REMARK ROI 2D Peak Detection System, File: /data/spectra/expnmr_00109_2.ft2 REMARK Detection Levels: -3.41204e+08 and 341203 REMARK Detection: X(+/-1) Y(+/-1) REMARK Interpolation: X(+/-1) Y(+/-1) REMARK Noise: 8533.21, 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: 40, Good Peaks: 40, Questionable Peaks: 0 REMARK Clusters: 33, Max Cluster Size: 3 REMARK ROI Spectral Axis Limits: DATA X_AXIS 1H 1 232 7.811ppm 2.153ppm DATA Y_AXIS 1H 1 954 7.821ppm 2.230ppm 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 9.863 41.004 0.002 0.001 7.594 7.586 3038.463 3035.488 2.222 2.777 21.776 6.520 8 11 39 43 1.331777e+07 6.948504e+03 7.384971e+07 0.00000 1 None 1 1 2 105.688 41.056 0.045 0.015 5.247 7.586 2099.364 3035.366 2.794 2.538 27.380 5.958 105 107 40 42 9.360888e+05 6.892885e+03 4.843590e+06 0.00000 1 None 2 1 3 113.036 41.064 0.030 0.015 5.067 7.586 2027.360 3035.348 2.731 2.622 26.766 6.154 112 114 40 42 9.370998e+05 6.716748e+03 5.009301e+06 0.00000 1 None 3 1 4 51.793 215.579 0.003 0.004 6.567 6.562 2627.543 2625.672 2.215 3.050 21.707 7.161 50 53 214 218 7.953931e+06 7.124426e+03 4.784231e+07 0.00000 1 None 4 1 5 105.736 215.681 0.027 0.016 5.246 6.561 2098.902 2625.434 2.734 2.758 26.790 6.474 104 107 214 217 1.438578e+06 6.939177e+03 9.954335e+06 0.00000 1 None 5 1 6 112.901 215.680 0.024 0.021 5.070 6.561 2028.682 2625.435 2.589 2.874 25.368 6.747 112 114 214 217 1.134275e+06 6.836735e+03 6.928086e+06 0.00000 1 None 6 1 7 105.602 436.412 0.006 0.004 5.249 5.266 2100.212 2107.265 2.815 2.936 27.592 6.893 104 107 434 438 8.437014e+06 7.167390e+03 6.599339e+07 0.00000 1 None 7 2 8 219.021 436.281 0.040 0.058 2.471 5.267 988.690 2107.572 2.166 3.064 21.227 7.192 219 219 436 437 4.612709e+05 6.986790e+03 8.348641e+05 0.00000 1 None 8 1 9 105.609 441.952 0.006 0.002 5.249 5.234 2100.143 2094.259 3.001 2.753 29.415 6.464 104 108 440 444 9.503725e+06 6.844757e+03 7.796342e+07 0.00000 1 None 7 2 10 112.853 442.394 0.010 0.012 5.071 5.231 2029.151 2093.222 2.283 2.848 22.371 6.685 112 114 441 444 2.288992e+06 7.164361e+03 1.247963e+07 0.00000 1 None 9 1 11 219.061 441.903 0.028 0.028 2.470 5.234 988.303 2094.375 2.173 2.931 21.295 6.880 219 220 441 443 6.596432e+05 6.871420e+03 2.413283e+06 0.00000 1 None 10 1 12 219.025 468.543 0.028 0.063 2.471 5.078 988.653 2031.838 2.100 3.147 20.578 7.387 219 219 468 469 6.741452e+05 7.294761e+03 1.264583e+06 0.00000 1 None 11 1 13 106.028 468.627 0.011 0.014 5.238 5.077 2096.041 2031.640 2.314 2.900 22.681 6.807 105 107 467 470 1.897290e+06 6.909274e+03 1.108905e+07 0.00000 1 None 12 3 14 113.091 468.731 0.003 0.002 5.065 5.077 2026.814 2031.396 2.834 2.749 27.772 6.454 111 115 467 471 1.100592e+07 6.769032e+03 8.365387e+07 0.00000 1 None 12 3 15 113.142 474.150 0.004 0.002 5.064 5.045 2026.317 2018.676 2.915 2.703 28.568 6.346 111 115 472 476 8.995026e+06 6.711241e+03 6.982316e+07 0.00000 1 None 12 3 16 219.062 474.102 0.039 0.034 2.470 5.045 988.295 2018.789 2.207 2.782 21.633 6.530 219 219 474 475 4.912002e+05 6.973956e+03 8.303660e+05 0.00000 1 None 13 1 17 105.421 475.437 0.842 0.036 5.253 5.037 2101.983 2015.655 6.032 2.049 59.118 4.809 105 106 475 475 4.596522e+05 7.965591e+03 7.784916e+05 0.00000 1 None 14 1 18 122.585 502.390 0.053 0.087 4.833 4.879 1933.773 1952.382 2.233 3.749 21.880 8.800 122 123 500 505 6.110529e+05 7.190197e+03 6.711178e+06 0.00000 1 None 15 2 19 184.552 510.909 0.150 0.030 3.315 4.829 1326.496 1932.383 2.678 2.143 26.248 5.030 184 185 511 511 4.517958e+05 8.682732e+03 7.918490e+05 0.00000 1 None 16 1 20 123.057 512.372 0.000 0.000 4.821 4.821 1929.148 1928.950 2.194 2.893 21.504 6.791 121 125 510 514 3.240821e+08 7.099917e+03 1.732729e+09 0.00000 1 None 15 2 21 168.225 512.451 0.114 0.148 3.715 4.820 1486.499 1928.764 2.755 3.598 26.997 8.447 168 168 512 512 4.337433e+05 9.237367e+03 4.150375e+05 0.00000 1 None 17 2 22 172.090 512.290 0.040 0.023 3.620 4.821 1448.618 1929.142 2.289 2.109 22.431 4.951 172 172 512 513 5.793289e+05 7.415972e+03 1.027717e+06 0.00000 1 None 18 1 23 178.348 512.044 0.072 0.015 3.467 4.823 1387.293 1929.720 2.589 1.937 25.375 4.547 178 179 512 512 6.243249e+05 8.074571e+03 1.092252e+06 0.00000 1 None 19 2 24 219.078 512.777 0.069 0.091 2.470 4.818 988.133 1927.999 2.397 2.736 23.493 6.422 219 219 512 513 5.435074e+05 9.317027e+03 8.770606e+05 0.00000 1 None 20 2 27 143.107 512.942 0.116 0.028 4.330 4.817 1732.657 1927.611 3.033 2.069 29.727 4.857 143 143 513 513 3.586630e+05 7.727444e+03 3.572122e+05 0.00000 1 None 21 1 28 180.395 513.020 0.337 0.023 3.417 4.817 1367.230 1927.429 4.949 2.264 48.502 5.316 180 181 513 513 5.175000e+05 7.757512e+03 9.360621e+05 0.00000 1 None 19 2 30 137.448 514.339 1.060 0.032 4.469 4.809 1788.117 1924.332 6.849 2.016 67.119 4.733 138 138 514 514 4.237743e+05 7.724886e+03 3.955075e+05 0.00000 1 None 22 1 31 156.595 514.262 0.129 0.020 4.000 4.810 1600.470 1924.513 3.085 1.886 30.232 4.426 156 157 514 514 5.809906e+05 8.285247e+03 9.692850e+05 0.00000 1 None 23 1 32 166.571 514.168 0.232 0.024 3.756 4.810 1502.706 1924.734 3.693 2.144 36.194 5.033 166 167 514 515 5.825504e+05 8.465354e+03 1.475967e+06 0.00000 1 None 17 2 33 203.059 514.323 0.072 0.039 2.862 4.809 1145.123 1924.369 2.601 2.245 25.486 5.271 203 203 514 514 4.623611e+05 8.435353e+03 4.428230e+05 0.00000 1 None 24 1 34 209.829 514.383 0.098 0.033 2.696 4.809 1078.773 1924.229 2.960 2.094 29.005 4.915 210 210 514 515 4.478398e+05 7.326297e+03 7.886275e+05 0.00000 1 None 25 1 35 216.836 514.064 0.059 0.015 2.524 4.811 1010.111 1924.978 2.920 2.133 28.615 5.006 216 217 514 515 6.532142e+05 7.162542e+03 1.948537e+06 0.00000 1 None 20 2 36 226.838 513.829 0.036 0.091 2.279 4.812 912.082 1925.529 1.811 3.869 17.745 9.082 227 227 513 514 4.008098e+05 7.029915e+03 7.667498e+05 0.00000 1 None 26 1 37 229.954 514.874 0.022 0.184 2.203 4.806 881.546 1923.076 1.465 3.679 14.361 8.637 230 230 514 515 6.038821e+05 9.837723e+03 1.041441e+06 0.00000 1 None 27 1 38 212.552 884.661 0.142 0.065 2.629 2.637 1052.095 1054.999 2.774 2.721 27.183 6.388 212 213 885 885 3.856354e+05 7.213251e+03 7.008808e+05 0.00000 1 None 28 1 39 105.710 911.795 0.028 0.017 5.246 2.477 2099.150 991.302 2.326 2.576 22.794 6.046 105 106 911 913 1.050055e+06 7.165815e+03 4.046560e+06 0.00000 1 None 29 1 40 112.956 911.661 0.024 0.027 5.069 2.478 2028.143 991.615 2.277 2.739 22.320 6.429 112 114 911 913 8.709620e+05 7.060824e+03 4.007922e+06 0.00000 1 None 30 1 41 219.067 911.958 0.000 0.000 2.470 2.476 988.242 990.918 2.259 2.734 22.142 6.418 218 221 910 914 8.022401e+07 6.904923e+03 4.499493e+08 0.00000 1 None 31 1 42 213.490 914.002 1.024 0.009 2.606 2.464 1042.899 986.121 8.116 1.426 79.533 3.347 211 215 914 914 4.766798e+05 6.719139e+03 2.172982e+06 0.00000 1 None 32 1 43 225.843 939.955 0.060 0.034 2.304 2.312 921.841 925.195 2.435 2.631 23.860 6.176 226 226 940 940 4.224778e+05 6.890384e+03 4.187072e+05 0.00000 1 None 33 1