######################### # Spectral peak lists # ######################### 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 20110 _Spectral_peak_list.ID 1 _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.Experiment_ID 4 _Spectral_peak_list.Experiment_name '2D 1H-1H NOESY' _Spectral_peak_list.Number_of_spectral_dimensions 2 _Spectral_peak_list.Details . _Spectral_peak_list.Text_data_format text _Spectral_peak_list.Text_data ; 1 9.702 3.541 5.500E+03 0.00E+00 0 0 0 2 9.617 9.667 1.400E+03 0.00E+00 0 0 0 3 9.140 3.518 8.160E+02 0.00E+00 0 0 0 4 9.037 3.524 2.050E+04 0.00E+00 0 0 0 5 8.991 1.143 1.490E+04 0.00E+00 0 0 0 6 8.778 4.489 2.320E+04 0.00E+00 0 0 0 7 8.776 1.143 8.170E+04 0.00E+00 0 0 0 8 8.695 4.628 2.510E+04 0.00E+00 0 0 0 9 8.695 1.862 2.150E+04 0.00E+00 0 0 0 10 8.693 8.221 8.490E+03 0.00E+00 0 0 0 11 8.693 4.953 3.950E+04 0.00E+00 0 0 0 12 8.688 2.690 5.390E+04 0.00E+00 0 0 0 13 8.688 2.244 3.040E+04 0.00E+00 0 0 0 14 8.687 4.372 3.310E+05 0.00E+00 0 0 0 15 8.684 2.730 5.080E+04 0.00E+00 0 0 0 16 8.632 1.611 4.410E+04 0.00E+00 0 0 0 17 8.630 1.149 1.870E+04 0.00E+00 0 0 0 18 8.629 4.140 1.050E+06 0.00E+00 0 0 0 19 8.629 1.812 2.050E+05 0.00E+00 0 0 0 20 8.629 1.724 1.540E+05 0.00E+00 0 0 0 21 8.628 3.160 2.400E+04 0.00E+00 0 0 0 22 8.628 1.424 1.410E+04 0.00E+00 0 0 0 23 8.628 0.819 3.990E+04 0.00E+00 0 0 0 24 8.627 1.619 5.660E+04 0.00E+00 0 0 0 25 8.626 4.955 1.080E+05 0.00E+00 0 0 0 26 8.626 4.392 1.730E+05 0.00E+00 0 0 0 27 8.625 0.856 1.410E+05 0.00E+00 0 0 0 28 8.623 8.361 2.260E+04 0.00E+00 0 0 0 29 8.622 1.572 4.280E+04 0.00E+00 0 0 0 30 8.603 4.231 8.950E+04 0.00E+00 0 0 0 31 8.572 4.512 2.460E+04 0.00E+00 0 0 0 32 8.571 1.854 2.970E+04 0.00E+00 0 0 0 33 8.570 2.486 2.410E+04 0.00E+00 0 0 0 34 8.568 4.962 3.810E+04 0.00E+00 0 0 0 35 8.568 2.730 6.110E+04 0.00E+00 0 0 0 36 8.568 2.219 1.880E+04 0.00E+00 0 0 0 37 8.567 4.588 1.190E+05 0.00E+00 0 0 0 38 8.567 4.367 4.450E+05 0.00E+00 0 0 0 39 8.565 4.263 1.620E+04 0.00E+00 0 0 0 40 8.563 1.984 1.820E+04 0.00E+00 0 0 0 41 8.562 2.771 3.910E+04 0.00E+00 0 0 0 42 8.553 4.782 3.480E+04 0.00E+00 0 0 0 43 8.540 7.130 1.980E+04 0.00E+00 0 0 0 44 8.540 4.644 9.990E+04 0.00E+00 0 0 0 45 8.535 1.254 3.620E+04 0.00E+00 0 0 0 46 8.534 4.237 1.770E+05 0.00E+00 0 0 0 47 8.534 3.052 8.270E+04 0.00E+00 0 0 0 48 8.534 2.966 8.820E+04 0.00E+00 0 0 0 49 8.493 4.587 3.430E+04 0.00E+00 0 0 0 50 8.490 4.262 1.140E+06 0.00E+00 0 0 0 51 8.490 3.817 3.510E+03 0.00E+00 0 0 0 52 8.490 1.465 8.210E+04 0.00E+00 0 0 0 53 8.489 4.536 2.360E+05 0.00E+00 0 0 0 54 8.489 1.791 2.420E+05 0.00E+00 0 0 0 55 8.489 1.689 3.570E+05 0.00E+00 0 0 0 56 8.489 1.408 7.940E+04 0.00E+00 0 0 0 57 8.488 3.598 2.910E+04 0.00E+00 0 0 0 58 8.472 2.544 2.520E+04 0.00E+00 0 0 0 59 8.469 4.490 3.540E+04 0.00E+00 0 0 0 60 8.468 4.374 1.300E+05 0.00E+00 0 0 0 61 8.467 2.625 2.890E+04 0.00E+00 0 0 0 62 8.444 4.506 1.090E+04 0.00E+00 0 0 0 63 8.440 8.148 2.370E+04 0.00E+00 0 0 0 64 8.440 0.914 4.730E+04 0.00E+00 0 0 0 65 8.439 4.644 5.010E+04 0.00E+00 0 0 0 66 8.438 3.671 2.820E+04 0.00E+00 0 0 0 67 8.437 3.825 2.360E+04 0.00E+00 0 0 0 68 8.435 4.433 2.010E+06 0.00E+00 0 0 0 69 8.435 4.087 4.810E+05 0.00E+00 0 0 0 70 8.435 2.279 1.830E+05 0.00E+00 0 0 0 71 8.434 4.228 3.580E+05 0.00E+00 0 0 0 72 8.434 1.846 1.310E+05 0.00E+00 0 0 0 73 8.434 1.176 4.160E+05 0.00E+00 0 0 0 74 8.432 4.150 1.800E+05 0.00E+00 0 0 0 75 8.432 1.939 2.920E+04 0.00E+00 0 0 0 76 8.431 4.267 2.040E+06 0.00E+00 0 0 0 77 8.431 1.343 6.830E+05 0.00E+00 0 0 0 78 8.430 1.757 1.910E+05 0.00E+00 0 0 0 79 8.430 1.717 2.270E+05 0.00E+00 0 0 0 80 8.430 0.850 2.800E+04 0.00E+00 0 0 0 81 8.429 4.955 4.560E+05 0.00E+00 0 0 0 82 8.427 2.025 4.350E+04 0.00E+00 0 0 0 83 8.396 5.906 5.890E+01 0.00E+00 0 0 0 84 8.383 4.164 2.200E+05 0.00E+00 0 0 0 85 8.382 4.263 2.010E+06 0.00E+00 0 0 0 86 8.382 2.037 4.780E+05 0.00E+00 0 0 0 87 8.382 1.720 9.140E+04 0.00E+00 0 0 0 88 8.382 1.346 1.040E+05 0.00E+00 0 0 0 89 8.382 0.917 5.500E+05 0.00E+00 0 0 0 90 8.381 1.758 1.290E+05 0.00E+00 0 0 0 91 8.380 4.066 3.540E+05 0.00E+00 0 0 0 92 8.375 4.953 7.200E+04 0.00E+00 0 0 0 93 8.365 2.680 1.320E+05 0.00E+00 0 0 0 94 8.364 8.135 1.940E+04 0.00E+00 0 0 0 95 8.354 2.284 2.320E+04 0.00E+00 0 0 0 96 8.351 4.434 9.540E+04 0.00E+00 0 0 0 97 8.350 4.229 2.880E+06 0.00E+00 0 0 0 98 8.350 4.139 4.510E+05 0.00E+00 0 0 0 99 8.350 4.088 4.370E+05 0.00E+00 0 0 0 100 8.350 1.443 2.580E+05 0.00E+00 0 0 0 101 8.350 1.174 4.850E+05 0.00E+00 0 0 0 102 8.350 0.859 3.780E+05 0.00E+00 0 0 0 103 8.349 1.807 7.550E+05 0.00E+00 0 0 0 104 8.349 0.819 1.520E+05 0.00E+00 0 0 0 105 8.344 4.957 8.350E+04 0.00E+00 0 0 0 106 8.337 4.335 2.130E+04 0.00E+00 0 0 0 107 8.334 4.262 1.150E+05 0.00E+00 0 0 0 108 8.332 2.714 3.060E+04 0.00E+00 0 0 0 109 8.331 1.686 9.140E+04 0.00E+00 0 0 0 110 8.330 4.588 3.910E+05 0.00E+00 0 0 0 111 8.330 2.779 1.930E+04 0.00E+00 0 0 0 112 8.301 4.150 6.320E+04 0.00E+00 0 0 0 113 8.299 4.480 1.070E+05 0.00E+00 0 0 0 114 8.298 4.209 1.020E+04 0.00E+00 0 0 0 115 8.296 1.174 8.240E+04 0.00E+00 0 0 0 116 8.295 4.392 3.790E+05 0.00E+00 0 0 0 117 8.289 4.953 3.090E+04 0.00E+00 0 0 0 118 8.268 2.747 2.250E+04 0.00E+00 0 0 0 119 8.236 7.632 1.760E+04 0.00E+00 0 0 0 120 8.233 7.057 1.800E+04 0.00E+00 0 0 0 121 8.232 2.615 1.440E+04 0.00E+00 0 0 0 122 8.231 4.523 1.630E+05 0.00E+00 0 0 0 123 8.225 3.871 2.730E+06 0.00E+00 0 0 0 124 8.225 1.627 5.150E+05 0.00E+00 0 0 0 125 8.225 1.578 8.200E+05 0.00E+00 0 0 0 126 8.225 1.520 3.990E+05 0.00E+00 0 0 0 127 8.224 3.613 1.000E+05 0.00E+00 0 0 0 128 8.223 7.134 1.910E+04 0.00E+00 0 0 0 129 8.222 4.235 1.340E+05 0.00E+00 0 0 0 130 8.222 2.244 2.830E+04 0.00E+00 0 0 0 131 8.221 3.829 1.470E+05 0.00E+00 0 0 0 132 8.221 1.157 4.470E+04 0.00E+00 0 0 0 133 8.219 4.128 6.120E+04 0.00E+00 0 0 0 134 8.218 4.370 8.530E+04 0.00E+00 0 0 0 135 8.217 4.926 1.120E+05 0.00E+00 0 0 0 136 8.216 4.956 2.530E+05 0.00E+00 0 0 0 137 8.216 4.415 4.650E+05 0.00E+00 0 0 0 138 8.216 3.670 9.000E+04 0.00E+00 0 0 0 139 8.216 3.063 2.460E+04 0.00E+00 0 0 0 140 8.216 1.846 5.670E+04 0.00E+00 0 0 0 141 8.216 0.885 9.300E+05 0.00E+00 0 0 0 142 8.215 2.949 3.030E+04 0.00E+00 0 0 0 143 8.215 0.935 3.180E+05 0.00E+00 0 0 0 144 8.214 7.705 2.660E+04 0.00E+00 0 0 0 145 8.214 4.617 2.680E+06 0.00E+00 0 0 0 146 8.214 2.728 2.540E+05 0.00E+00 0 0 0 147 8.214 2.690 1.930E+05 0.00E+00 0 0 0 148 8.214 2.046 6.320E+05 0.00E+00 0 0 0 149 8.145 1.859 1.690E+04 0.00E+00 0 0 0 150 8.140 1.351 2.930E+04 0.00E+00 0 0 0 151 8.139 3.966 2.170E+04 0.00E+00 0 0 0 152 8.139 1.757 3.170E+04 0.00E+00 0 0 0 153 8.138 4.118 4.540E+05 0.00E+00 0 0 0 154 8.138 4.066 2.960E+06 0.00E+00 0 0 0 155 8.138 2.039 3.310E+05 0.00E+00 0 0 0 156 8.138 0.916 4.340E+05 0.00E+00 0 0 0 157 8.137 4.274 2.740E+04 0.00E+00 0 0 0 158 8.137 2.256 1.350E+05 0.00E+00 0 0 0 159 8.137 1.899 2.750E+05 0.00E+00 0 0 0 160 8.134 8.374 2.580E+05 0.00E+00 0 0 0 161 8.064 4.242 1.720E+04 0.00E+00 0 0 0 162 8.058 4.386 1.860E+05 0.00E+00 0 0 0 163 8.058 2.674 5.980E+04 0.00E+00 0 0 0 164 8.028 8.221 5.270E+04 0.00E+00 0 0 0 165 8.028 7.139 1.800E+04 0.00E+00 0 0 0 166 8.028 4.236 3.160E+05 0.00E+00 0 0 0 167 8.028 3.871 4.750E+05 0.00E+00 0 0 0 168 8.026 4.142 4.490E+04 0.00E+00 0 0 0 169 8.026 1.141 3.920E+04 0.00E+00 0 0 0 170 8.025 7.057 9.120E+03 0.00E+00 0 0 0 171 8.025 4.954 1.200E+05 0.00E+00 0 0 0 172 7.984 4.258 1.960E+04 0.00E+00 0 0 0 173 7.980 1.360 4.220E+04 0.00E+00 0 0 0 174 7.980 0.881 7.660E+03 0.00E+00 0 0 0 175 7.979 4.320 7.530E+04 0.00E+00 0 0 0 176 7.978 3.860 1.170E+05 0.00E+00 0 0 0 177 7.977 4.485 2.200E+04 0.00E+00 0 0 0 178 7.977 1.552 1.230E+05 0.00E+00 0 0 0 179 7.869 4.808 2.300E+03 0.00E+00 0 0 0 180 7.869 2.760 1.950E+04 0.00E+00 0 0 0 181 7.869 1.978 2.550E+04 0.00E+00 0 0 0 182 7.864 0.830 8.410E+04 0.00E+00 0 0 0 183 7.862 4.563 1.980E+05 0.00E+00 0 0 0 184 7.862 4.224 3.150E+04 0.00E+00 0 0 0 185 7.841 1.151 1.210E+04 0.00E+00 0 0 0 186 7.757 7.510 3.030E+04 0.00E+00 0 0 0 187 7.706 8.216 1.440E+04 0.00E+00 0 0 0 188 7.698 2.691 1.760E+05 0.00E+00 0 0 0 189 7.695 4.955 2.370E+05 0.00E+00 0 0 0 190 7.695 4.442 1.280E+04 0.00E+00 0 0 0 191 7.685 4.588 5.700E+04 0.00E+00 0 0 0 192 7.683 4.954 2.360E+05 0.00E+00 0 0 0 193 7.682 2.721 2.430E+05 0.00E+00 0 0 0 194 7.681 2.755 2.020E+05 0.00E+00 0 0 0 195 7.680 6.985 3.440E+06 0.00E+00 0 0 0 196 7.680 4.377 1.870E+04 0.00E+00 0 0 0 197 7.643 2.763 4.080E+04 0.00E+00 0 0 0 198 7.642 2.730 4.750E+04 0.00E+00 0 0 0 199 7.639 4.477 2.750E+04 0.00E+00 0 0 0 200 7.637 0.840 2.920E+04 0.00E+00 0 0 0 201 7.636 5.592 1.080E+06 0.00E+00 0 0 0 202 7.635 5.898 4.080E+05 0.00E+00 0 0 0 203 7.635 4.256 1.850E+06 0.00E+00 0 0 0 204 7.635 4.133 1.100E+05 0.00E+00 0 0 0 205 7.635 3.870 2.530E+04 0.00E+00 0 0 0 206 7.632 6.899 1.790E+06 0.00E+00 0 0 0 207 7.631 4.955 1.370E+05 0.00E+00 0 0 0 208 7.629 5.602 1.470E+06 0.00E+00 0 0 0 209 7.629 0.886 1.280E+04 0.00E+00 0 0 0 210 7.517 5.833 5.260E+04 0.00E+00 0 0 0 211 7.514 4.551 4.810E+04 0.00E+00 0 0 0 212 7.511 7.763 1.240E+04 0.00E+00 0 0 0 213 7.508 5.597 8.710E+04 0.00E+00 0 0 0 214 7.505 4.270 2.190E+04 0.00E+00 0 0 0 215 7.501 4.495 5.040E+04 0.00E+00 0 0 0 216 7.498 7.641 3.640E+05 0.00E+00 0 0 0 217 7.496 5.772 3.330E+04 0.00E+00 0 0 0 218 7.466 8.139 1.580E+04 0.00E+00 0 0 0 219 7.386 9.569 1.450E+04 0.00E+00 0 0 0 220 7.373 9.429 1.240E+04 0.00E+00 0 0 0 221 7.255 7.057 3.280E+04 0.00E+00 0 0 0 222 7.147 3.631 1.850E+04 0.00E+00 0 0 0 223 7.143 2.757 1.960E+04 0.00E+00 0 0 0 224 7.143 1.434 1.430E+04 0.00E+00 0 0 0 225 7.141 4.644 1.320E+06 0.00E+00 0 0 0 226 7.141 3.762 2.100E+04 0.00E+00 0 0 0 227 7.141 3.054 1.460E+06 0.00E+00 0 0 0 228 7.141 2.965 1.490E+06 0.00E+00 0 0 0 229 7.141 0.911 1.080E+05 0.00E+00 0 0 0 230 7.140 4.243 2.780E+05 0.00E+00 0 0 0 231 7.140 4.133 7.940E+04 0.00E+00 0 0 0 232 7.140 3.809 1.900E+04 0.00E+00 0 0 0 233 7.140 3.722 2.820E+04 0.00E+00 0 0 0 234 7.140 1.976 2.210E+04 0.00E+00 0 0 0 235 7.140 1.633 3.800E+04 0.00E+00 0 11 100 236 7.140 1.249 1.370E+05 0.00E+00 0 0 0 237 7.139 5.605 1.070E+05 0.00E+00 0 0 0 238 7.139 3.872 1.850E+05 0.00E+00 0 0 0 239 7.138 1.566 2.940E+04 0.00E+00 0 11 101 240 7.135 1.358 1.710E+04 0.00E+00 0 0 0 241 7.135 1.122 2.790E+03 0.00E+00 0 0 0 242 7.135 0.782 1.990E+04 0.00E+00 0 0 0 243 7.134 4.360 3.200E+04 0.00E+00 0 0 0 244 7.070 1.648 2.560E+04 0.00E+00 0 13 53 245 7.070 1.358 6.260E+03 0.00E+00 0 13 55 246 7.070 0.908 4.130E+04 0.00E+00 0 0 0 247 7.067 4.644 2.940E+05 0.00E+00 0 0 0 248 7.067 3.052 3.210E+05 0.00E+00 0 0 0 249 7.067 2.964 3.100E+05 0.00E+00 0 0 0 250 7.067 1.572 2.050E+04 0.00E+00 0 0 0 251 7.065 4.250 6.700E+05 0.00E+00 0 0 0 252 7.065 4.135 2.100E+05 0.00E+00 0 0 0 253 7.065 1.249 1.070E+05 0.00E+00 0 0 0 254 7.064 5.601 9.270E+04 0.00E+00 0 0 0 255 7.064 3.871 4.570E+05 0.00E+00 0 0 0 256 7.064 3.813 4.190E+04 0.00E+00 0 0 0 257 7.063 3.769 3.330E+04 0.00E+00 0 0 0 258 7.063 3.620 2.180E+04 0.00E+00 0 0 0 259 7.062 1.437 1.260E+03 0.00E+00 0 0 0 260 7.061 4.366 5.060E+04 0.00E+00 0 0 0 261 7.061 4.328 2.420E+04 0.00E+00 0 13 52 262 7.059 1.137 1.380E+04 0.00E+00 0 0 0 263 7.056 1.985 2.730E+04 0.00E+00 0 0 0 264 7.055 3.729 3.250E+04 0.00E+00 0 0 0 265 6.996 4.604 2.050E+04 0.00E+00 0 0 0 266 6.996 0.839 3.280E+04 0.00E+00 0 0 0 267 6.993 4.436 3.770E+04 0.00E+00 0 0 0 268 6.993 4.373 3.710E+04 0.00E+00 0 0 0 269 6.992 0.900 5.020E+03 0.00E+00 0 0 0 270 6.989 2.695 1.230E+05 0.00E+00 0 0 0 271 6.987 4.954 2.850E+05 0.00E+00 0 0 0 272 6.986 1.664 2.070E+04 0.00E+00 0 0 0 273 6.985 2.723 1.610E+05 0.00E+00 0 0 0 274 6.984 2.754 1.400E+05 0.00E+00 0 0 0 275 6.984 1.832 1.880E+04 0.00E+00 0 0 0 276 6.982 1.993 1.460E+04 0.00E+00 0 0 0 277 6.955 7.161 3.740E+04 0.00E+00 0 0 0 278 6.897 4.960 4.280E+04 0.00E+00 0 0 0 279 6.488 4.968 4.550E+03 0.00E+00 0 0 0 280 6.463 7.134 1.960E+04 0.00E+00 0 0 0 281 6.392 3.526 4.500E+04 0.00E+00 0 0 0 282 6.383 7.062 2.220E+04 0.00E+00 0 0 0 283 6.005 5.790 1.720E+04 0.00E+00 0 0 0 284 5.903 8.424 6.060E+04 0.00E+00 0 0 0 285 5.894 4.262 -2.140E+05 0.00E+00 0 0 0 286 5.887 9.746 1.810E+04 0.00E+00 0 0 0 287 5.887 7.637 1.030E+05 0.00E+00 0 0 0 288 5.824 7.514 1.980E+04 0.00E+00 0 0 0 289 5.772 7.505 2.500E+04 0.00E+00 0 0 0 290 5.622 7.623 9.840E+04 0.00E+00 0 0 0 291 5.606 9.017 5.720E+04 0.00E+00 0 0 0 292 5.605 4.254 3.560E+04 0.00E+00 0 0 0 293 5.605 3.867 1.670E+04 0.00E+00 0 0 0 294 5.600 7.148 1.310E+04 0.00E+00 0 0 0 295 5.598 0.939 2.130E+04 0.00E+00 0 0 0 296 5.597 7.514 1.940E+04 0.00E+00 0 0 0 297 5.593 7.057 1.770E+04 0.00E+00 0 0 0 298 4.641 3.056 8.150E+04 0.00E+00 0 0 0 299 4.624 7.136 4.840E+04 0.00E+00 0 0 0 300 4.624 2.966 7.160E+04 0.00E+00 0 0 0 301 4.607 2.735 1.030E+05 0.00E+00 0 0 0 302 4.607 2.677 9.060E+04 0.00E+00 0 0 0 303 4.580 3.815 2.310E+05 0.00E+00 0 0 0 304 4.580 3.618 1.950E+05 0.00E+00 0 0 0 305 4.580 2.714 1.650E+05 0.00E+00 0 0 0 306 4.580 1.517 1.210E+05 0.00E+00 0 0 0 307 4.580 0.883 1.950E+05 0.00E+00 0 0 0 308 4.575 1.580 9.220E+04 0.00E+00 0 0 0 309 4.572 2.775 7.750E+04 0.00E+00 0 0 0 310 4.534 3.609 4.050E+05 0.00E+00 0 0 0 311 4.534 1.978 6.730E+04 0.00E+00 0 0 0 312 4.531 1.795 1.230E+05 0.00E+00 0 0 0 313 4.529 1.691 9.610E+04 0.00E+00 0 0 0 314 4.524 3.801 3.310E+05 0.00E+00 0 0 0 315 4.482 0.841 2.190E+04 0.00E+00 0 0 0 316 4.435 1.848 2.040E+05 0.00E+00 0 0 0 317 4.430 2.284 4.340E+05 0.00E+00 0 0 0 318 4.425 1.954 1.050E+05 0.00E+00 0 0 0 319 4.417 2.050 2.740E+05 0.00E+00 0 0 0 320 4.416 3.669 7.140E+05 0.00E+00 0 0 0 321 4.414 0.887 3.490E+05 0.00E+00 0 0 0 322 4.413 3.829 8.100E+05 0.00E+00 0 0 0 323 4.409 0.937 3.770E+05 0.00E+00 0 0 0 324 4.394 1.173 6.830E+04 0.00E+00 0 0 0 325 4.391 1.821 2.260E+05 0.00E+00 0 0 0 326 4.390 3.170 3.230E+04 0.00E+00 0 0 0 327 4.390 1.564 1.050E+05 0.00E+00 0 0 0 328 4.389 1.622 8.860E+04 0.00E+00 0 0 0 329 4.388 1.715 1.370E+05 0.00E+00 0 0 0 330 4.385 2.680 5.190E+04 0.00E+00 0 0 0 331 4.371 3.609 1.020E+05 0.00E+00 0 0 0 332 4.370 1.981 2.870E+05 0.00E+00 0 0 0 333 4.369 1.856 4.200E+05 0.00E+00 0 0 0 334 4.365 2.249 7.260E+05 0.00E+00 0 0 0 335 4.362 3.806 6.820E+04 0.00E+00 0 0 0 336 4.323 4.488 6.810E+04 0.00E+00 0 0 0 337 4.320 0.841 5.170E+04 0.00E+00 0 0 0 338 4.267 1.346 9.600E+05 0.00E+00 0 0 0 339 4.266 0.822 3.250E+04 0.00E+00 0 0 0 340 4.265 1.705 2.960E+05 0.00E+00 0 0 0 341 4.263 1.779 4.270E+05 0.00E+00 0 0 0 342 4.262 1.181 5.140E+05 0.00E+00 0 0 0 343 4.260 4.474 1.200E+05 0.00E+00 0 0 0 344 4.260 1.394 1.850E+05 0.00E+00 0 0 0 345 4.259 7.071 1.550E+05 0.00E+00 0 0 0 346 4.259 0.917 7.030E+04 0.00E+00 0 0 0 347 4.258 5.894 2.950E+05 0.00E+00 0 0 0 348 4.258 4.149 1.880E+06 0.00E+00 0 0 0 349 4.257 1.630 1.480E+05 0.00E+00 0 0 0 350 4.257 0.856 4.470E+04 0.00E+00 0 0 0 351 4.251 5.601 2.770E+04 0.00E+00 0 0 0 352 4.250 0.894 1.260E+04 0.00E+00 0 0 0 353 4.249 4.131 2.900E+06 0.00E+00 0 0 0 354 4.239 1.250 1.090E+05 0.00E+00 0 0 0 355 4.238 1.147 8.590E+05 0.00E+00 0 0 0 356 4.237 7.155 2.620E+04 0.00E+00 0 0 0 357 4.237 5.903 6.230E+04 0.00E+00 0 0 0 358 4.235 3.879 8.180E+04 0.00E+00 0 0 0 359 4.231 1.176 8.290E+05 0.00E+00 0 0 0 360 4.226 0.937 3.740E+04 0.00E+00 0 0 0 361 4.221 0.860 4.580E+04 0.00E+00 0 0 0 362 4.221 0.822 4.390E+04 0.00E+00 0 0 0 363 4.214 4.790 1.230E+05 0.00E+00 0 0 0 364 4.207 0.829 3.900E+04 0.00E+00 0 0 0 365 4.147 1.173 1.430E+06 0.00E+00 0 0 0 366 4.142 1.343 6.140E+04 0.00E+00 0 0 0 367 4.140 4.264 1.360E+06 0.00E+00 0 0 0 368 4.140 1.723 5.930E+04 0.00E+00 0 0 0 369 4.138 1.447 1.990E+05 0.00E+00 0 0 0 370 4.137 1.811 5.360E+05 0.00E+00 0 0 0 371 4.137 1.142 1.510E+06 0.00E+00 0 0 0 372 4.137 0.858 8.760E+05 0.00E+00 0 0 0 373 4.137 0.816 3.170E+05 0.00E+00 0 0 0 374 4.136 1.622 6.190E+04 0.00E+00 0 0 0 375 4.133 7.142 1.910E+04 0.00E+00 0 0 0 376 4.132 0.911 4.640E+04 0.00E+00 0 0 0 377 4.130 7.061 4.890E+04 0.00E+00 0 0 0 378 4.119 1.898 1.900E+05 0.00E+00 0 0 0 379 4.111 2.037 9.830E+04 0.00E+00 0 0 0 380 4.088 0.860 5.860E+04 0.00E+00 0 0 0 381 4.086 4.442 4.600E+04 0.00E+00 0 0 0 382 4.086 4.223 8.110E+05 0.00E+00 0 0 0 383 4.086 1.171 1.650E+06 0.00E+00 0 0 0 384 4.072 1.288 7.980E+04 0.00E+00 0 0 0 385 4.065 0.917 6.920E+05 0.00E+00 0 0 0 386 4.063 2.034 3.030E+05 0.00E+00 0 0 0 387 3.878 4.580 8.140E+04 0.00E+00 0 0 0 388 3.875 7.067 2.220E+05 0.00E+00 0 0 0 389 3.870 1.638 9.120E+04 0.00E+00 0 0 0 390 3.870 1.569 1.040E+05 0.00E+00 0 0 0 391 3.868 7.148 3.120E+04 0.00E+00 0 0 0 392 3.866 1.152 6.400E+04 0.00E+00 0 0 0 393 3.836 1.957 7.170E+05 0.00E+00 0 0 0 394 3.830 2.281 2.070E+05 0.00E+00 0 0 0 395 3.829 3.687 2.190E+06 0.00E+00 0 0 0 396 3.828 0.937 3.230E+05 0.00E+00 0 0 0 397 3.827 4.419 1.610E+06 0.00E+00 0 0 0 398 3.826 2.010 7.920E+05 0.00E+00 0 0 0 399 3.821 0.884 3.100E+05 0.00E+00 0 0 0 400 3.817 1.843 2.900E+05 0.00E+00 0 0 0 401 3.813 4.589 1.470E+06 0.00E+00 0 0 0 402 3.812 1.574 1.060E+05 0.00E+00 0 0 0 403 3.812 1.519 2.230E+05 0.00E+00 0 0 0 404 3.803 3.595 3.600E+06 0.00E+00 0 0 0 405 3.800 2.241 2.540E+05 0.00E+00 0 0 0 406 3.797 4.360 1.530E+05 0.00E+00 0 0 0 407 3.792 1.803 2.140E+05 0.00E+00 0 0 0 408 3.791 1.412 6.570E+04 0.00E+00 0 0 0 409 3.790 1.686 1.360E+05 0.00E+00 0 0 0 410 3.788 1.983 1.590E+06 0.00E+00 0 0 0 411 3.785 4.534 1.790E+06 0.00E+00 0 0 0 412 3.729 1.253 1.150E+05 0.00E+00 0 0 0 413 3.678 3.843 3.090E+06 0.00E+00 0 0 0 414 3.670 2.284 1.480E+05 0.00E+00 0 0 0 415 3.670 2.031 5.000E+05 0.00E+00 0 0 0 416 3.669 4.419 1.740E+06 0.00E+00 0 0 0 417 3.668 1.962 3.690E+05 0.00E+00 0 0 0 418 3.667 0.890 1.720E+05 0.00E+00 0 0 0 419 3.665 1.853 3.530E+05 0.00E+00 0 0 0 420 3.662 0.939 4.970E+05 0.00E+00 0 0 0 421 3.615 3.801 6.240E+06 0.00E+00 0 0 0 422 3.613 0.912 1.480E+05 0.00E+00 0 0 0 423 3.613 0.884 4.210E+05 0.00E+00 0 0 0 424 3.612 1.423 1.080E+05 0.00E+00 0 0 0 425 3.611 1.516 4.680E+05 0.00E+00 0 0 0 426 3.610 1.633 8.900E+04 0.00E+00 0 0 0 427 3.610 1.577 1.690E+05 0.00E+00 0 0 0 428 3.609 4.374 2.970E+05 0.00E+00 0 0 0 429 3.609 2.244 2.660E+05 0.00E+00 0 0 0 430 3.609 1.981 2.210E+06 0.00E+00 0 0 0 431 3.609 1.699 2.160E+05 0.00E+00 0 0 0 432 3.608 4.593 1.360E+06 0.00E+00 0 0 0 433 3.607 1.795 4.180E+05 0.00E+00 0 0 0 434 3.606 4.539 1.980E+06 0.00E+00 0 0 0 435 3.604 1.848 3.870E+05 0.00E+00 0 0 0 436 3.588 3.417 4.890E+05 0.00E+00 0 0 0 437 3.578 1.920 1.670E+05 0.00E+00 0 0 0 438 3.560 1.779 8.440E+04 0.00E+00 0 0 0 439 3.160 1.822 4.690E+05 0.00E+00 0 0 0 440 3.160 1.726 4.490E+05 0.00E+00 0 0 0 441 3.160 1.176 1.240E+05 0.00E+00 0 0 0 442 3.159 4.397 2.260E+05 0.00E+00 0 0 0 443 3.158 1.562 6.320E+05 0.00E+00 0 0 0 444 3.158 0.928 4.330E+04 0.00E+00 0 0 0 445 3.158 0.891 2.030E+04 0.00E+00 0 0 0 446 3.157 1.623 5.840E+05 0.00E+00 0 0 0 447 3.154 0.851 4.020E+04 0.00E+00 0 0 0 448 3.064 2.959 2.710E+06 0.00E+00 0 0 0 449 3.063 5.601 2.130E+04 0.00E+00 0 0 0 450 3.060 7.139 1.180E+06 0.00E+00 0 0 0 451 3.060 0.909 3.180E+04 0.00E+00 0 0 0 452 3.056 4.653 7.070E+05 0.00E+00 0 0 0 453 3.052 7.067 1.670E+05 0.00E+00 0 0 0 454 2.977 1.669 6.680E+05 0.00E+00 0 0 0 455 2.976 1.025 3.240E+04 0.00E+00 0 0 0 456 2.971 7.067 1.590E+05 0.00E+00 0 0 0 457 2.968 1.466 1.810E+05 0.00E+00 0 0 0 458 2.968 1.415 2.290E+05 0.00E+00 0 0 0 459 2.964 7.142 1.190E+06 0.00E+00 0 0 0 460 2.962 1.632 1.460E+06 0.00E+00 0 0 0 461 2.962 0.914 7.260E+04 0.00E+00 0 0 0 462 2.959 4.658 4.880E+05 0.00E+00 0 0 0 463 2.957 0.883 6.990E+04 0.00E+00 0 0 0 464 2.953 5.601 7.630E+03 0.00E+00 0 0 0 465 2.952 3.050 2.720E+06 0.00E+00 0 0 0 466 2.948 1.352 2.430E+05 0.00E+00 0 0 0 467 2.947 1.390 2.680E+05 0.00E+00 0 0 0 468 2.947 1.004 4.050E+04 0.00E+00 0 0 0 469 2.931 5.897 1.970E+04 0.00E+00 0 0 0 470 2.857 3.527 9.330E+05 0.00E+00 0 0 0 471 2.753 6.983 1.370E+05 0.00E+00 0 0 0 472 2.743 4.603 5.440E+05 0.00E+00 0 0 0 473 2.732 0.937 2.590E+04 0.00E+00 0 0 0 474 2.728 0.887 8.000E+04 0.00E+00 0 0 0 475 2.717 6.986 1.510E+05 0.00E+00 0 0 0 476 2.686 0.887 5.190E+04 0.00E+00 0 0 0 477 2.685 0.935 2.810E+04 0.00E+00 0 0 0 478 2.339 1.921 8.200E+04 0.00E+00 0 0 0 479 2.336 2.098 5.770E+05 0.00E+00 0 0 0 480 2.281 6.999 1.170E+04 0.00E+00 0 0 0 481 2.277 1.146 2.710E+05 0.00E+00 0 0 0 482 2.269 1.978 1.090E+06 0.00E+00 0 0 0 483 2.253 1.846 5.060E+06 0.00E+00 0 0 0 484 2.252 0.886 9.750E+04 0.00E+00 0 0 0 485 2.249 1.677 8.430E+04 0.00E+00 0 0 0 486 2.098 1.776 9.460E+04 0.00E+00 0 0 0 487 2.097 2.337 5.720E+05 0.00E+00 0 0 0 488 2.093 5.775 1.460E+04 0.00E+00 0 0 0 489 2.053 1.892 1.180E+06 0.00E+00 0 0 0 490 2.041 0.932 2.480E+06 0.00E+00 0 0 0 491 2.041 0.887 1.760E+06 0.00E+00 0 0 0 492 2.001 2.284 3.880E+05 0.00E+00 0 0 0 493 1.984 1.514 1.150E+05 0.00E+00 0 0 0 494 1.982 7.064 1.960E+04 0.00E+00 0 0 0 495 1.981 1.464 6.990E+04 0.00E+00 0 0 0 496 1.980 1.665 1.330E+05 0.00E+00 0 0 0 497 1.979 7.142 1.660E+04 0.00E+00 0 0 0 498 1.979 1.588 7.280E+04 0.00E+00 0 0 0 499 1.979 1.398 6.500E+04 0.00E+00 0 0 0 500 1.978 1.718 7.730E+04 0.00E+00 0 0 0 501 1.977 2.240 1.710E+06 0.00E+00 0 0 0 502 1.977 1.858 2.880E+06 0.00E+00 0 0 0 503 1.975 6.990 1.030E+04 0.00E+00 0 0 0 504 1.968 2.125 5.160E+04 0.00E+00 0 0 0 505 1.966 0.874 1.600E+05 0.00E+00 0 0 0 506 1.962 0.830 1.660E+05 0.00E+00 0 0 0 507 1.949 2.282 6.110E+05 0.00E+00 0 0 0 508 1.917 1.781 7.370E+05 0.00E+00 0 0 0 509 1.916 2.337 8.950E+04 0.00E+00 0 0 0 510 1.914 2.097 1.350E+05 0.00E+00 0 0 0 511 1.899 2.047 3.740E+05 0.00E+00 0 0 0 512 1.849 1.986 3.050E+06 0.00E+00 0 0 0 513 1.846 6.996 9.480E+03 0.00E+00 0 0 0 514 1.844 0.936 7.170E+04 0.00E+00 0 0 0 515 1.844 0.892 5.370E+04 0.00E+00 0 0 0 516 1.843 2.152 8.510E+04 0.00E+00 0 0 0 517 1.840 2.289 2.500E+06 0.00E+00 0 0 0 518 1.840 2.226 2.820E+06 0.00E+00 0 0 0 519 1.818 1.562 6.590E+05 0.00E+00 0 0 0 520 1.813 1.450 7.820E+05 0.00E+00 0 0 0 521 1.806 1.172 2.230E+05 0.00E+00 0 0 0 522 1.805 0.860 2.920E+06 0.00E+00 0 0 0 523 1.802 0.818 7.610E+05 0.00E+00 0 0 0 524 1.777 1.919 5.770E+05 0.00E+00 0 0 0 525 1.777 1.394 7.570E+05 0.00E+00 0 0 0 526 1.773 2.095 1.190E+05 0.00E+00 0 0 0 527 1.741 1.140 3.260E+05 0.00E+00 0 0 0 528 1.726 1.562 6.300E+05 0.00E+00 0 0 0 529 1.673 6.983 7.070E+03 0.00E+00 0 0 0 530 1.666 1.460 6.750E+05 0.00E+00 0 0 0 531 1.644 1.375 1.070E+06 0.00E+00 0 0 0 532 1.639 7.074 3.130E+03 0.00E+00 0 0 0 533 1.636 7.136 1.720E+04 0.00E+00 0 0 0 534 1.630 1.739 3.470E+05 0.00E+00 0 0 0 535 1.630 0.914 6.560E+05 0.00E+00 0 0 0 536 1.624 0.891 5.720E+05 0.00E+00 0 0 0 537 1.621 5.405 1.490E+04 0.00E+00 0 0 0 538 1.621 1.820 3.870E+05 0.00E+00 0 0 0 539 1.578 0.886 3.870E+05 0.00E+00 0 0 0 540 1.575 0.910 5.930E+05 0.00E+00 0 0 0 541 1.563 1.835 1.090E+05 0.00E+00 0 0 0 542 1.561 1.729 5.130E+05 0.00E+00 0 0 0 543 1.515 0.914 6.830E+05 0.00E+00 0 0 0 544 1.514 0.886 6.760E+05 0.00E+00 0 0 0 545 1.460 1.683 4.680E+05 0.00E+00 0 0 0 546 1.449 1.157 3.010E+06 0.00E+00 0 0 0 547 1.447 1.811 6.890E+05 0.00E+00 0 0 0 548 1.447 0.857 9.770E+05 0.00E+00 0 0 0 549 1.447 0.820 8.170E+05 0.00E+00 0 0 0 550 1.423 1.247 1.020E+05 0.00E+00 0 0 0 551 1.400 1.675 7.250E+05 0.00E+00 0 0 0 552 1.397 1.769 7.570E+05 0.00E+00 0 0 0 553 1.358 1.553 3.960E+05 0.00E+00 0 0 0 554 1.344 1.634 8.070E+05 0.00E+00 0 0 0 555 1.343 1.707 4.730E+05 0.00E+00 0 0 0 556 1.094 1.255 2.520E+05 0.00E+00 0 0 0 557 1.058 1.225 5.570E+05 0.00E+00 0 0 0 558 0.938 2.049 2.270E+06 0.00E+00 0 0 0 559 0.927 1.356 1.850E+05 0.00E+00 0 0 0 560 0.925 1.247 1.930E+05 0.00E+00 0 0 0 561 0.911 1.737 1.920E+05 0.00E+00 0 0 0 562 0.909 1.063 2.600E+05 0.00E+00 0 0 0 563 0.908 1.511 6.490E+05 0.00E+00 0 0 0 564 0.898 1.636 8.100E+05 0.00E+00 0 0 0 565 0.888 2.049 2.210E+06 0.00E+00 0 0 0 566 0.882 1.980 2.840E+05 0.00E+00 0 0 0 567 0.882 1.516 7.080E+05 0.00E+00 0 0 0 568 0.878 1.033 1.780E+05 0.00E+00 0 0 0 569 0.860 1.811 3.400E+06 0.00E+00 0 0 0 570 0.859 1.442 1.120E+06 0.00E+00 0 0 0 571 0.859 1.152 1.430E+06 0.00E+00 0 0 0 572 0.850 1.006 1.620E+05 0.00E+00 0 0 0 573 0.833 0.994 2.300E+05 0.00E+00 0 0 0 574 0.830 1.963 1.440E+05 0.00E+00 0 0 0 575 0.819 1.806 8.560E+05 0.00E+00 0 0 0 576 0.813 1.442 1.290E+06 0.00E+00 0 0 0 577 0.811 1.152 1.600E+06 0.00E+00 0 0 0 578 0.810 0.972 1.030E+05 0.00E+00 0 0 0 ; loop_ _Spectral_dim.ID _Spectral_dim.Atom_type _Spectral_dim.Atom_isotope_number _Spectral_dim.Spectral_region _Spectral_dim.Magnetization_linkage_ID _Spectral_dim.Sweep_width _Spectral_dim.Sweep_width_units _Spectral_dim.Encoding_code _Spectral_dim.Encoded_reduced_dimension_ID _Spectral_dim.Entry_ID _Spectral_dim.Spectral_peak_list_ID 2 Proton 1 H1 1 9002.9259 . . . 20110 1 stop_ save_