REMARK ROI 2D Peak Detection System, File: ./test.ft2 REMARK Detection Levels: -5.16268e+08 and 516268 REMARK Detection: X(+/-1) Y(+/-1) REMARK Interpolation: X(+/-1) Y(+/-1) REMARK Noise: 7500.34, 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: 48, Good Peaks: 48, Questionable Peaks: 0 REMARK Clusters: 37, Max Cluster Size: 3 REMARK ROI Spectral Axis Limits: DATA X_AXIS 1H 1 111 5.459ppm 3.284ppm DATA Y_AXIS 1H 1 395 5.502ppm 3.190ppm 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 9.093 36.871 0.003 0.005 5.299 5.291 2120.132 2117.145 2.191 3.682 17.328 8.643 8 10 35 39 4.825374e+06 5.869038e+03 3.266691e+07 0.00000 1 None 1 1 2 79.575 36.934 0.032 0.018 3.905 5.291 1562.697 2116.997 2.734 3.513 21.623 8.246 78 81 36 38 1.324033e+06 6.022111e+03 9.328749e+06 0.00000 1 None 2 1 3 34.012 120.443 0.000 0.000 4.806 4.801 1923.047 1920.958 2.238 3.294 17.697 7.732 32 35 118 122 7.831038e+07 6.108690e+03 5.284546e+08 0.00000 1 None 3 1 4 45.814 158.378 0.009 0.008 4.573 4.578 1829.705 1831.905 2.420 2.708 19.138 6.357 45 47 157 160 2.714231e+06 6.326076e+03 1.533607e+07 0.00000 1 None 4 2 5 64.223 158.393 0.033 0.036 4.209 4.578 1684.112 1831.870 2.205 2.776 17.437 6.516 64 64 158 159 6.801620e+05 6.500956e+03 1.205142e+06 0.00000 1 None 5 1 6 90.545 158.385 0.012 0.004 3.689 4.578 1475.935 1831.889 2.946 2.537 23.298 5.955 89 92 157 160 4.760824e+06 6.452872e+03 3.316836e+07 0.00000 1 None 6 2 7 45.897 161.814 0.008 0.005 4.571 4.558 1829.056 1823.839 2.504 2.561 19.801 6.013 45 47 160 163 2.742323e+06 6.078724e+03 1.581990e+07 0.00000 1 None 4 2 8 64.268 161.767 0.035 0.023 4.208 4.558 1683.760 1823.950 2.347 2.651 18.562 6.222 64 65 161 162 7.431669e+05 6.304193e+03 2.311739e+06 0.00000 1 None 7 1 9 90.602 161.856 0.010 0.002 3.687 4.558 1475.486 1823.740 3.030 2.393 23.962 5.617 89 92 160 163 5.030993e+06 6.141212e+03 3.535851e+07 0.00000 1 None 6 2 10 54.238 188.491 0.002 0.003 4.406 4.402 1763.086 1761.214 2.264 2.957 17.908 6.941 53 55 187 190 1.090686e+07 6.477287e+03 5.791930e+07 0.00000 1 None 8 2 11 51.345 189.313 0.084 0.015 4.463 4.397 1785.967 1759.284 3.434 2.076 27.155 4.873 51 53 189 190 7.656633e+05 6.202793e+03 7.469228e+06 0.00000 1 None 8 2 12 60.853 189.104 0.018 0.014 4.276 4.398 1710.767 1759.776 2.153 2.624 17.031 6.160 60 61 188 190 9.466355e+05 6.085401e+03 3.414481e+06 0.00000 1 None 9 1 13 54.276 211.007 0.029 0.022 4.406 4.269 1762.782 1708.359 2.462 3.315 19.468 7.781 54 55 210 212 9.114488e+05 5.945047e+03 4.144968e+06 0.00000 1 None 10 1 14 60.931 210.700 0.002 0.004 4.274 4.271 1710.152 1709.079 2.191 3.474 17.331 8.156 59 62 209 213 6.807959e+06 5.963762e+03 4.627297e+07 0.00000 1 None 11 1 15 83.866 210.822 0.030 0.027 3.821 4.271 1528.764 1708.793 2.572 3.245 20.339 7.618 83 84 210 212 7.865778e+05 5.875812e+03 3.425419e+06 0.00000 1 None 12 1 16 45.856 222.123 0.018 0.020 4.572 4.204 1829.378 1682.265 2.352 3.391 18.601 7.960 45 47 221 223 1.106957e+06 5.893586e+03 6.070494e+06 0.00000 1 None 13 1 17 64.252 222.084 0.002 0.002 4.208 4.205 1683.885 1682.354 2.329 3.366 18.421 7.901 63 66 220 224 9.301050e+06 5.997195e+03 6.446657e+07 0.00000 1 None 14 1 18 71.997 222.432 0.010 0.036 4.055 4.202 1622.629 1681.539 1.968 3.817 15.565 8.961 71 73 221 224 1.289925e+06 6.081844e+03 7.388996e+06 0.00000 1 None 15 1 19 90.584 222.213 0.028 0.016 3.688 4.204 1475.631 1682.052 2.754 3.254 21.777 7.638 89 92 221 224 1.523238e+06 6.097199e+03 1.184316e+07 0.00000 1 None 16 1 20 69.465 239.173 0.041 0.017 4.105 4.104 1642.654 1642.240 2.648 2.804 20.945 6.582 69 70 238 240 1.060593e+06 6.351044e+03 4.647984e+06 0.00000 1 None 17 1 21 70.740 242.148 0.044 0.055 4.080 4.087 1632.572 1635.256 2.500 4.102 19.773 9.629 71 71 242 245 6.200587e+05 6.010272e+03 3.003132e+06 0.00000 1 None 18 3 22 64.335 248.381 0.024 0.015 4.207 4.050 1683.231 1620.623 2.583 2.700 20.428 6.338 63 65 247 249 1.475092e+06 6.361470e+03 7.202464e+06 0.00000 1 None 18 3 23 71.995 247.909 0.001 0.001 4.055 4.053 1622.646 1621.731 2.249 2.715 17.786 6.372 70 73 246 250 2.384440e+07 6.091009e+03 1.257476e+08 0.00000 1 None 18 3 24 75.752 249.216 0.234 0.012 3.981 4.045 1592.930 1618.662 5.397 1.755 42.686 4.119 76 76 249 249 5.720379e+05 6.190312e+03 5.525541e+05 0.00000 1 None 19 1 25 83.701 270.039 0.049 0.023 3.824 3.923 1530.067 1569.781 2.716 2.914 21.479 6.840 83 84 270 270 6.882396e+05 5.981944e+03 1.249916e+06 0.00000 1 None 20 1 26 79.551 270.925 0.031 0.016 3.906 3.918 1562.883 1567.700 2.772 3.381 21.927 7.938 78 81 270 273 1.427365e+06 6.049121e+03 1.315103e+07 0.00000 1 None 21 2 27 9.080 274.613 0.021 0.056 5.299 3.896 2120.230 1559.042 1.952 3.474 15.435 8.154 9 9 274 275 6.412645e+05 6.132117e+03 1.192307e+06 0.00000 1 None 22 1 28 79.644 274.856 0.016 0.009 3.904 3.895 1562.153 1558.473 2.687 3.168 21.248 7.438 78 81 273 277 2.362734e+06 6.034926e+03 2.034749e+07 0.00000 1 None 21 2 29 83.807 275.229 0.021 0.014 3.822 3.893 1529.230 1557.598 2.675 2.961 21.154 6.951 83 85 274 276 1.368781e+06 5.948747e+03 7.659146e+06 0.00000 1 None 23 1 30 60.913 286.329 0.022 0.051 4.274 3.828 1710.290 1531.540 2.121 3.713 16.776 8.717 61 61 286 287 7.119201e+05 5.967521e+03 1.337813e+06 0.00000 1 None 24 1 31 79.691 286.116 0.019 0.012 3.903 3.829 1561.778 1532.039 2.640 3.272 20.880 7.682 78 81 285 288 1.712330e+06 5.956988e+03 1.304734e+07 0.00000 1 None 25 1 32 83.893 286.734 0.012 0.020 3.820 3.825 1528.546 1530.588 2.582 4.049 20.423 9.505 83 85 285 290 1.856025e+06 5.768901e+03 1.908668e+07 0.00000 1 None 26 2 33 83.953 290.202 0.017 0.105 3.819 3.805 1528.074 1522.447 2.487 7.764 19.667 18.226 83 85 285 292 1.167799e+06 5.667129e+03 2.339704e+07 0.00000 1 None 26 2 34 79.794 291.145 0.031 0.022 3.901 3.799 1560.966 1520.233 2.632 3.144 20.815 7.381 79 80 290 292 8.684554e+05 5.876171e+03 3.869984e+06 0.00000 1 None 27 1 35 45.827 307.940 0.006 0.006 4.573 3.701 1829.604 1480.808 2.406 3.358 19.026 7.883 44 47 306 310 3.562890e+06 5.882178e+03 2.905591e+07 0.00000 1 None 28 2 36 64.272 307.980 0.031 0.029 4.208 3.701 1683.726 1480.713 2.257 3.387 17.849 7.950 64 65 307 309 7.255614e+05 6.028802e+03 3.209442e+06 0.00000 1 None 29 1 37 90.553 307.918 0.029 0.012 3.688 3.701 1475.876 1480.860 2.858 3.177 22.603 7.459 89 92 306 310 1.669522e+06 6.057492e+03 1.540007e+07 0.00000 1 None 30 2 38 45.850 312.100 0.005 0.005 4.572 3.676 1829.423 1471.041 2.393 3.378 18.928 7.930 44 47 310 314 4.207554e+06 5.890828e+03 3.370163e+07 0.00000 1 None 28 2 39 64.264 311.954 0.024 0.023 4.208 3.677 1683.788 1471.385 2.256 3.388 17.840 7.954 64 65 311 313 9.111695e+05 6.040932e+03 4.006272e+06 0.00000 1 None 31 1 40 90.644 312.117 0.018 0.010 3.687 3.676 1475.156 1471.002 2.721 3.243 21.518 7.614 89 92 310 314 2.081771e+06 5.999767e+03 1.830331e+07 0.00000 1 None 30 2 41 45.775 339.025 0.036 0.017 4.574 3.518 1830.017 1407.836 2.480 2.594 19.618 6.089 45 46 339 339 7.163274e+05 6.095034e+03 1.251880e+06 0.00000 1 None 32 1 42 90.880 339.167 0.039 0.023 3.682 3.518 1473.291 1407.503 2.523 2.580 19.956 6.056 91 91 339 339 5.864086e+05 6.060103e+03 5.789256e+05 0.00000 1 None 33 1 43 100.104 339.084 0.020 0.008 3.500 3.518 1400.335 1407.696 2.912 2.491 23.033 5.848 99 101 338 341 1.485570e+06 5.913033e+03 9.787388e+06 0.00000 1 None 34 3 44 45.880 342.627 0.027 0.030 4.571 3.497 1829.187 1399.380 2.397 2.884 18.957 6.769 45 46 342 343 7.906858e+05 6.131894e+03 2.496232e+06 0.00000 1 None 35 1 45 64.306 342.742 0.046 0.032 4.207 3.497 1683.459 1399.110 2.363 2.754 18.690 6.464 64 64 343 343 5.977882e+05 6.267424e+03 5.686098e+05 0.00000 1 None 36 1 46 90.896 342.822 0.030 0.029 3.682 3.496 1473.158 1398.922 2.371 3.002 18.748 7.048 91 91 342 343 6.478305e+05 5.936979e+03 1.190853e+06 0.00000 1 None 37 1 47 100.113 342.829 0.012 0.006 3.500 3.496 1400.262 1398.906 2.886 2.649 22.828 6.219 99 102 341 345 2.486946e+06 5.905979e+03 1.898512e+07 0.00000 1 None 34 3 48 100.161 346.659 0.027 0.015 3.499 3.474 1399.883 1389.914 2.885 2.616 22.816 6.140 99 101 345 347 1.204534e+06 6.082985e+03 6.608954e+06 0.00000 1 None 34 3