000E+00 e 0 0 0 0
1079 50.943 3.722 3.722 1 U 0.400E+09 0.000E+00 e 0 0 0 0
1080 50.943 3.760 3.722 1 U 0.362E+09 0.000E+00 e 0 0 0 0
1081 50.943 4.506 3.760 1 U 0.210E+08 0.000E+00 e 0 0 0 0
1082 50.943 1.839 3.760 1 U 0.146E+08 0.000E+00 e 0 0 0 0
1083 50.943 2.253 3.760 1 U 0.123E+08 0.000E+00 e 0 0 0 0
1084 50.943 1.975 3.760 1 U 0.575E+08 0.000E+00 e 0 0 0 0
1085 50.943 3.722 3.760 1 U 0.389E+09 0.000E+00 e 0 0 0 0
1086 50.943 3.760 3.760 1 U 0.399E+09 0.000E+00 e 0 0 0 0
1087 65.051 4.011 4.011 1 U 0.304E+09 0.000E+00 e 0 0 0 0
1088 65.051 4.170 4.011 1 U 0.522E+08 0.000E+00 e 0 0 0 0
1089 65.051 1.219 4.011 1 U 0.325E+08 0.000E+00 e 0 0 0 0
1090 69.041 4.011 4.170 1 U 0.691E+08 0.000E+00 e 0 0 0 0
1091 69.041 4.170 4.170 1 U 0.508E+09 0.000E+00 e 0 0 0 0
1092 69.041 1.219 4.170 1 U 0.724E+08 0.000E+00 e 0 0 0 0
1093 21.606 4.011 1.219 1 U 0.404E+08 0.000E+00 e 0 0 0 0
1094 21.606 4.170 1.219 1 U 0.754E+08 0.000E+00 e 0 0 0 0
1095 21.606 1.219 1.219 1 U 0.539E+10 0.000E+00 e 0 0 0 0
1096 21.606 7.888 1.219 1 U 0.507E+07 0.000E+00 e 0 0 0 0
1097 57.903 4.062 4.062 1 U 0.474E+09 0.000E+00 e 0 0 0 0
1098 57.903 1.683 4.062 1 U 0.579E+08 0.000E+00 e 0 0 0 0
1099 57.903 1.471 4.062 1 U 0.322E+08 0.000E+00 e 0 0 0 0
1100 57.903 3.086 4.071 1 U 0.773E+07 0.000E+00 e 0 0 0 0
1101 57.903 7.803 4.062 1 U 0.509E+07 0.000E+00 e 0 0 0 0
1102 30.119 4.062 1.683 1 U 0.356E+08 0.000E+00 e 0 0 0 0
1103 30.119 1.683 1.683 1 U 0.623E+09 0.000E+00 e 0 0 0 0
1104 30.119 1.471 1.683 1 U 0.922E+08 0.000E+00 e 0 0 0 0
1105 30.119 3.083 1.683 1 U 0.293E+08 0.000E+00 e 0 0 0 0
1106 30.119 7.803 1.683 1 U 0.271E+07 0.000E+00 e 0 0 0 0
1107 26.918 4.062 1.471 1 U 0.114E+08 0.000E+00 e 0 0 0 0
1108 26.918 1.683 1.471 1 U 0.847E+08 0.000E+00 e 0 0 0 0
1109 26.918 1.471 1.471 1 U 0.566E+09 0.000E+00 e 0 0 0 0
1110 26.918 3.083 1.471 1 U 0.421E+08 0.000E+00 e 0 0 0 0
1111 43.416 4.062 3.083 1 U 0.152E+08 0.000E+00 e 0 0 0 0
1112 43.416 1.683 3.083 1 U 0.959E+08 0.000E+00 e 0 0 0 0
1113 43.416 1.471 3.083 1 U 0.143E+09 0.000E+00 e 0 0 0 0
1114 43.416 3.083 3.083 1 U 0.564E+10 0.000E+00 e 0 0 0 0
1115 45.072 3.764 3.764 1 U 0.167E+09 0.000E+00 e 0 0 0 0
1116 45.072 4.285 3.764 1 U 0.105E+09 0.000E+00 e 0 0 0 0
1117 45.072 8.651 3.764 1 U 0.269E+08 0.000E+00 e 0 0 0 0
1118 45.072 3.764 4.285 1 U 0.939E+08 0.000E+00 e 0 0 0 0
1119 45.072 4.285 4.285 1 U 0.130E+09 0.000E+00 e 0 0 0 0
1120 45.072 8.651 4.285 1 U 0.173E+08 0.000E+00 e 0 0 0 0
1121 54.543 4.536 4.536 1 U 0.420E+10 0.000E+00 e 0 0 0 0
1122 54.543 2.577 4.536 1 U 0.767E+08 0.000E+00 e 0 0 0 0
1123 54.543 2.656 4.536 1 U 0.150E+09 0.000E+00 e 0 0 0 0
1124 54.543 8.129 4.536 1 U 0.255E+08 0.000E+00 e 0 0 0 0
1125 41.254 4.536 2.577 1 U 0.622E+08 0.000E+00 e 0 0 0 0
1126 41.254 2.577 2.577 1 U 0.245E+10 0.000E+00 e 0 0 0 0
1127 41.254 2.656 2.577 1 U 0.153E+10 0.000E+00 e 0 0 0 0
1128 41.254 4.536 2.656 1 U 0.930E+08 0.000E+00 e 0 0 0 0
1129 41.254 2.577 2.656 1 U 0.151E+10 0.000E+00 e 0 0 0 0
1130 41.254 2.656 2.656 1 U 0.298E+10 0.000E+00 e 0 0 0 0
1131 41.254 8.129 2.656 1 U 0.128E+08 0.000E+00 e 0 0 0 0
1132 63.994 3.840 3.840 1 U 0.177E+10 0.000E+00 e 0 0 0 0
1133 63.994 1.922 3.840 1 U 0.205E+08 0.000E+00 e 0 0 0 0
1134 63.994 1.038 3.840 1 U 0.338E+08 0.000E+00 e 0 0 0 0
1135 63.994 1.365 3.840 1 U 0.301E+08 0.000E+00 e 0 0 0 0
1136 63.994 0.833 3.840 1 U 0.892E+08 0.000E+00 e 0 0 0 0
1137 63.994 0.780 3.840 1 U 0.573E+08 0.000E+00 e 0 0 0 0
1138 63.994 8.900 3.840 1 U 0.633E+07 0.000E+00 e 0 0 0 0
1139 38.510 3.840 1.922 1 U 0.141E+08 0.000E+00 e 0 0 0 0
1140 38.510 1.922 1.922 1 U 0.195E+09 0.000E+00 e 0 0 0 0
1141 38.510 1.038 1.922 1 U 0.154E+08 0.000E+00 e 0 0 0 0
1142 38.510 1.365 1.922 1 U 0.176E+08 0.000E+00 e 0 0 0 0
1143 38.510 0.833 1.922 1 U 0.719E+08 0.000E+00 e 0 0 0 0
1144 38.510 0.780 1.922 1 U 0.566E+08 0.000E+00 e 0 0 0 0
1145 38.510 8.900 1.922 1 U 0.307E+08 0.000E+00 e 0 0 0 0
1146 28.334 3.840 1.038 1 U 0.180E+08 0.000E+00 e 0 0 0 0
1147 28.334 1.922 1.038 1 U 0.126E+08 0.000E+00 e 0 0 0 0
1148 28.334 1.038 1.038 1 U 0.222E+09 0.000E+00 e 0 0 0 0
1149 28.334 1.365 1.038 1 U 0.102E+09 0.000E+00 e 0 0 0 0
1150 28.334 0.833 1.038 1 U 0.617E+08 0.000E+00 e 0 0 0 0
1151 28.334 0.780 1.038 1 U 0.602E+08 0.000E+00 e 0 0 0 0
1152 28.334 3.840 1.365 1 U 0.215E+08 0.000E+00 e 0 0 0 0
1153 28.334 1.922 1.365 1 U 0.173E+08 0.000E+00 e 0 0 0 0
1154 28.334 1.038 1.365 1 U 0.109E+09 0.000E+00 e 0 0 0 0
1155 28.334 1.365 1.365 1 U 0.305E+09 0.000E+00 e 0 0 0 0
1156 28.334 0.833 1.365 1 U 0.557E+08 0.000E+00 e 0 0 0 0
1157 28.334 0.780 1.365 1 U 0.533E+08 0.000E+00 e 0 0 0 0
1158 28.334 8.900 1.365 1 U 0.645E+07 0.000E+00 e 0 0 0 0
1159 18.403 3.840 0.833 1 U 0.109E+09 0.000E+00 e 0 0 0 0
1160 18.403 1.922 0.833 1 U 0.130E+09 0.000E+00 e 0 0 0 0
1161 18.403 1.038 0.833 1 U 0.189E+09 0.000E+00 e 0 0 0 0
1162 18.403 1.365 0.833 1 U 0.932E+08 0.000E+00 e 0 0 0 0
1163 18.403 0.833 0.833 1 U 0.561E+10 0.000E+00 e 0 0 0 0
1164 18.403 0.780 0.833 1 U 0.307E+10 0.000E+00 e 0 0 0 0
1165 18.403 8.900 0.833 1 U 0.319E+08 0.000E+00 e 0 0 0 0
1166 14.159 3.840 0.780 1 U 0.302E+08 0.000E+00 e 0 0 0 0
1167 14.159 1.922 0.780 1 U 0.712E+08 0.000E+00 e 0 0 0 0
1168 14.159 1.038 0.780 1 U 0.135E+09 0.000E+00 e 0 0 0 0
1169 14.159 1.365 0.780 1 U 0.104E+09 0.000E+00 e 0 0 0 0
1170 14.159 0.833 0.780 1 U 0.190E+10 0.000E+00 e 0 0 0 0
1171 14.159 0.780 0.780 1 U 0.377E+10 0.000E+00 e 0 0 0 0
1172 14.159 8.900 0.780 1 U 0.141E+08 0.000E+00 e 0 0 0 0
1173 57.724 4.791 4.791 1 U 0.378E+09 0.000E+00 e 0 0 0 0
1174 57.724 3.577 4.803 1 U 0.289E+08 0.000E+00 e 0 0 0 0
1175 57.724 3.740 4.801 1 U 0.147E+08 0.000E+00 e 0 0 0 0
1176 66.394 4.791 3.574 1 U 0.396E+08 0.000E+00 e 0 0 0 0
1177 66.394 3.574 3.574 1 U 0.141E+09 0.000E+00 e 0 0 0 0
1178 66.394 3.737 3.574 1 U 0.122E+09 0.000E+00 e 0 0 0 0
1179 66.394 8.578 3.574 1 U 0.114E+08 0.000E+00 e 0 0 0 0
1180 66.394 4.791 3.737 1 U 0.397E+08 0.000E+00 e 0 0 0 0
1181 66.394 3.574 3.737 1 U 0.129E+09 0.000E+00 e 0 0 0 0
1182 66.394 3.737 3.737 1 U 0.195E+09 0.000E+00 e 0 0 0 0
1183 66.394 8.578 3.737 1 U 0.130E+08 0.000E+00 e 0 0 0 0
1184 58.655 4.960 4.960 1 U 0.839E+09 0.000E+00 e 0 0 0 0
1185 58.655 3.916 4.960 1 U 0.277E+08 0.000E+00 e 0 0 0 0
1186 58.655 0.936 4.960 1 U 0.240E+08 0.000E+00 e 0 0 0 0
1187 58.655 8.566 4.960 1 U 0.409E+08 0.000E+00 e 0 0 0 0
1188 72.837 4.960 3.916 1 U 0.249E+08 0.000E+00 e 0 0 0 0
1189 72.837 3.916 3.916 1 U 0.138E+09 0.000E+00 e 0 0 0 0
1190 72.837 0.936 3.916 1 U 0.347E+08 0.000E+00 e 0 0 0 0
1191 72.837 8.566 3.916 1 U 0.231E+08 0.000E+00 e 0 0 0 0
1192 21.880 4.960 0.936 1 U 0.373E+08 0.000E+00 e 0 0 0 0
1193 21.880 3.916 0.936 1 U 0.446E+08 0.000E+00 e 0 0 0 0
1194 21.880 0.936 0.936 1 U 0.103E+10 0.000E+00 e 0 0 0 0
1195 21.880 8.566 0.936 1 U 0.946E+07 0.000E+00 e 0 0 0 0
1196 45.171 3.941 3.941 1 U 0.200E+10 0.000E+00 e 0 0 0 0
1197 55.691 4.213 4.213 1 U 0.957E+09 0.000E+00 e 0 0 0 0
1198 55.691 1.570 4.213 1 U 0.696E+08 0.000E+00 e 0 0 0 0
1199 55.691 1.472 4.213 1 U 0.381E+08 0.000E+00 e 0 0 0 0
1200 55.691 0.780 4.213 1 U 0.597E+08 0.000E+00 e 0 0 0 0
1201 55.691 0.840 4.213 1 U 0.504E+08 0.000E+00 e 0 0 0 0
1202 55.691 8.046 4.212 1 U 0.105E+08 0.000E+00 e 0 0 0 0
1203 42.374 4.213 1.570 1 U 0.248E+08 0.000E+00 e 0 0 0 0
1204 42.374 1.570 1.570 1 U 0.312E+10 0.000E+00 e 0 0 0 0
1205 42.374 1.472 1.570 1 U 0.259E+09 0.000E+00 e 0 0 0 0
1206 42.374 0.780 1.570 1 U 0.805E+08 0.000E+00 e 0 0 0 0
1207 42.374 0.840 1.570 1 U 0.932E+08 0.000E+00 e 0 0 0 0
1208 42.374 8.043 1.569 1 U 0.690E+07 0.000E+00 e 0 0 0 0
1209 27.004 4.213 1.472 1 U 0.433E+07 0.000E+00 e 0 0 0 0
1210 24.922 4.213 0.780 1 U 0.919E+07 0.000E+00 e 0 0 0 0
1211 52.892 4.277 4.277 1 U 0.140E+10 0.000E+00 e 0 0 0 0
1212 52.892 1.363 4.277 1 U 0.166E+09 0.000E+00 e 0 0 0 0
1213 52.892 8.034 4.277 1 U 0.961E+07 0.000E+00 e 0 0 0 0
1214 19.159 4.277 1.363 1 U 0.193E+09 0.000E+00 e 0 0 0 0
1215 19.159 8.034 1.363 1 U 0.758E+07 0.000E+00 e 0 0 0 0
1216 58.548 4.800 4.800 1 U 0.519E+09 0.000E+00 e 0 0 0 0
1217 58.548 2.245 4.800 1 U 0.335E+08 0.000E+00 e 0 0 0 0
1218 58.548 0.880 4.800 1 U 0.465E+08 0.000E+00 e 0 0 0 0
1219 58.548 0.685 4.800 1 U 0.187E+08 0.000E+00 e 0 0 0 0
1220 58.548 8.321 4.800 1 U 0.448E+08 0.000E+00 e 0 0 0 0
1221 36.422 4.800 2.245 1 U 0.381E+08 0.000E+00 e 0 0 0 0
1222 36.422 2.245 2.245 1 U 0.111E+10 0.000E+00 e 0 0 0 0
1223 36.422 0.880 2.245 1 U 0.535E+08 0.000E+00 e 0 0 0 0
1224 36.422 0.685 2.245 1 U 0.428E+08 0.000E+00 e 0 0 0 0
1225 36.422 8.321 2.245 1 U 0.281E+08 0.000E+00 e 0 0 0 0
1226 21.960 4.800 0.880 1 U 0.722E+08 0.000E+00 e 0 0 0 0
1227 21.960 2.245 0.880 1 U 0.933E+08 0.000E+00 e 0 0 0 0
1228 21.960 0.880 0.880 1 U 0.369E+10 0.000E+00 e 0 0 0 0
1229 21.960 0.685 0.880 1 U 0.194E+09 0.000E+00 e 0 0 0 0
1230 21.960 8.321 0.880 1 U 0.213E+08 0.000E+00 e 0 0 0 0
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1499 26.777 0.643 1.183 1 U 0.910E+07 0.000E+00 e 0 0 0 0
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1514 55.510 0.792 4.304 1 U 0.457E+08 0.000E+00 e 0 0 0 0
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1545 39.009 3.294 2.742 1 U 0.758E+08 0.000E+00 e 0 0 0 0
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1551 58.000 1.898 4.117 1 U 0.178E+08 0.000E+00 e 0 0 0 0
1552 58.000 1.961 4.117 1 U 0.133E+08 0.000E+00 e 0 0 0 0
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1564 35.972 1.785 1.961 1 U 0.991E+08 0.000E+00 e 0 0 0 0
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1728 30.198 1.955 2.035 1 U 0.228E+09 0.000E+00 e 0 0 0 0
1729 30.198 2.035 2.035 1 U 0.377E+09 0.000E+00 e 0 0 0 0
1730 30.198 2.183 2.035 1 U 0.485E+08 0.000E+00 e 0 0 0 0
1731 30.198 2.264 2.035 1 U 0.201E+08 0.000E+00 e 0 0 0 0
1732 30.198 7.995 2.035 1 U 0.533E+07 0.000E+00 e 0 0 0 0
1733 36.450 4.210 2.183 1 U 0.150E+08 0.000E+00 e 0 0 0 0
1734 36.450 1.955 2.183 1 U 0.548E+08 0.000E+00 e 0 0 0 0
1735 36.450 2.035 2.183 1 U 0.860E+08 0.000E+00 e 0 0 0 0
1736 36.450 2.183 2.183 1 U 0.759E+09 0.000E+00 e 0 0 0 0
1737 36.450 2.264 2.183 1 U 0.470E+09 0.000E+00 e 0 0 0 0
1738 36.450 4.210 2.264 1 U 0.174E+08 0.000E+00 e 0 0 0 0
1739 36.450 1.955 2.264 1 U 0.739E+08 0.000E+00 e 0 0 0 0
1740 36.450 2.035 2.264 1 U 0.922E+08 0.000E+00 e 0 0 0 0
1741 36.450 2.183 2.264 1 U 0.747E+09 0.000E+00 e 0 0 0 0
1742 36.450 2.264 2.264 1 U 0.139E+10 0.000E+00 e 0 0 0 0
1743 61.038 4.167 4.167 1 U 0.139E+10 0.000E+00 e 0 0 0 0
1744 61.038 1.812 4.167 1 U 0.273E+08 0.000E+00 e 0 0 0 0
1745 61.038 1.128 4.167 1 U 0.216E+08 0.000E+00 e 0 0 0 0
1746 61.038 1.415 4.167 1 U 0.929E+07 0.000E+00 e 0 0 0 0
1747 61.038 0.854 4.167 1 U 0.385E+08 0.000E+00 e 0 0 0 0
1748 61.038 0.802 4.167 1 U 0.355E+08 0.000E+00 e 0 0 0 0
1749 61.038 8.342 4.167 1 U 0.146E+08 0.000E+00 e 0 0 0 0
1750 38.927 4.167 1.812 1 U 0.127E+08 0.000E+00 e 0 0 0 0
1751 38.927 1.812 1.812 1 U 0.545E+09 0.000E+00 e 0 0 0 0
1752 38.927 1.128 1.812 1 U 0.680E+07 0.000E+00 e 0 0 0 0
1753 38.927 1.415 1.812 1 U 0.155E+08 0.000E+00 e 0 0 0 0
1754 38.927 0.854 1.812 1 U 0.513E+08 0.000E+00 e 0 0 0 0
1755 38.927 0.802 1.812 1 U 0.337E+08 0.000E+00 e 0 0 0 0
1756 38.927 8.342 1.812 1 U 0.479E+07 0.000E+00 e 0 0 0 0
1757 27.256 4.167 1.128 1 U 0.685E+07 0.000E+00 e 0 0 0 0
1758 27.256 1.812 1.128 1 U 0.995E+07 0.000E+00 e 0 0 0 0
1759 27.256 1.128 1.128 1 U 0.517E+09 0.000E+00 e 0 0 0 0
1760 27.256 1.415 1.128 1 U 0.114E+09 0.000E+00 e 0 0 0 0
1761 27.256 0.854 1.128 1 U 0.320E+08 0.000E+00 e 0 0 0 0
1762 27.256 0.802 1.128 1 U 0.352E+08 0.000E+00 e 0 0 0 0
1763 27.256 8.342 1.128 1 U 0.440E+07 0.000E+00 e 0 0 0 0
1764 27.256 4.167 1.415 1 U 0.118E+08 0.000E+00 e 0 0 0 0
1765 27.256 1.812 1.415 1 U 0.301E+08 0.000E+00 e 0 0 0 0
1766 27.256 1.128 1.415 1 U 0.146E+09 0.000E+00 e 0 0 0 0
1767 27.256 1.415 1.415 1 U 0.101E+10 0.000E+00 e 0 0 0 0
1768 27.256 0.854 1.415 1 U 0.330E+08 0.000E+00 e 0 0 0 0
1769 27.256 0.802 1.415 1 U 0.460E+08 0.000E+00 e 0 0 0 0
1770 17.583 4.167 0.854 1 U 0.379E+08 0.000E+00 e 0 0 0 0
1771 17.583 1.812 0.854 1 U 0.918E+08 0.000E+00 e 0 0 0 0
1772 17.583 1.128 0.854 1 U 0.381E+08 0.000E+00 e 0 0 0 0
1773 17.583 1.415 0.854 1 U 0.381E+08 0.000E+00 e 0 0 0 0
1774 17.583 0.854 0.854 1 U 0.526E+10 0.000E+00 e 0 0 0 0
1775 17.583 0.802 0.854 1 U 0.237E+10 0.000E+00 e 0 0 0 0
1776 13.013 4.167 0.802 1 U 0.960E+07 0.000E+00 e 0 0 0 0
1777 13.013 1.812 0.802 1 U 0.217E+08 0.000E+00 e 0 0 0 0
1778 13.013 1.128 0.802 1 U 0.436E+08 0.000E+00 e 0 0 0 0
1779 13.013 1.415 0.802 1 U 0.539E+08 0.000E+00 e 0 0 0 0
1780 13.013 0.854 0.802 1 U 0.121E+10 0.000E+00 e 0 0 0 0
1781 13.013 0.802 0.802 1 U 0.385E+10 0.000E+00 e 0 0 0 0
1782 53.376 4.693 4.693 1 U 0.545E+09 0.000E+00 e 0 0 0 0
1783 53.376 2.756 4.693 1 U 0.340E+08 0.000E+00 e 0 0 0 0
1784 53.376 2.938 4.693 1 U 0.399E+08 0.000E+00 e 0 0 0 0
1785 53.376 8.070 4.693 1 U 0.861E+07 0.000E+00 e 0 0 0 0
1786 38.394 4.693 2.756 1 U 0.277E+08 0.000E+00 e 0 0 0 0
1787 38.394 2.756 2.756 1 U 0.568E+09 0.000E+00 e 0 0 0 0
1788 38.394 2.938 2.756 1 U 0.202E+09 0.000E+00 e 0 0 0 0
1789 38.394 4.693 2.938 1 U 0.416E+08 0.000E+00 e 0 0 0 0
1790 38.394 2.756 2.938 1 U 0.189E+09 0.000E+00 e 0 0 0 0
1791 38.394 2.938 2.938 1 U 0.723E+09 0.000E+00 e 0 0 0 0
1792 44.811 3.722 3.722 1 U 0.320E+10 0.000E+00 e 0 0 0 0
1793 44.811 4.443 3.722 1 U 0.402E+08 0.000E+00 e 0 0 0 0
1794 44.811 8.680 3.729 1 U 0.625E+07 0.000E+00 e 0 0 0 0
1795 44.811 3.722 4.443 1 U 0.220E+08 0.000E+00 e 0 0 0 0
1796 44.811 4.443 4.443 1 U 0.777E+08 0.000E+00 e 0 0 0 0
1797 62.789 3.765 3.765 1 U 0.570E+09 0.000E+00 e 0 0 0 0
1798 62.789 1.679 3.765 1 U 0.505E+08 0.000E+00 e 0 0 0 0
1799 62.789 1.112 3.765 1 U 0.885E+07 0.000E+00 e 0 0 0 0
1800 62.789 1.388 3.765 1 U 0.166E+08 0.000E+00 e 0 0 0 0
1801 62.789 0.831 3.765 1 U 0.616E+08 0.000E+00 e 0 0 0 0
1802 62.789 0.880 3.765 1 U 0.524E+08 0.000E+00 e 0 0 0 0
1803 38.927 3.765 1.679 1 U 0.236E+08 0.000E+00 e 0 0 0 0
1804 38.927 1.679 1.679 1 U 0.742E+09 0.000E+00 e 0 0 0 0
1805 38.927 1.112 1.679 1 U 0.179E+08 0.000E+00 e 0 0 0 0
1806 38.927 1.388 1.679 1 U 0.267E+08 0.000E+00 e 0 0 0 0
1807 38.927 0.831 1.679 1 U 0.527E+08 0.000E+00 e 0 0 0 0
1808 38.927 0.880 1.679 1 U 0.373E+08 0.000E+00 e 0 0 0 0
1809 28.050 3.765 1.112 1 U 0.705E+07 0.000E+00 e 0 0 0 0
1810 28.050 1.679 1.112 1 U 0.159E+08 0.000E+00 e 0 0 0 0
1811 28.050 1.112 1.112 1 U 0.290E+09 0.000E+00 e 0 0 0 0
1812 28.050 1.388 1.112 1 U 0.905E+08 0.000E+00 e 0 0 0 0
1813 28.050 0.831 1.112 1 U 0.477E+08 0.000E+00 e 0 0 0 0
1814 28.050 0.880 1.112 1 U 0.570E+08 0.000E+00 e 0 0 0 0
1815 28.050 3.765 1.388 1 U 0.116E+08 0.000E+00 e 0 0 0 0
1816 28.050 1.679 1.388 1 U 0.327E+08 0.000E+00 e 0 0 0 0
1817 28.050 1.112 1.388 1 U 0.104E+09 0.000E+00 e 0 0 0 0
1818 28.050 1.388 1.388 1 U 0.433E+09 0.000E+00 e 0 0 0 0
1819 28.050 0.831 1.388 1 U 0.574E+08 0.000E+00 e 0 0 0 0
1820 28.050 0.880 1.388 1 U 0.477E+08 0.000E+00 e 0 0 0 0
1821 18.185 3.765 0.831 1 U 0.471E+08 0.000E+00 e 0 0 0 0
1822 18.185 1.679 0.831 1 U 0.109E+09 0.000E+00 e 0 0 0 0
1823 18.185 1.112 0.831 1 U 0.113E+09 0.000E+00 e 0 0 0 0
1824 18.185 1.388 0.831 1 U 0.855E+08 0.000E+00 e 0 0 0 0
1825 18.185 0.831 0.831 1 U 0.553E+10 0.000E+00 e 0 0 0 0
1826 18.185 0.880 0.831 1 U 0.261E+10 0.000E+00 e 0 0 0 0
1827 13.943 3.765 0.880 1 U 0.239E+08 0.000E+00 e 0 0 0 0
1828 13.943 1.679 0.880 1 U 0.433E+08 0.000E+00 e 0 0 0 0
1829 13.943 1.112 0.880 1 U 0.125E+09 0.000E+00 e 0 0 0 0
1830 13.943 1.388 0.880 1 U 0.682E+08 0.000E+00 e 0 0 0 0
1831 13.943 0.831 0.880 1 U 0.149E+10 0.000E+00 e 0 0 0 0
1832 13.943 0.880 0.880 1 U 0.323E+10 0.000E+00 e 0 0 0 0
1833 63.117 4.449 4.449 1 U 0.342E+09 0.000E+00 e 0 0 0 0
1834 63.117 1.927 4.449 1 U 0.198E+08 0.000E+00 e 0 0 0 0
1835 63.117 2.414 4.449 1 U 0.325E+08 0.000E+00 e 0 0 0 0
1836 63.117 2.037 4.449 1 U 0.196E+08 0.000E+00 e 0 0 0 0
1837 63.117 3.554 4.449 1 U 0.758E+07 0.000E+00 e 0 0 0 0
1838 63.117 3.882 4.449 1 U 0.124E+08 0.000E+00 e 0 0 0 0
1839 32.305 4.449 1.927 1 U 0.184E+08 0.000E+00 e 0 0 0 0
1840 32.305 1.927 1.927 1 U 0.807E+09 0.000E+00 e 0 0 0 0
1841 32.305 2.414 1.927 1 U 0.104E+09 0.000E+00 e 0 0 0 0
1842 32.305 2.037 1.927 1 U 0.183E+09 0.000E+00 e 0 0 0 0
1843 32.305 3.554 1.927 1 U 0.123E+08 0.000E+00 e 0 0 0 0
1844 32.305 3.882 1.927 1 U 0.130E+08 0.000E+00 e 0 0 0 0
1845 32.305 4.449 2.414 1 U 0.349E+08 0.000E+00 e 0 0 0 0
1846 32.305 1.927 2.414 1 U 0.155E+09 0.000E+00 e 0 0 0 0
1847 32.305 2.414 2.414 1 U 0.108E+10 0.000E+00 e 0 0 0 0
1848 32.305 2.037 2.414 1 U 0.800E+08 0.000E+00 e 0 0 0 0
1849 32.305 3.554 2.414 1 U 0.661E+07 0.000E+00 e 0 0 0 0
1850 32.305 3.882 2.414 1 U 0.615E+07 0.000E+00 e 0 0 0 0
1851 27.954 4.449 2.037 1 U 0.858E+07 0.000E+00 e 0 0 0 0
1852 27.954 1.927 2.037 1 U 0.100E+09 0.000E+00 e 0 0 0 0
1853 27.954 2.414 2.037 1 U 0.449E+08 0.000E+00 e 0 0 0 0
1854 27.954 2.037 2.037 1 U 0.820E+09 0.000E+00 e 0 0 0 0
1855 27.954 3.554 2.037 1 U 0.304E+08 0.000E+00 e 0 0 0 0
1856 27.954 3.882 2.037 1 U 0.322E+08 0.000E+00 e 0 0 0 0
1857 50.681 4.449 3.554 1 U 0.532E+07 0.000E+00 e 0 0 0 0
1858 50.681 1.927 3.554 1 U 0.506E+08 0.000E+00 e 0 0 0 0
1859 50.681 2.414 3.554 1 U 0.102E+08 0.000E+00 e 0 0 0 0
1860 50.681 2.037 3.554 1 U 0.601E+08 0.000E+00 e 0 0 0 0
1861 50.681 3.554 3.554 1 U 0.291E+09 0.000E+00 e 0 0 0 0
1862 50.681 3.882 3.554 1 U 0.151E+09 0.000E+00 e 0 0 0 0
1863 50.681 4.449 3.882 1 U 0.643E+07 0.000E+00 e 0 0 0 0
1864 50.681 1.927 3.882 1 U 0.302E+08 0.000E+00 e 0 0 0 0
1865 50.681 2.414 3.882 1 U 0.501E+07 0.000E+00 e 0 0 0 0
1866 50.681 2.037 3.882 1 U 0.518E+08 0.000E+00 e 0 0 0 0
1867 50.681 3.554 3.882 1 U 0.141E+09 0.000E+00 e 0 0 0 0
1868 50.681 3.882 3.882 1 U 0.215E+09 0.000E+00 e 0 0 0 0
1869 50.681 8.604 3.882 1 U 0.535E+07 0.000E+00 e 0 0 0 0
1870 58.602 4.025 4.025 1 U 0.276E+09 0.000E+00 e 0 0 0 0
1871 58.602 1.976 4.025 1 U 0.285E+08 0.000E+00 e 0 0 0 0
1872 58.602 2.131 4.025 1 U 0.111E+08 0.000E+00 e 0 0 0 0
1873 58.602 2.279 4.025 1 U 0.521E+07 0.000E+00 e 0 0 0 0
1874 30.034 4.025 1.976 1 U 0.470E+08 0.000E+00 e 0 0 0 0
1875 30.034 1.976 1.976 1 U 0.110E+10 0.000E+00 e 0 0 0 0
1876 30.034 2.131 1.976 1 U 0.169E+09 0.000E+00 e 0 0 0 0
1877 30.034 2.279 1.976 1 U 0.616E+08 0.000E+00 e 0 0 0 0
1878 36.423 4.025 2.131 1 U 0.161E+08 0.000E+00 e 0 0 0 0
1879 36.423 1.976 2.131 1 U 0.157E+09 0.000E+00 e 0 0 0 0
1880 36.423 2.131 2.131 1 U 0.791E+09 0.000E+00 e 0 0 0 0
1881 36.423 2.279 2.131 1 U 0.104E+09 0.000E+00 e 0 0 0 0
1882 36.423 4.025 2.279 1 U 0.135E+08 0.000E+00 e 0 0 0 0
1883 36.423 1.976 2.279 1 U 0.748E+08 0.000E+00 e 0 0 0 0
1884 36.423 2.131 2.279 1 U 0.168E+09 0.000E+00 e 0 0 0 0
1885 36.423 2.279 2.279 1 U 0.923E+09 0.000E+00 e 0 0 0 0
1886 57.645 4.115 4.115 1 U 0.400E+10 0.000E+00 e 0 0 0 0
1887 57.645 1.894 4.115 1 U 0.211E+08 0.000E+00 e 0 0 0 0
1888 57.645 2.099 4.115 1 U 0.200E+08 0.000E+00 e 0 0 0 0
1889 57.645 2.268 4.115 1 U 0.103E+08 0.000E+00 e 0 0 0 0
1890 30.349 4.115 1.894 1 U 0.467E+07 0.000E+00 e 0 0 0 0
1891 30.349 1.894 1.894 1 U 0.271E+10 0.000E+00 e 0 0 0 0
1892 30.349 2.099 1.894 1 U 0.547E+08 0.000E+00 e 0 0 0 0
1893 30.349 2.268 1.894 1 U 0.299E+08 0.000E+00 e 0 0 0 0
1894 30.349 4.115 2.099 1 U 0.158E+08 0.000E+00 e 0 0 0 0
1895 30.349 2.099 2.099 1 U 0.294E+10 0.000E+00 e 0 0 0 0
1896 30.349 2.268 2.099 1 U 0.446E+09 0.000E+00 e 0 0 0 0
1897 34.521 4.115 2.268 1 U 0.109E+08 0.000E+00 e 0 0 0 0
1898 34.521 1.894 2.268 1 U 0.170E+08 0.000E+00 e 0 0 0 0
1899 34.521 2.099 2.268 1 U 0.534E+09 0.000E+00 e 0 0 0 0
1900 34.521 2.268 2.268 1 U 0.811E+10 0.000E+00 e 0 0 0 0
1901 57.226 4.696 4.147 1 U 0.142E+08 0.000E+00 e 0 0 0 0
1902 38.394 6.917 2.931 1 U 0.813E+07 0.000E+00 e 0 0 0 0
1903 21.814 4.625 0.997 1 U 0.127E+08 0.000E+00 e 0 0 0 0
1904 53.376 2.094 4.693 1 U 0.123E+08 0.000E+00 e 0 0 0 0
1905 70.326 3.910 3.753 1 U 0.195E+08 0.000E+00 e 0 0 0 0
1906 70.326 1.009 3.754 1 U 0.803E+07 0.000E+00 e 0 0 0 0
1907 21.880 0.997 1.130 1 U 0.151E+09 0.000E+00 e 0 0 0 0
1908 58.548 1.009 4.800 1 U 0.200E+08 0.000E+00 e 0 0 0 0
1909 60.372 4.611 5.035 1 U 0.948E+07 0.000E+00 e 0 0 0 0
1910 71.119 4.593 3.928 1 U 0.643E+07 0.000E+00 e 0 0 0 0
1911 43.081 2.574 3.125 1 U 0.754E+07 0.000E+00 e 0 0 0 0
1912 62.355 2.595 5.220 1 U 0.632E+07 0.000E+00 e 0 0 0 0
1913 53.143 5.071 5.471 1 U 0.717E+07 0.000E+00 e 0 0 0 0
1914 72.837 5.062 3.909 1 U 0.792E+07 0.000E+00 e 0 0 0 0
1915 58.655 0.517 4.960 1 U 0.638E+07 0.000E+00 e 0 0 0 0
1916 53.143 1.479 5.475 1 U 0.461E+07 0.000E+00 e 0 0 0 0
1917 16.930 1.446 2.007 1 U 0.221E+08 0.000E+00 e 0 0 0 0
1918 72.837 1.470 3.907 1 U 0.114E+08 0.000E+00 e 0 0 0 0
1919 21.880 0.691 0.932 1 U 0.245E+08 0.000E+00 e 0 0 0 0
1920 14.876 4.809 0.514 1 U 0.115E+08 0.000E+00 e 0 0 0 0
1921 22.563 1.223 1.423 1 U 0.285E+08 0.000E+00 e 0 0 0 0
1922 30.692 0.815 1.728 1 U 0.648E+07 0.000E+00 e 0 0 0 0
1923 53.062 4.408 4.833 1 U 0.791E+07 0.000E+00 e 0 0 0 0
1924 54.868 4.361 4.625 1 U 0.665E+07 0.000E+00 e 0 0 0 0
1925 38.715 4.402 2.779 1 U 0.723E+07 0.000E+00 e 0 0 0 0
1926 58.594 2.634 4.944 1 U 0.425E+08 0.000E+00 e 0 0 0 0
1927 44.137 3.251 3.511 1 U 0.584E+07 0.000E+00 e 0 0 0 0
1928 58.655 3.245 4.954 1 U 0.531E+08 0.000E+00 e 0 0 0 0
1929 58.536 4.616 4.393 1 U 0.162E+08 0.000E+00 e 0 0 0 0
1930 56.659 4.622 4.946 1 U 0.844E+07 0.000E+00 e 0 0 0 0
1931 22.563 4.625 1.420 1 U 0.578E+08 0.000E+00 e 0 0 0 0
1932 56.659 2.609 4.948 1 U 0.245E+08 0.000E+00 e 0 0 0 0
1933 31.964 9.347 3.205 1 U 0.789E+07 0.000E+00 e 0 0 0 0
1934 33.413 2.662 3.259 1 U 0.601E+08 0.000E+00 e 0 0 0 0
1935 33.413 3.231 2.634 1 U 0.344E+08 0.000E+00 e 0 0 0 0
1936 23.801 9.253 0.720 1 U 0.716E+07 0.000E+00 e 0 0 0 0
1937 33.413 4.770 3.260 1 U 0.114E+08 0.000E+00 e 0 0 0 0
1938 44.137 4.752 4.216 1 U 0.757E+07 0.000E+00 e 0 0 0 0
1939 21.814 3.765 1.018 1 U 0.912E+07 0.000E+00 e 0 0 0 0
1940 58.548 3.747 4.800 1 U 0.339E+08 0.000E+00 e 0 0 0 0
1941 21.960 1.124 0.868 1 U 0.455E+08 0.000E+00 e 0 0 0 0
1942 21.880 4.782 1.130 1 U 0.373E+08 0.000E+00 e 0 0 0 0
1943 21.880 0.880 1.127 1 U 0.485E+08 0.000E+00 e 0 0 0 0
1944 71.119 9.044 3.929 1 U 0.832E+07 0.000E+00 e 0 0 0 0
1945 21.814 9.012 1.008 1 U 0.689E+07 0.000E+00 e 0 0 0 0
1946 29.256 7.700 2.043 1 U 0.768E+07 0.000E+00 e 0 0 0 0
1947 16.930 4.436 2.000 1 U 0.246E+08 0.000E+00 e 0 0 0 0
1948 32.763 4.451 2.428 1 U 0.225E+08 0.000E+00 e 0 0 0 0
1949 22.204 7.038 0.863 1 U 0.124E+08 0.000E+00 e 0 0 0 0
1950 20.599 7.050 0.867 1 U 0.185E+08 0.000E+00 e 0 0 0 0
1951 21.814 8.694 1.009 1 U 0.738E+07 0.000E+00 e 0 0 0 0
1952 19.238 8.691 0.689 1 U 0.773E+07 0.000E+00 e 0 0 0 0
1953 62.789 4.105 3.765 1 U 0.807E+07 0.000E+00 e 0 0 0 0
1954 45.072 4.509 4.294 1 U 0.777E+07 0.000E+00 e 0 0 0 0
1955 16.930 1.855 2.013 1 U 0.498E+09 0.000E+00 e 0 0 0 0
1956 40.103 2.009 2.903 1 U 0.732E+07 0.000E+00 e 0 0 0 0
1957 35.274 1.991 1.664 1 U 0.980E+07 0.000E+00 e 0 0 0 0
1958 35.274 2.000 1.861 1 U 0.169E+08 0.000E+00 e 0 0 0 0
1959 32.763 2.000 2.524 1 U 0.156E+08 0.000E+00 e 0 0 0 0
1960 58.856 2.445 4.446 1 U 0.825E+07 0.000E+00 e 0 0 0 0
1961 16.930 2.524 2.000 1 U 0.801E+08 0.000E+00 e 0 0 0 0
1962 14.159 1.896 0.783 1 U 0.595E+08 0.000E+00 e 0 0 0 0
1963 28.334 1.890 1.035 1 U 0.113E+08 0.000E+00 e 0 0 0 0
1964 58.751 1.910 4.966 1 U 0.107E+08 0.000E+00 e 0 0 0 0
1965 57.850 3.839 4.018 1 U 0.172E+08 0.000E+00 e 0 0 0 0
1966 18.403 7.225 0.834 1 U 0.946E+07 0.000E+00 e 0 0 0 0
1967 58.137 4.609 4.396 1 U 0.208E+08 0.000E+00 e 0 0 0 0
1968 21.880 4.986 0.936 1 U 0.345E+08 0.000E+00 e 0 0 0 0
1969 33.413 4.931 3.260 1 U 0.631E+07 0.000E+00 e 0 0 0 0
1970 22.563 4.969 1.426 1 U 0.144E+08 0.000E+00 e 0 0 0 0
1971 59.262 3.916 5.062 1 U 0.441E+07 0.000E+00 e 0 0 0 0
1972 51.077 3.937 4.695 1 U 0.649E+07 0.000E+00 e 0 0 0 0
1973 18.969 0.904 0.691 1 U 0.337E+09 0.000E+00 e 0 0 0 0
1974 45.387 8.513 1.235 1 U 0.618E+07 0.000E+00 e 0 0 0 0
1975 59.262 8.922 5.065 1 U 0.303E+08 0.000E+00 e 0 0 0 0
1976 18.969 8.878 0.685 1 U 0.240E+08 0.000E+00 e 0 0 0 0
1977 21.880 8.287 1.118 1 U 0.615E+07 0.000E+00 e 0 0 0 0
1978 55.866 2.075 4.462 1 U 0.393E+08 0.000E+00 e 0 0 0 0
1979 19.759 0.835 1.217 1 U 0.274E+08 0.000E+00 e 0 0 0 0
1980 21.880 8.332 1.120 1 U 0.584E+07 0.000E+00 e 0 0 0 0
1981 19.759 1.443 1.213 1 U 0.563E+08 0.000E+00 e 0 0 0 0
1982 23.801 3.245 0.726 1 U 0.616E+07 0.000E+00 e 0 0 0 0
1983 32.276 8.419 1.820 1 U 0.815E+07 0.000E+00 e 0 0 0 0
1984 14.159 8.366 0.780 1 U 0.700E+07 0.000E+00 e 0 0 0 0
1985 14.159 4.782 0.789 1 U 0.130E+08 0.000E+00 e 0 0 0 0
1986 22.204 1.216 0.867 1 U 0.360E+08 0.000E+00 e 0 0 0 0
# Number of dimensions 3
#FORMAT xeasy3D
#INAME 1 H
#INAME 2 C
#INAME 3 HC
#CYANAFORMAT hCH
1 7.198 124.334 7.197 1 U 0.119E+09 0.000E+00 e 0 0 0 0
2 10.349 124.334 7.197 1 U 0.629E+07 0.000E+00 e 0 0 0 0
3 4.604 124.334 7.200 1 U 0.544E+07 0.000E+00 e 0 0 0 0
4 4.548 124.334 7.199 1 U 0.504E+07 0.000E+00 e 0 0 0 0
5 3.375 124.334 7.198 1 U 0.272E+07 0.000E+00 e 0 0 0 0
6 3.433 124.334 7.199 1 U 0.278E+07 0.000E+00 e 0 0 0 0
7 0.852 124.334 7.193 1 U 0.321E+07 0.000E+00 e 0 0 0 0
8 10.336 112.103 7.503 1 U 0.261E+07 0.000E+00 e 0 0 0 0
9 7.212 112.103 7.500 1 U 0.740E+07 0.000E+00 e 0 0 0 0
10 7.523 112.103 7.499 1 U 0.636E+08 0.000E+00 e 0 0 0 0
11 7.482 112.103 7.499 1 U 0.715E+08 0.000E+00 e 0 0 0 0
12 0.855 112.103 7.496 1 U 0.398E+07 0.000E+00 e 0 0 0 0
13 1.670 112.103 7.505 1 U 0.490E+07 0.000E+00 e 0 0 0 0
14 1.785 112.103 7.507 1 U 0.301E+07 0.000E+00 e 0 0 0 0
15 7.094 118.525 7.521 1 U 0.461E+07 0.000E+00 e 0 0 0 0
16 7.517 118.525 7.520 1 U 0.351E+08 0.000E+00 e 0 0 0 0
17 1.242 118.525 7.503 1 U 0.436E+07 0.000E+00 e 0 0 0 0
18 7.496 122.110 7.214 1 U 0.115E+08 0.000E+00 e 0 0 0 0
19 7.212 122.110 7.213 1 U 0.833E+08 0.000E+00 e 0 0 0 0
20 7.097 122.110 7.213 1 U 0.163E+08 0.000E+00 e 0 0 0 0
21 1.594 122.110 7.215 1 U 0.504E+07 0.000E+00 e 0 0 0 0
22 2.984 122.110 7.216 1 U 0.335E+07 0.000E+00 e 0 0 0 0
23 6.819 130.461 6.820 1 U 0.240E+09 0.000E+00 e 0 0 0 0
24 6.643 130.461 6.821 1 U 0.593E+08 0.000E+00 e 0 0 0 0
25 7.197 130.461 6.823 1 U 0.540E+07 0.000E+00 e 0 0 0 0
26 4.328 130.461 6.818 1 U 0.493E+07 0.000E+00 e 0 0 0 0
27 4.680 130.461 6.814 1 U 0.418E+07 0.000E+00 e 0 0 0 0
28 2.849 130.461 6.820 1 U 0.124E+08 0.000E+00 e 0 0 0 0
29 1.849 130.461 6.820 1 U 0.482E+07 0.000E+00 e 0 0 0 0
30 6.821 115.370 6.639 1 U 0.731E+08 0.000E+00 e 0 0 0 0
31 6.640 115.370 6.640 1 U 0.392E+09 0.000E+00 e 0 0 0 0
32 7.003 130.325 6.997 1 U 0.452E+09 0.000E+00 e 0 0 0 0
33 6.733 130.325 6.998 1 U 0.524E+08 0.000E+00 e 0 0 0 0
34 3.307 130.325 6.993 1 U 0.459E+07 0.000E+00 e 0 0 0 0
35 2.741 130.325 6.998 1 U 0.686E+07 0.000E+00 e 0 0 0 0
36 1.922 130.325 6.997 1 U 0.796E+07 0.000E+00 e 0 0 0 0
37 2.022 130.325 6.998 1 U 0.570E+07 0.000E+00 e 0 0 0 0
38 1.846 130.325 6.998 1 U 0.606E+07 0.000E+00 e 0 0 0 0
39 7.000 115.529 6.734 1 U 0.673E+08 0.000E+00 e 0 0 0 0
40 6.733 115.529 6.733 1 U 0.673E+09 0.000E+00 e 0 0 0 0
41 4.727 115.529 6.741 1 U 0.690E+07 0.000E+00 e 0 0 0 0
42 1.846 115.529 6.732 1 U 0.529E+07 0.000E+00 e 0 0 0 0
43 1.961 115.529 6.728 1 U 0.701E+07 0.000E+00 e 0 0 0 0
44 0.834 115.529 6.732 1 U 0.526E+07 0.000E+00 e 0 0 0 0
45 6.513 130.189 6.779 1 U 0.491E+07 0.000E+00 e 0 0 0 0
46 6.772 130.189 6.779 1 U 0.166E+08 0.000E+00 e 0 0 0 0
47 0.726 114.872 6.498 1 U 0.703E+07 0.000E+00 e 0 0 0 0
48 2.717 114.872 6.496 1 U 0.618E+07 0.000E+00 e 0 0 0 0
49 4.275 114.872 6.496 1 U 0.518E+07 0.000E+00 e 0 0 0 0
50 6.499 114.872 6.503 1 U 0.117E+09 0.000E+00 e 0 0 0 0
51 6.777 114.872 6.504 1 U 0.138E+08 0.000E+00 e 0 0 0 0
52 6.980 129.009 6.984 1 U 0.679E+08 0.000E+00 e 0 0 0 0
53 7.056 129.009 6.984 1 U 0.230E+08 0.000E+00 e 0 0 0 0
54 7.053 128.782 7.059 1 U 0.398E+08 0.000E+00 e 0 0 0 0
55 6.977 128.782 7.060 1 U 0.298E+08 0.000E+00 e 0 0 0 0
56 6.930 117.072 6.929 1 U 0.941E+09 0.000E+00 e 0 0 0 0
57 4.701 117.072 6.933 1 U 0.918E+07 0.000E+00 e 0 0 0 0
58 3.732 117.072 6.935 1 U 0.486E+07 0.000E+00 e 0 0 0 0
59 3.046 117.072 6.931 1 U 0.103E+08 0.000E+00 e 0 0 0 0
60 1.987 117.072 6.928 1 U 0.416E+07 0.000E+00 e 0 0 0 0
61 1.873 117.072 6.929 1 U 0.517E+07 0.000E+00 e 0 0 0 0
62 7.508 134.909 7.501 1 U 0.108E+09 0.000E+00 e 0 0 0 0
63 4.736 134.909 7.499 1 U 0.613E+07 0.000E+00 e 0 0 0 0
64 4.205 134.909 7.500 1 U 0.373E+07 0.000E+00 e 0 0 0 0
65 1.670 134.909 7.499 1 U 0.119E+08 0.000E+00 e 0 0 0 0
66 1.233 134.909 7.498 1 U 0.521E+07 0.000E+00 e 0 0 0 0
67 0.846 134.909 7.500 1 U 0.124E+08 0.000E+00 e 0 0 0 0
68 1.092 134.909 7.504 1 U 0.310E+07 0.000E+00 e 0 0 0 0
69 7.179 116.255 7.182 1 U 0.849E+08 0.000E+00 e 0 0 0 0
70 7.030 116.255 7.182 1 U 0.504E+07 0.000E+00 e 0 0 0 0
71 2.829 116.255 7.175 1 U 0.342E+07 0.000E+00 e 0 0 0 0
72 2.043 116.255 7.183 1 U 0.338E+07 0.000E+00 e 0 0 0 0
73 1.943 116.255 7.182 1 U 0.322E+07 0.000E+00 e 0 0 0 0
74 0.638 116.255 7.188 1 U 0.436E+07 0.000E+00 e 0 0 0 0
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