REMARK ROI 2D Peak Detection System, File: ./test.ft2 REMARK Detection Levels: -1.57304e+08 and 157303 REMARK Detection: X(+/-1) Y(+/-1) REMARK Interpolation: X(+/-1) Y(+/-1) REMARK Noise: 9379.26, Chi2-Threshold: 1.000000e-04, Local Adjustment: None REMARK Position Tolerances: X(2.0) Y(2.0) REMARK Sinc Detect ON, Height Adjustments: X(1.800) Y(1.200) REMARK Sinc Detect Linewidths: X(5.0Hz) Y(15.0Hz) REMARK Total Peaks: 61, Good Peaks: 53, Questionable Peaks: 8 REMARK Clusters: 42, Max Cluster Size: 9 REMARK ROI Spectral Axis Limits: DATA X_AXIS 1H 1 224 8.098ppm 1.391ppm DATA Y_AXIS 1H 1 1144 8.111ppm 1.406ppm VARS INDEX X_AXIS Y_AXIS DX DY X_PPM Y_PPM X_HZ Y_HZ XW YW XW_HZ YW_HZ X1 X3 Y1 Y3 HEIGHT DHEIGHT VOL PCHI2 TYPE ASS CLUSTID MEMCNT FORMAT %5d %9.3f %9.3f %6.3f %6.3f %8.3f %8.3f %9.3f %9.3f %7.3f %7.3f %8.3f %8.3f %4d %4d %4d %4d %+e %+e %+e %.5f %d %s %4d %4d 1 15.918 79.931 0.001 0.001 7.649 7.648 3060.752 3060.373 2.189 2.782 26.350 6.530 14 17 78 82 2.213914e+07 7.633667e+03 1.139083e+08 0.00000 1 None 1 1 2 207.295 79.990 0.007 0.004 1.893 7.648 757.478 3060.235 2.348 2.849 28.259 6.688 206 209 78 82 4.414800e+06 7.706487e+03 2.603846e+07 0.00000 1 None 2 1 3 121.673 308.909 0.013 0.010 4.468 6.305 1787.967 2522.847 2.419 3.321 29.109 7.795 120 123 307 311 2.648215e+06 7.562452e+03 2.265236e+07 0.00000 1 None 3 3 4 136.463 309.051 0.182 0.076 4.024 6.304 1609.967 2522.513 2.474 2.758 29.779 6.475 136 137 308 311 2.549783e+05 7.853226e+03 1.429827e+06 0.00000 1 None 4 2 5 191.304 309.258 0.011 0.023 2.374 6.303 949.935 2522.028 2.319 4.681 27.906 10.990 190 193 307 312 2.920250e+06 7.407689e+03 4.208826e+07 0.00000 1 None 5 2 6 61.081 311.652 0.005 0.006 6.291 6.289 2517.203 2516.407 2.178 2.874 26.213 6.747 60 62 310 314 4.539084e+06 7.806888e+03 2.440129e+07 0.00000 1 None 6 1 7 121.671 311.606 0.012 0.023 4.468 6.289 1787.985 2516.516 2.329 3.977 28.028 9.337 120 123 309 315 2.719061e+06 7.644930e+03 3.829514e+07 0.00000 1 None 3 3 8 136.397 311.678 0.177 0.360 4.026 6.289 1610.752 2516.346 2.172 4.236 26.139 9.944 136 136 309 312 1.819641e+05 7.766119e+03 7.330327e+05 0.00000 1 None 4 2 9 191.315 311.589 0.007 0.008 2.374 6.289 949.808 2516.556 2.373 3.294 28.558 7.733 190 193 310 314 5.136320e+06 7.784179e+03 4.139132e+07 0.00000 1 None 5 2 10 121.684 314.362 0.013 0.023 4.468 6.273 1787.827 2510.046 2.344 4.069 28.211 9.553 120 123 311 316 2.591058e+06 7.572206e+03 2.953672e+07 0.00000 1 None 3 3 11 136.484 314.691 0.221 0.109 4.023 6.271 1609.707 2509.274 2.477 2.594 29.807 6.088 136 137 314 315 2.311655e+05 8.198924e+03 8.042854e+05 0.00000 1 None 7 1 12 105.166 564.022 0.034 0.025 4.965 4.808 1986.634 1923.967 2.080 2.541 25.029 5.965 105 106 563 565 6.219284e+05 7.892582e+03 2.113553e+06 0.00000 3 None 8 3 13 106.966 563.981 0.006 0.013 4.911 4.809 1964.965 1924.062 1.609 3.270 19.368 7.675 106 107 562 566 1.998678e+06 8.143732e+03 5.822469e+06 0.00000 3 None 8 3 14 110.253 563.887 0.000 0.000 4.812 4.809 1925.406 1924.283 2.363 2.752 28.444 6.460 109 112 562 566 1.139570e+08 7.693365e+03 6.594567e+08 0.00000 1 None 9 1 15 103.093 564.979 0.095 0.038 5.027 4.803 2011.576 1921.721 2.471 2.166 29.733 5.084 102 105 564 565 2.779253e+05 7.556534e+03 1.795853e+06 0.00000 1 None 8 3 16 61.061 621.309 0.007 0.041 6.292 4.472 2517.437 1789.485 2.181 5.967 26.243 14.008 60 62 617 625 2.670373e+06 7.147339e+03 3.437348e+07 0.00000 1 None 10 1 17 121.715 622.242 0.015 0.027 4.467 4.467 1787.453 1787.297 2.208 4.046 26.576 9.499 120 123 619 625 1.841326e+06 7.540361e+03 1.486452e+07 0.00000 1 None 11 1 18 136.539 622.138 0.039 0.035 4.021 4.467 1609.045 1787.539 2.427 3.798 29.212 8.917 135 138 620 624 1.132149e+06 7.779816e+03 8.917780e+06 0.00000 1 None 12 1 19 143.466 622.225 0.084 0.042 3.813 4.467 1525.676 1787.335 3.731 4.268 44.901 10.018 141 146 619 625 1.229042e+06 7.315924e+03 2.135721e+07 0.00000 1 None 13 1 20 191.310 621.548 0.007 0.140 2.374 4.471 949.872 1788.925 2.262 11.945 27.226 28.041 190 193 617 627 4.245707e+06 7.310099e+03 6.034453e+07 0.00000 1 None 14 1 21 61.061 697.138 0.048 1.104 6.292 4.027 2517.447 1611.476 1.560 6.046 18.771 14.192 61 61 697 699 2.256879e+05 7.620439e+03 5.975792e+05 0.00000 1 None 15 1 22 143.805 698.221 0.023 0.005 3.803 4.021 1521.596 1608.934 5.925 3.844 71.307 9.023 141 147 695 701 7.323948e+06 7.082208e+03 1.287521e+08 0.00000 1 None 16 1 23 191.299 698.176 0.019 0.044 2.374 4.021 949.996 1609.041 2.298 5.096 27.652 11.962 190 193 695 702 1.566133e+06 7.383547e+03 1.708227e+07 0.00000 1 None 17 1 24 121.715 698.634 0.029 0.180 4.467 4.019 1787.456 1607.965 2.114 6.504 25.444 15.268 121 123 695 702 8.612120e+05 7.436628e+03 9.399660e+06 0.00000 1 None 18 1 25 136.644 699.892 0.033 0.031 4.018 4.011 1607.780 1605.011 2.469 3.823 29.709 8.975 135 138 697 702 1.146690e+06 7.472437e+03 1.147797e+07 0.00000 1 None 19 1 26 121.724 726.228 0.095 0.127 4.467 3.857 1787.353 1543.187 2.151 3.444 25.889 8.084 121 122 725 727 2.774153e+05 7.696931e+03 1.196262e+06 0.00000 1 None 20 1 27 136.509 726.092 0.035 0.020 4.022 3.857 1609.404 1543.506 2.498 3.240 30.066 7.606 135 138 724 728 1.405138e+06 7.910566e+03 9.973295e+06 0.00000 1 None 21 2 28 142.767 726.340 0.012 0.009 3.834 3.856 1534.093 1542.925 2.919 3.227 35.136 7.576 141 145 724 728 3.737516e+06 7.448204e+03 3.399374e+07 0.00000 1 None 22 2 29 136.552 731.442 0.014 0.015 4.021 3.826 1608.891 1530.947 2.428 3.303 29.217 7.753 135 138 729 733 3.378109e+06 8.065517e+03 2.384576e+07 0.00000 1 None 21 2 30 143.119 731.259 0.007 0.004 3.823 3.827 1529.852 1531.377 3.285 3.129 39.536 7.345 141 145 729 733 6.529787e+06 7.285855e+03 7.008016e+07 0.00000 1 None 22 2 31 191.266 731.230 0.085 0.095 2.375 3.827 950.393 1531.446 2.196 3.192 26.432 7.494 191 192 730 732 3.207947e+05 7.732447e+03 1.344967e+06 0.00000 1 None 23 1 32 121.764 731.620 0.039 0.067 4.466 3.825 1786.868 1530.530 2.206 3.491 26.551 8.196 121 123 730 733 6.805598e+05 7.636758e+03 4.102315e+06 0.00000 1 None 24 1 33 144.276 739.235 0.043 0.011 3.789 3.780 1515.928 1512.654 5.969 4.216 71.836 9.896 141 147 737 742 4.404150e+06 7.068271e+03 7.724131e+07 0.00000 1 None 25 2 34 191.369 739.043 0.130 0.145 2.372 3.782 949.156 1513.105 2.281 3.931 27.447 9.228 191 192 738 740 2.572096e+05 7.637091e+03 1.222433e+06 0.00000 1 None 26 1 35 121.718 739.667 0.052 0.270 4.467 3.778 1787.427 1511.639 2.131 6.159 25.645 14.458 121 122 738 742 4.846305e+05 7.419083e+03 3.341401e+06 0.00000 1 None 27 1 36 136.555 739.620 0.015 0.047 4.021 3.778 1608.849 1511.749 2.384 5.622 28.686 13.198 135 138 737 744 2.692668e+06 7.689983e+03 2.991652e+07 0.00000 1 None 28 2 37 144.911 744.104 0.010 0.015 3.769 3.752 1508.283 1501.224 2.593 4.299 31.205 10.092 143 147 741 747 2.827658e+06 7.137458e+03 5.044517e+07 0.00000 1 None 25 2 38 121.711 745.378 0.115 0.819 4.467 3.744 1787.501 1498.234 2.125 6.933 25.573 16.276 121 122 744 746 2.157042e+05 7.313301e+03 1.084357e+06 0.00000 1 None 29 1 39 136.574 744.796 0.031 0.135 4.020 3.748 1608.627 1499.599 2.346 7.531 28.239 17.680 135 138 739 747 1.230654e+06 7.530688e+03 3.140011e+07 0.00000 1 None 28 2 40 190.772 973.121 0.140 0.049 2.390 2.408 956.340 963.604 2.405 2.079 28.943 4.881 191 191 973 973 2.273718e+05 7.986071e+03 2.218465e+05 0.00000 1 None 30 1 41 61.058 979.140 0.007 0.011 6.292 2.373 2517.476 949.474 2.143 3.487 25.787 8.186 60 62 977 981 2.683091e+06 7.368287e+03 1.997844e+07 0.00000 1 None 31 1 42 121.706 979.197 0.010 0.010 4.467 2.373 1787.570 949.341 2.323 3.450 27.952 8.098 120 123 977 981 3.162758e+06 7.568057e+03 2.587594e+07 0.00000 1 None 32 1 43 136.529 979.256 0.053 0.060 4.022 2.372 1609.163 949.203 2.250 3.598 27.075 8.446 136 137 976 982 7.534179e+05 8.130463e+03 6.322473e+06 0.00000 1 None 33 1 44 144.305 979.303 0.471 0.146 3.788 2.372 1515.580 949.094 4.388 3.352 52.806 7.869 143 145 978 980 2.379154e+05 7.260520e+03 1.673556e+06 0.00000 1 None 34 1 45 191.312 979.191 0.002 0.002 2.374 2.373 949.847 949.356 2.392 3.476 28.783 8.160 190 193 976 982 1.965492e+07 7.572729e+03 2.119300e+08 0.00000 1 None 35 2 46 195.156 980.155 0.087 0.041 2.258 2.367 903.576 947.092 2.109 1.963 25.387 4.608 195 195 980 980 2.751875e+05 8.650417e+03 2.688709e+05 0.00000 3 None 36 1 47 196.963 980.155 0.409 0.037 2.204 2.367 881.835 947.092 4.313 1.694 51.909 3.976 197 197 980 980 1.947765e+05 7.623493e+03 1.914702e+05 0.00000 3 None 37 1 48 195.088 983.022 0.173 0.046 2.260 2.350 904.399 940.363 2.777 1.979 33.417 4.646 195 195 983 983 1.808341e+05 7.098228e+03 1.804279e+05 0.00000 1 None 38 1 49 191.667 987.525 0.142 0.328 2.363 2.324 945.568 929.792 2.339 4.244 28.145 9.963 191 192 985 989 2.420989e+05 7.626483e+03 2.502822e+06 0.00000 1 None 35 2 50 202.048 1034.067 0.047 0.038 2.051 2.051 820.629 820.533 2.230 2.710 26.837 6.361 201 203 1033 1035 4.460134e+05 7.635180e+03 2.022497e+06 0.00000 1 None 39 1 51 15.930 1060.908 0.004 0.007 7.649 1.893 3060.598 757.523 1.723 2.886 20.738 6.776 15 17 1059 1063 3.204818e+06 8.210454e+03 8.917284e+06 0.00000 1 None 40 1 52 207.323 1061.279 0.000 0.000 1.892 1.891 757.145 756.654 2.369 2.696 28.515 6.329 206 209 1059 1063 7.847899e+07 7.975286e+03 4.287602e+08 0.00000 1 None 41 9 53 201.947 1062.792 0.053 0.046 2.054 1.882 821.843 753.102 2.885 2.677 34.716 6.284 200 204 1062 1063 9.056639e+05 8.212873e+03 8.196780e+06 0.00000 3 None 41 9 54 203.846 1062.819 0.017 0.055 1.997 1.882 798.992 753.038 1.777 3.076 21.391 7.221 203 204 1062 1063 1.515841e+06 1.132395e+04 3.659249e+06 0.00000 3 None 41 9 55 211.185 1062.596 0.017 0.024 1.776 1.883 710.671 753.562 2.015 2.616 24.247 6.140 211 213 1062 1063 1.850138e+06 1.074000e+04 6.726154e+06 0.00000 3 None 41 9 56 212.948 1062.450 0.090 0.015 1.723 1.884 689.446 753.905 4.628 2.104 55.700 4.939 211 216 1062 1063 1.229912e+06 8.374369e+03 1.200720e+07 0.00000 3 None 41 9 57 214.797 1062.418 0.151 0.014 1.667 1.884 667.198 753.979 5.326 2.044 64.094 4.798 211 219 1062 1063 1.097313e+06 7.971516e+03 1.592408e+07 0.00000 1 None 41 9 58 187.833 1063.099 0.724 0.021 2.478 1.880 991.712 752.382 6.408 1.578 77.126 3.704 185 193 1063 1063 2.621610e+05 7.253312e+03 2.255602e+06 0.00000 1 None 41 9 59 191.294 1062.922 0.381 0.019 2.374 1.881 950.055 752.797 4.609 1.636 55.472 3.841 188 194 1063 1063 3.230800e+05 7.434355e+03 2.061649e+06 0.00000 1 None 41 9 60 198.526 1062.800 0.233 0.012 2.157 1.882 863.016 753.083 4.566 1.870 54.947 4.390 196 202 1062 1063 7.368955e+05 7.272883e+03 8.441028e+06 0.00000 1 None 41 9 61 212.837 1089.167 0.057 0.044 1.726 1.727 690.788 691.185 2.285 2.715 27.502 6.374 212 214 1088 1090 4.478096e+05 7.727224e+03 2.055048e+06 0.00000 1 None 42 1