Content for NMR-STAR saveframe, spectral_peak_list_1
save_spectral_peak_list_1
_Spectral_peak_list.Sf_category spectral_peak_list
_Spectral_peak_list.Sf_framecode spectral_peak_list_1
_Spectral_peak_list.Entry_ID 31213
_Spectral_peak_list.ID 1
_Spectral_peak_list.Name .
_Spectral_peak_list.Sample_ID 1
_Spectral_peak_list.Sample_label $sample_1
_Spectral_peak_list.Sample_condition_list_ID 1
_Spectral_peak_list.Sample_condition_list_label $sample_conditions_1
_Spectral_peak_list.Chem_shift_reference_ID 1
_Spectral_peak_list.Chem_shift_reference_label $chem_shift_reference_1
_Spectral_peak_list.Experiment_ID 1
_Spectral_peak_list.Experiment_name '2D 1H-1H NOESY'
_Spectral_peak_list.Experiment_class .
_Spectral_peak_list.Experiment_type .
_Spectral_peak_list.Number_of_spectral_dimensions 2
_Spectral_peak_list.Chemical_shift_list .
_Spectral_peak_list.Assigned_chem_shift_list_ID 1
_Spectral_peak_list.Assigned_chem_shift_list_label $assigned_chemical_shifts_1
_Spectral_peak_list.Details .
_Spectral_peak_list.Text_data_format text
_Spectral_peak_list.Text_data
;
# Number of dimensions 2
#INAME 1 H
#INAME 2 h
#CYANAFORMAT Hh
1 4.302 9.053 1 T 1.018e+05 0.00e+00 a 0 23 19 0
#2 4.341 9.053 1 T 1.818e+05 0.00e+00 a 0 21 19 0
3 1.269 9.053 1 T 1.197e+05 0.00e+00 a 0 24 19 0
4 4.896 9.046 1 T 3.496e+04 0.00e+00 a 0 35 33 0
6 2.004 9.047 1 T 2.382e+04 0.00e+00 a 0 38 33 0
7 1.816 9.046 1 T 3.394e+04 0.00e+00 a 0 37 33 0
8 1.666 9.046 1 T 3.428e+04 0.00e+00 a 0 43 33 0
13 4.544 7.763 1 T 2.751e+04 0.00e+00 a 0 62 60 0
14 1.135 7.763 1 T 3.201e+04 0.00e+00 a 0 65 60 0
17 1.664 3.230 1 T 3.921e+04 0.00e+00 a 0 0 0 0
18 2.004 1.812 1 T 3.439e+05 0.00e+00 a 0 0 0 0
19 2.004 1.664 1 T 1.790e+05 0.00e+00 a 0 0 0 0
21 1.664 1.812 1 T 2.431e+05 0.00e+00 a 0 0 0 0
22 1.664 2.004 1 T 1.935e+05 0.00e+00 a 0 0 0 0
23 1.813 2.004 1 T 2.589e+05 0.00e+00 a 0 0 0 0
30 5.049 7.744 1 T 3.697e+04 0.00e+00 a 0 76 74 0
31 2.715 7.744 1 T 2.706e+04 0.00e+00 a 0 78 74 0
#32 2.516 7.744 1 T 5.991e+04 0.00e+00 a 0 79 74 0
33 2.715 2.516 1 T 4.635e+05 0.00e+00 a 0 0 0 0
34 2.516 2.716 1 T 2.034e+05 0.00e+00 a 0 0 0 0
40 4.196 8.821 1 T 9.274e+04 0.00e+00 a 0 88 85 0
41 4.230 8.820 1 T 8.858e+04 0.00e+00 a 0 87 85 0
44 4.062 8.389 1 T 1.300e+05 0.00e+00 a 0 94 92 0
45 4.424 8.389 1 T 8.838e+04 0.00e+00 a 0 95 92 0
47 4.425 4.062 1 T 1.372e+05 0.00e+00 a 0 95 94 0
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51 4.496 3.678 1 T 1.741e+04 0.00e+00 a 0 101 111 0
52 4.630 3.679 1 T 4.755e+04 0.00e+00 a 0 109 111 0
53 4.630 3.891 1 T 1.265e+05 0.00e+00 a 0 109 110 0
54 3.890 3.678 1 T 4.358e+05 0.00e+00 a 0 110 111 0
55 3.678 3.891 1 T 4.943e+05 0.00e+00 a 0 0 0 0
56 2.058 3.890 1 T 2.413e+04 0.00e+00 a 0 0 0 0
57 2.057 3.678 1 T 2.307e+04 0.00e+00 a 0 0 0 0
60 2.058 2.424 1 T 2.233e+05 0.00e+00 a 0 103 104 0
61 2.422 2.058 1 T 3.045e+05 0.00e+00 a 0 104 103 0
68 4.632 2.421 1 T 2.246e+04 0.00e+00 a 0 0 0 0
70 4.424 8.768 1 T 4.625e+04 0.00e+00 a 0 117 115 0
71 4.496 8.769 1 T 3.672e+04 0.00e+00 a 0 101 115 0
72 2.058 8.768 1 T 2.189e+04 0.00e+00 a 0 103 115 0
79 3.930 7.824 1 T 1.308e+05 0.00e+00 a 0 143 141 0
80 3.128 7.824 1 T 1.282e+04 0.00e+00 a 0 146 141 0
81 2.186 7.824 1 T 1.198e+04 0.00e+00 a 0 0 0 0
82 3.930 2.186 1 T 1.724e+04 0.00e+00 a 0 143 145 0
83 3.931 3.131 1 T 3.165e+04 0.00e+00 a 0 143 146 0
84 2.186 3.128 1 T 2.352e+05 0.00e+00 a 0 145 146 0
85 3.128 2.186 1 T 7.629e+04 0.00e+00 a 0 146 145 0
86 3.128 3.929 1 T 1.840e+04 0.00e+00 a 0 146 143 0
87 2.186 3.930 1 T 4.221e+04 0.00e+00 a 0 145 143 0
93 4.662 1.110 1 T 1.600e+05 0.00e+00 a 0 154 157 0
94 4.291 1.110 1 T 2.277e+05 0.00e+00 a 0 156 157 0
95 4.291 8.163 1 T 1.337e+05 0.00e+00 a 0 156 166 0
96 4.661 8.163 1 T 1.839e+05 0.00e+00 a 0 154 166 0
97 3.770 8.163 1 T 7.103e+04 0.00e+00 a 0 0 0 0
98 4.846 8.163 1 T 3.485e+04 0.00e+00 a 0 0 0 0
100 4.081 8.235 1 T 3.583e+04 0.00e+00 a 0 177 173 0
101 4.615 8.235 1 T 6.018e+04 0.00e+00 a 0 175 173 0
102 1.157 8.237 1 T 4.178e+04 0.00e+00 a 0 178 173 0
107 4.615 4.084 1 T 1.107e+05 0.00e+00 a 0 175 177 0
108 4.780 8.706 1 T 2.937e+04 0.00e+00 a 0 189 187 0
109 3.223 8.706 1 T 2.013e+04 0.00e+00 a 0 191 187 0
#110 2.921 8.706 1 T 3.610e+04 0.00e+00 a 0 192 187 0
111 2.921 3.224 1 T 1.289e+05 0.00e+00 a 0 192 191 0
112 3.224 2.921 1 T 1.482e+05 0.00e+00 a 0 191 192 0
117 1.142 8.059 1 T 2.818e+04 0.00e+00 a 0 203 198 0
119 2.919 8.060 1 T 5.079e+04 0.00e+00 a 0 192 198 0
120 3.221 8.060 1 T 1.979e+04 0.00e+00 a 0 191 198 0
121 4.117 8.060 1 T 1.710e+04 0.00e+00 a 0 0 0 0
122 4.497 8.060 1 T 2.984e+04 0.00e+00 a 0 200 198 0
123 4.780 8.060 1 T 2.846e+04 0.00e+00 a 0 189 198 0
124 4.302 1.270 1 T 2.568e+05 0.00e+00 a 0 0 0 0
125 4.341 1.270 1 T 1.935e+05 0.00e+00 a 0 0 0 0
131 3.092 8.267 1 T 3.636e+04 0.00e+00 a 0 0 0 0
132 5.558 8.267 1 T 1.235e+04 0.00e+00 a 0 214 212 0
133 3.092 5.558 1 T 5.731e+04 0.00e+00 a 0 218 214 0
139 4.092 8.508 1 T 7.776e+04 0.00e+00 a 0 225 223 0
140 4.207 8.508 1 T 3.802e+04 0.00e+00 a 0 227 223 0
141 1.319 8.508 1 T 1.035e+05 0.00e+00 a 0 228 223 0
145 4.092 4.207 1 T 9.879e+04 0.00e+00 a 0 0 0 0
146 4.206 4.092 1 T 2.549e+05 0.00e+00 a 0 0 0 0
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148 2.920 8.868 1 T 1.459e+04 0.00e+00 a 0 241 237 0
149 4.574 8.868 1 T 4.968e+04 0.00e+00 a 0 239 237 0
156 6.861 7.660 1 T 1.323e+06 0.00e+00 a 0 0 0 0
157 7.659 6.862 1 T 1.200e+06 0.00e+00 a 0 0 0 0
158 2.907 6.861 1 T 3.612e+04 0.00e+00 a 0 242 248 0
159 2.921 6.861 1 T 3.457e+04 0.00e+00 a 0 241 248 0
160 2.907 7.660 1 T 7.941e+04 0.00e+00 a 0 242 247 0
161 2.921 7.660 1 T 7.829e+04 0.00e+00 a 0 241 247 0
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167 3.649 7.444 1 T 5.074e+04 0.00e+00 a 0 256 252 0
168 4.771 7.443 1 T 4.358e+04 0.00e+00 a 0 254 252 0
169 4.772 3.649 1 T 3.906e+04 0.00e+00 a 0 254 256 0
170 4.772 3.620 1 T 6.410e+04 0.00e+00 a 0 254 257 0
177 4.771 8.591 1 T 9.485e+04 0.00e+00 a 0 254 263 0
178 3.885 8.593 1 T 1.068e+05 0.00e+00 a 0 269 263 0
179 4.678 8.591 1 T 1.149e+05 0.00e+00 a 0 265 263 0
180 4.679 3.886 1 T 2.289e+05 0.00e+00 a 0 265 269 0
182 4.327 8.594 1 T 1.239e+05 0.00e+00 a 0 276 274 0
183 1.406 8.593 1 T 2.158e+04 0.00e+00 a 0 284 274 0
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189 1.405 1.870 1 T 4.864e+04 0.00e+00 a 0 0 0 0
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191 1.407 1.683 1 T 8.088e+04 0.00e+00 a 0 0 0 0
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202 2.903 3.083 1 T 5.272e+05 0.00e+00 a 0 305 304 0
203 3.084 2.904 1 T 2.970e+05 0.00e+00 a 0 0 0 0
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211 2.904 8.532 1 T 2.750e+04 0.00e+00 a 0 305 300 0
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213 5.454 8.531 1 T 2.937e+04 0.00e+00 a 0 302 300 0
217 4.440 3.977 1 T 1.232e+05 0.00e+00 a 0 314 313 0
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224 2.834 8.698 1 T 6.032e+04 0.00e+00 a 0 323 318 0
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232 4.976 9.092 1 T 1.909e+05 0.00e+00 a 0 320 329 0
233 4.669 9.097 1 T 5.870e+04 0.00e+00 a 0 331 329 0
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278 1.986 9.093 1 T 2.809e+04 0.00e+00 a 0 334 329 0
279 1.729 9.093 1 T 2.865e+04 0.00e+00 a 0 333 329 0
280 1.577 9.093 1 T 2.609e+04 0.00e+00 a 0 338 329 0
281 1.459 9.093 1 T 2.340e+04 0.00e+00 a 0 337 329 0
282 4.668 8.687 1 T 2.224e+05 0.00e+00 a 0 331 356 0
# 283 1.461 8.687 1 T 1.958e+04 0.00e+00 a 0 337 356 0
#284 1.578 8.687 1 T 2.274e+04 0.00e+00 a 0 338 356 0
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341 0.733 3.773 1 T 8.056e+04 0.00e+00 a 0 400 397 0
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351 1.722 7.833 1 T 1.828e+04 0.00e+00 a 0 399 413 0
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353 3.773 7.833 1 T 1.482e+05 0.00e+00 a 0 397 413 0
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541 7.510 10.181 1 T 6.205e+04 0.00e+00 a 0 484 481 0
553 3.113 7.151 1 T 1.475e+05 0.00e+00 a 0 470 477 0
554 0.732 7.092 1 T 4.377e+04 0.00e+00 a 0 400 478 0
562 4.081 8.706 1 T 1.432e+05 0.00e+00 a 0 177 187 0
567 4.661 4.291 1 T 4.539e+04 0.00e+00 a 0 154 156 0
568 1.270 4.302 1 T 5.876e+04 0.00e+00 a 0 24 23 0
569 1.269 4.341 1 T 5.215e+04 0.00e+00 a 0 24 21 0
570 1.135 7.744 1 T 2.429e+04 0.00e+00 a 0 65 74 0
571 4.544 7.744 1 T 5.493e+04 0.00e+00 a 0 62 74 0
574 4.196 4.232 1 T 5.630e+05 0.00e+00 a 0 0 0 0
575 4.231 4.195 1 T 1.084e+06 0.00e+00 a 0 0 0 0
576 1.157 8.706 1 T 4.986e+04 0.00e+00 a 0 178 187 0
583 4.497 4.117 1 T 7.964e+04 0.00e+00 a 0 200 202 0
584 3.092 8.508 1 T 1.170e+05 0.00e+00 a 0 218 223 0
591 1.377 1.644 1 T 1.366e+05 0.00e+00 a 0 0 0 0
592 1.380 1.687 1 T 3.584e+04 0.00e+00 a 0 0 0 0
593 1.380 1.994 1 T 5.646e+04 0.00e+00 a 0 0 0 0
595 1.646 1.994 1 T 1.461e+05 0.00e+00 a 0 0 0 0
596 1.682 1.994 1 T 2.965e+05 0.00e+00 a 0 127 119 0
601 1.686 1.381 1 T 5.001e+04 0.00e+00 a 0 0 0 0
602 1.645 1.381 1 T 1.677e+05 0.00e+00 a 0 0 0 0
612 1.110 8.163 1 T 3.729e+04 0.00e+00 a 0 157 166 0
613 4.846 3.770 1 T 1.238e+05 0.00e+00 a 0 169 168 0
614 1.157 4.080 1 T 1.715e+05 0.00e+00 a 0 178 177 0
615 1.110 4.288 1 T 8.653e+04 0.00e+00 a 0 157 156 0
616 1.142 4.116 1 T 8.837e+04 0.00e+00 a 0 203 202 0
#617 1.319 4.091 1 T 1.869e+05 0.00e+00 a 0 228 225 0
623 1.319 4.207 1 T 7.920e+04 0.00e+00 a 0 228 227 0
627 3.092 7.444 1 T 2.199e+04 0.00e+00 a 0 218 252 0
633 4.497 3.084 1 T 5.224e+04 0.00e+00 a 0 200 304 0
641 1.682 2.973 1 T 7.570e+04 0.00e+00 a 0 0 0 0
649 4.062 3.679 1 T 7.425e+04 0.00e+00 a 0 94 111 0
650 4.062 3.890 1 T 4.369e+05 0.00e+00 a 0 94 110 0
653 2.981 3.289 1 T 9.076e+04 0.00e+00 a 0 539 538 0
654 3.289 2.981 1 T 4.346e+05 0.00e+00 a 0 538 539 0
655 4.992 3.607 1 T 1.374e+04 0.00e+00 a 0 415 442 0
658 1.990 3.872 1 T 4.339e+04 0.00e+00 a 0 0 0 0
659 2.129 3.872 1 T 3.802e+04 0.00e+00 a 0 0 0 0
662 1.959 2.377 1 T 1.215e+05 0.00e+00 a 0 0 0 0
663 2.128 2.379 1 T 4.811e+04 0.00e+00 a 0 0 0 0
664 1.993 2.127 1 T 4.248e+05 0.00e+00 a 0 0 0 0
665 2.128 1.991 1 T 2.887e+05 0.00e+00 a 0 0 0 0
666 2.377 1.990 1 T 1.136e+05 0.00e+00 a 0 0 0 0
667 2.380 2.129 1 T 9.749e+04 0.00e+00 a 0 0 0 0
669 3.607 3.872 1 T 1.385e+05 0.00e+00 a 0 0 0 0
670 3.868 3.602 1 T 1.021e+05 0.00e+00 a 0 441 442 0
671 4.311 3.872 1 T 2.194e+04 0.00e+00 a 0 0 0 0
674 3.871 2.129 1 T 5.031e+04 0.00e+00 a 0 441 439 0
675 3.872 1.990 1 T 2.698e+04 0.00e+00 a 0 441 438 0
680 3.249 3.873 1 T 2.777e+04 0.00e+00 a 0 417 441 0
682 3.290 3.620 1 T 5.421e+04 0.00e+00 a 0 538 257 0
683 3.092 3.620 1 T 4.758e+04 0.00e+00 a 0 218 257 0
684 3.290 3.649 1 T 3.181e+04 0.00e+00 a 0 538 256 0
685 3.620 3.290 1 T 1.547e+04 0.00e+00 a 0 257 538 0
686 3.649 3.290 1 T 1.450e+04 0.00e+00 a 0 256 538 0
687 3.620 3.091 1 T 4.785e+04 0.00e+00 a 0 257 218 0
688 3.648 3.090 1 T 5.813e+04 0.00e+00 a 0 256 218 0
689 3.092 3.649 1 T 3.414e+04 0.00e+00 a 0 218 256 0
690 3.620 2.982 1 T 4.946e+04 0.00e+00 a 0 257 539 0
691 3.649 2.982 1 T 3.781e+04 0.00e+00 a 0 256 539 0
700 3.679 4.062 1 T 6.611e+04 0.00e+00 a 0 111 94 0
701 3.890 4.062 1 T 1.264e+05 0.00e+00 a 0 110 94 0
708 3.679 8.390 1 T 1.830e+04 0.00e+00 a 0 111 92 0
711 2.982 3.620 1 T 3.090e+04 0.00e+00 a 0 539 257 0
712 3.649 8.591 1 T 3.333e+04 0.00e+00 a 0 256 263 0
714 4.922 9.092 1 T 2.623e+04 0.00e+00 a 0 515 329 0
715 4.498 8.425 1 T 2.249e+04 0.00e+00 a 0 0 0 0
719 4.074 6.645 1 T 2.355e+04 0.00e+00 a 0 490 364 0
728 4.083 8.359 1 T 4.902e+04 0.00e+00 a 0 0 0 0
729 3.830 8.359 1 T 5.271e+04 0.00e+00 a 0 508 506 0
731 2.907 7.444 1 T 1.843e+04 0.00e+00 a 0 242 252 0
735 3.075 2.131 1 T 9.816e+03 0.00e+00 a 0 418 439 0
#736 2.136 3.075 1 T 2.572e+04 0.00e+00 a 0 439 418 0
737 2.983 3.650 1 T 2.006e+04 0.00e+00 a 0 539 256 0
740 1.685 1.110 1 T 7.929e+04 0.00e+00 a 0 127 157 0
743 1.110 1.686 1 T 4.358e+04 0.00e+00 a 0 157 127 0
746 4.661 2.831 1 T 1.651e+04 0.00e+00 a 0 154 323 0
749 2.921 7.444 1 T 1.905e+04 0.00e+00 a 0 241 252 0
754 4.496 4.044 1 T 4.418e+04 0.00e+00 a 0 448 450 0
768 6.813 8.516 1 T 1.313e+04 0.00e+00 a 0 363 380 0
#769 8.270 8.516 1 T 2.272e+04 0.00e+00 a 0 395 380 0
772 3.773 7.092 1 T 2.471e+04 0.00e+00 a 0 397 478 0
776 7.092 8.425 1 T 2.903e+04 0.00e+00 a 0 478 488 0
777 7.152 8.436 1 T 2.664e+04 0.00e+00 a 0 477 464 0
779 3.084 8.826 1 T 3.948e+04 0.00e+00 a 0 304 311 0
780 2.904 8.826 1 T 7.927e+04 0.00e+00 a 0 305 311 0
793 7.092 7.505 1 T 2.872e+04 0.00e+00 a 0 0 0 0
794 3.113 7.092 1 T 8.894e+04 0.00e+00 a 0 470 478 0
795 3.128 2.735 1 T 3.412e+04 0.00e+00 a 0 146 360 0
796 3.128 2.688 1 T 2.228e+04 0.00e+00 a 0 146 361 0
797 2.688 3.128 1 T 3.151e+04 0.00e+00 a 0 361 146 0
798 2.735 3.128 1 T 3.966e+04 0.00e+00 a 0 360 146 0
800 3.083 5.454 1 T 5.676e+03 0.00e+00 a 0 304 302 0
803 9.053 2.986 1 T 3.662e+04 0.00e+00 a 0 19 13 0
804 9.053 2.947 1 T 6.218e+04 0.00e+00 a 0 19 12 0
805 7.092 3.112 1 T 4.232e+04 0.00e+00 a 0 478 470 0
806 7.151 3.112 1 T 2.794e+04 0.00e+00 a 0 477 470 0
#809 8.516 8.270 1 T 3.148e+04 0.00e+00 a 0 380 395 0
810 1.110 1.995 1 T 2.002e+04 0.00e+00 a 0 157 121 0
811 1.994 1.110 1 T 4.458e+04 0.00e+00 a 0 121 157 0
812 2.948 2.987 1 T 3.036e+06 0.00e+00 a 0 0 0 0
815 2.949 8.827 1 T 3.677e+04 0.00e+00 a 0 0 0 0
816 2.987 8.827 1 T 3.776e+04 0.00e+00 a 0 13 8 0
817 8.423 8.516 1 T 5.202e+04 0.00e+00 a 0 488 380 0
818 8.516 8.423 1 T 1.036e+05 0.00e+00 a 0 380 488 0
819 8.868 7.444 1 T 2.057e+04 0.00e+00 a 0 237 252 0
820 7.446 3.094 1 T 2.237e+04 0.00e+00 a 0 252 218 0
821 7.445 3.619 1 T 2.866e+04 0.00e+00 a 0 252 257 0
822 7.445 3.649 1 T 2.856e+04 0.00e+00 a 0 252 256 0
823 8.593 3.621 1 T 1.971e+04 0.00e+00 a 0 263 257 0
824 8.594 3.651 1 T 2.280e+04 0.00e+00 a 0 263 256 0
826 6.813 2.735 1 T 6.864e+04 0.00e+00 a 0 363 360 0
827 6.813 2.688 1 T 5.004e+04 0.00e+00 a 0 363 361 0
830 1.861 3.912 1 T 2.198e+04 0.00e+00 a 0 278 551 0
831 2.186 2.735 1 T 2.065e+04 0.00e+00 a 0 145 360 0
835 4.661 2.507 1 T 3.177e+04 0.00e+00 a 0 154 322 0
839 2.186 2.618 1 T 1.280e+03 0.00e+00 a 0 145 499 0
840 3.075 7.077 1 T 4.722e+04 0.00e+00 a 0 418 426 0
841 7.833 7.078 1 T 2.408e+04 0.00e+00 a 0 413 426 0
#849 8.389 4.193 1 T 6.237e+04 0.00e+00 a 0 92 88 0
850 8.388 4.232 1 T 4.582e+04 0.00e+00 a 0 92 87 0
851 1.289 1.995 1 T 1.348e+04 0.00e+00 a 0 0 0 0
853 7.690 8.347 1 T 2.029e+04 0.00e+00 a 0 0 545 0
854 8.347 7.691 1 T 3.606e+04 0.00e+00 a 0 545 0 0
855 8.347 7.263 1 T 1.569e+04 0.00e+00 a 0 545 0 0
857 3.911 7.264 1 T 1.561e+04 0.00e+00 a 0 551 0 0
858 1.861 7.691 1 T 3.464e+04 0.00e+00 a 0 278 0 0
860 4.531 8.347 1 T 3.497e+04 0.00e+00 a 0 547 545 0
862 4.531 7.264 1 T 2.924e+04 0.00e+00 a 0 547 0 0
863 2.757 8.705 1 T 4.363e+04 0.00e+00 a 0 500 495 0
865 8.705 2.758 1 T 5.600e+04 0.00e+00 a 0 0 0 0
866 2.758 2.617 1 T 3.932e+05 0.00e+00 a 0 0 0 0
867 2.617 2.758 1 T 4.726e+05 0.00e+00 a 0 499 500 0
868 2.758 3.128 1 T 3.452e+04 0.00e+00 a 0 500 146 0
869 3.128 2.757 1 T 2.869e+04 0.00e+00 a 0 146 500 0
870 2.758 2.186 1 T 2.095e+04 0.00e+00 a 0 500 145 0
871 2.186 2.758 1 T 2.019e+04 0.00e+00 a 0 145 500 0
872 1.110 8.278 1 T 2.717e+04 0.00e+00 a 0 157 152 0
873 2.617 6.813 1 T 1.038e+04 0.00e+00 a 0 499 363 0
874 2.617 6.645 1 T 1.588e+04 0.00e+00 a 0 499 364 0
875 2.758 6.645 1 T 6.856e+04 0.00e+00 a 0 500 364 0
876 2.758 6.813 1 T 8.454e+04 0.00e+00 a 0 500 363 0
877 3.607 3.249 1 T 1.904e+04 0.00e+00 a 0 442 417 0
878 3.607 3.075 1 T 4.574e+04 0.00e+00 a 0 442 418 0
879 3.873 3.075 1 T 3.140e+03 0.00e+00 a 0 441 418 0
880 3.873 3.249 1 T 1.866e+04 0.00e+00 a 0 441 417 0
882 4.497 2.904 1 T 4.117e+04 0.00e+00 a 0 200 305 0
883 4.082 2.508 1 T 2.497e+04 0.00e+00 a 0 0 0 0
#884 4.117 1.270 1 T 3.749e+04 0.00e+00 a 0 0 0 0
888 1.270 8.059 1 T 2.424e+04 0.00e+00 a 0 24 198 0
#889 0.753 7.833 1 T 2.923e+04 0.00e+00 a 0 401 413 0
890 0.753 3.773 1 T 9.381e+04 0.00e+00 a 0 401 397 0
891 0.753 1.720 1 T 1.792e+04 0.00e+00 a 0 0 0 0
898 3.922 8.089 1 T 1.198e+04 0.00e+00 a 0 0 0 0
900 3.229 2.003 1 T 1.623e+04 0.00e+00 a 0 0 0 0
901 3.229 1.814 1 T 1.903e+04 0.00e+00 a 0 0 0 0
902 3.229 1.663 1 T 2.896e+04 0.00e+00 a 0 0 0 0
#904 1.813 7.744 1 T 2.645e+04 0.00e+00 a 0 37 74 0
907 5.050 2.516 1 T 5.161e+04 0.00e+00 a 0 0 0 0
908 5.050 2.714 1 T 2.433e+04 0.00e+00 a 0 0 0 0
909 1.142 8.267 1 T 2.460e+04 0.00e+00 a 0 203 212 0
910 4.574 2.907 1 T 9.592e+04 0.00e+00 a 0 0 0 0
911 4.574 2.920 1 T 1.293e+05 0.00e+00 a 0 0 0 0
912 6.861 2.907 1 T 5.753e+03 0.00e+00 a 0 248 242 0
913 6.861 2.921 1 T 2.115e+04 0.00e+00 a 0 248 241 0
914 7.660 2.921 1 T 3.583e+04 0.00e+00 a 0 247 241 0
915 7.660 2.907 1 T 4.152e+04 0.00e+00 a 0 247 242 0
916 4.327 1.407 1 T 2.059e+04 0.00e+00 a 0 0 0 0
917 1.886 8.594 1 T 2.407e+04 0.00e+00 a 0 279 274 0
918 1.886 8.532 1 T 9.420e+03 0.00e+00 a 0 279 300 0
919 1.886 8.347 1 T 2.100e+04 0.00e+00 a 0 279 545 0
920 1.886 7.691 1 T 2.558e+04 0.00e+00 a 0 279 0 0
923 1.886 3.912 1 T 1.756e+04 0.00e+00 a 0 279 551 0
924 3.987 8.826 1 T 7.610e+04 0.00e+00 a 0 4 8 0
925 4.003 8.826 1 T 5.819e+04 0.00e+00 a 0 3 8 0
926 4.669 1.986 1 T 2.399e+04 0.00e+00 a 0 331 334 0
927 4.669 1.730 1 T 3.531e+04 0.00e+00 a 0 0 0 0
928 8.705 2.617 1 T 1.327e+04 0.00e+00 a 0 0 0 0
929 4.885 2.735 1 T 4.672e+04 0.00e+00 a 0 0 0 0
930 4.884 2.688 1 T 1.612e+04 0.00e+00 a 0 0 0 0
931 4.827 2.757 1 T 4.834e+04 0.00e+00 a 0 0 0 0
932 4.827 2.618 1 T 1.296e+04 0.00e+00 a 0 0 0 0
933 4.760 2.493 1 T 6.667e+04 0.00e+00 a 0 0 0 0
934 4.760 2.520 1 T 3.819e+04 0.00e+00 a 0 0 0 0
935 0.753 8.271 1 T 4.806e+04 0.00e+00 a 0 401 395 0
936 0.753 7.092 1 T 1.997e+04 0.00e+00 a 0 401 478 0
937 3.248 7.833 1 T 2.192e+04 0.00e+00 a 0 417 413 0
938 4.993 3.249 1 T 2.237e+04 0.00e+00 a 0 0 0 0
939 4.993 3.075 1 T 4.307e+04 0.00e+00 a 0 0 0 0
940 2.422 3.891 1 T 1.198e+04 0.00e+00 a 0 0 0 0
942 3.890 4.497 1 T 1.953e+04 0.00e+00 a 0 110 101 0
943 4.715 1.362 1 T 1.902e+05 0.00e+00 a 0 526 527 0
944 5.452 3.288 1 T 1.034e+03 0.00e+00 a 0 302 538 0
945 5.452 2.981 1 T 2.192e+04 0.00e+00 a 0 302 539 0
#946 5.758 3.092 1 T 3.267e+04 0.00e+00 a 0 10 218 0
#947 5.560 2.947 1 T 2.077e+04 0.00e+00 a 0 214 12 0
#949 5.560 2.987 1 T 1.576e+04 0.00e+00 a 0 214 13 0
950 5.386 2.903 1 T 4.101e+03 0.00e+00 a 0 536 305 0
951 4.846 2.714 1 T 1.820e+04 0.00e+00 a 0 169 78 0
952 5.051 3.771 1 T 3.252e+03 0.00e+00 a 0 76 168 0
953 3.773 3.112 1 T 1.770e+04 0.00e+00 a 0 397 470 0
954 4.423 6.813 1 T 1.498e+04 0.00e+00 a 0 117 363 0
955 4.075 6.813 1 T 1.824e+04 0.00e+00 a 0 490 363 0
956 0.732 6.645 1 T 1.061e+04 0.00e+00 a 0 400 364 0
957 0.753 6.645 1 T 8.882e+03 0.00e+00 a 0 401 364 0
#958 0.732 6.813 1 T 1.816e+04 0.00e+00 a 0 400 363 0
959 0.753 6.813 1 T 1.265e+04 0.00e+00 a 0 401 363 0
960 4.074 7.092 1 T 1.989e+04 0.00e+00 a 0 490 478 0
#961 3.773 7.152 1 T 2.115e+04 0.00e+00 a 0 397 477 0
#962 0.732 7.153 1 T 4.128e+04 0.00e+00 a 0 400 477 0
#963 0.752 7.152 1 T 2.319e+04 0.00e+00 a 0 401 477 0
#964 3.773 8.436 1 T 1.965e+04 0.00e+00 a 0 397 464 0
#965 1.722 7.092 1 T 1.655e+04 0.00e+00 a 0 399 478 0
966 4.671 8.234 1 T 3.411e+04 0.00e+00 a 0 64 173 0
967 1.686 8.768 1 T 3.774e+04 0.00e+00 a 0 127 115 0
968 1.994 8.768 1 T 2.345e+04 0.00e+00 a 0 121 115 0
969 1.380 8.768 1 T 1.392e+04 0.00e+00 a 0 123 115 0
970 2.376 4.311 1 T 4.180e+04 0.00e+00 a 0 434 432 0
971 1.990 4.310 1 T 2.311e+04 0.00e+00 a 0 438 0 0
972 4.311 2.376 1 T 6.173e+04 0.00e+00 a 0 432 434 0
973 4.311 1.958 1 T 2.019e+04 0.00e+00 a 0 432 435 0
974 4.311 1.990 1 T 2.575e+04 0.00e+00 a 0 432 438 0
976 4.544 1.136 1 T 1.839e+05 0.00e+00 a 0 62 65 0
977 4.671 1.136 1 T 2.308e+05 0.00e+00 a 0 64 65 0
;
loop_
_Spectral_dim.ID
_Spectral_dim.Axis_code
_Spectral_dim.Spectrometer_frequency
_Spectral_dim.Atom_type
_Spectral_dim.Atom_isotope_number
_Spectral_dim.Spectral_region
_Spectral_dim.Magnetization_linkage_ID
_Spectral_dim.Under_sampling_type
_Spectral_dim.Sweep_width
_Spectral_dim.Sweep_width_units
_Spectral_dim.Value_first_point
_Spectral_dim.Absolute_peak_positions
_Spectral_dim.Acquisition
_Spectral_dim.Center_frequency_offset
_Spectral_dim.Encoding_code
_Spectral_dim.Encoded_reduced_dimension_ID
_Spectral_dim.Entry_ID
_Spectral_dim.Spectral_peak_list_ID
1 . . H 1 H . 'not observed' 12 ppm . . . 4.76 . . 31213 1
2 . . H 1 H . 'not observed' 12 ppm . . . 4.76 . . 31213 1
stop_
save_