REMARK ROI 2D Peak Detection System, File: /data/spectra/expnmr_00065_2.ft2 REMARK Detection Levels: -2.8542e+08 and 285419 REMARK Detection: X(+/-1) Y(+/-1) REMARK Interpolation: X(+/-1) Y(+/-1) REMARK Noise: 9518.86, 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: 42, Good Peaks: 42, Questionable Peaks: 0 REMARK Clusters: 29, Max Cluster Size: 3 REMARK ROI Spectral Axis Limits: DATA X_AXIS 1H 1 230 8.557ppm 3.539ppm DATA Y_AXIS 1H 1 846 8.597ppm 3.640ppm 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 11.756 49.378 0.001 0.001 8.321 8.314 3329.583 3326.570 2.169 2.769 19.016 6.499 10 13 48 51 2.525389e+07 8.225384e+03 1.299842e+08 0.00000 1 None 1 2 2 11.991 52.724 0.036 0.032 8.316 8.294 3327.528 3318.715 2.278 2.561 19.972 6.012 11 12 51 53 6.572209e+05 8.084456e+03 1.248197e+07 0.00000 1 None 1 2 3 12.345 70.321 0.148 0.027 8.308 8.191 3324.420 3277.407 3.956 2.422 34.692 5.686 10 15 70 71 7.070326e+05 7.641830e+03 7.377100e+06 0.00000 1 None 2 2 4 17.225 70.078 0.003 0.001 8.201 8.192 3281.631 3277.978 2.432 2.498 21.321 5.864 15 18 68 72 1.106398e+07 7.855818e+03 5.657756e+07 0.00000 1 None 2 2 5 114.305 431.427 0.011 0.021 6.074 6.072 2430.383 2429.709 2.347 4.044 20.582 9.493 113 116 429 434 3.157989e+06 7.708028e+03 3.226565e+07 0.00000 1 None 3 2 6 174.443 431.339 0.007 0.008 4.756 6.073 1903.064 2429.914 2.525 3.755 22.137 8.815 173 176 429 434 7.076372e+06 7.865467e+03 7.657105e+07 0.00000 1 None 4 2 7 188.868 431.345 0.006 0.013 4.440 6.073 1776.577 2429.901 2.238 3.943 19.623 9.256 187 190 429 434 4.133987e+06 7.490441e+03 4.095475e+07 0.00000 1 None 5 2 8 196.082 431.484 0.057 0.125 4.282 6.072 1713.322 2429.574 2.265 3.472 19.858 8.150 196 196 431 433 4.033112e+05 7.555013e+03 1.217020e+06 0.00000 1 None 6 2 9 114.341 432.767 0.011 0.010 6.073 6.064 2430.071 2426.563 2.439 3.434 21.387 8.062 113 116 431 435 3.428365e+06 7.731351e+03 2.790567e+07 0.00000 1 None 3 2 10 174.458 432.770 0.007 0.005 4.756 6.064 1902.929 2426.556 2.581 3.429 22.632 8.050 173 176 430 435 7.461809e+06 7.896040e+03 7.761122e+07 0.00000 1 None 4 2 11 188.875 432.762 0.005 0.009 4.440 6.064 1776.517 2426.573 2.269 3.694 19.894 8.672 187 190 430 435 4.335474e+06 7.502667e+03 4.149116e+07 0.00000 1 None 5 2 12 196.089 432.886 0.054 0.089 4.282 6.064 1713.261 2426.282 2.365 4.087 20.738 9.595 196 197 431 434 4.456065e+05 7.500199e+03 2.599570e+06 0.00000 1 None 6 2 13 129.127 642.632 0.030 0.039 5.749 4.833 2300.416 1933.902 2.046 2.676 17.943 6.281 129 130 641 643 7.052671e+05 8.186722e+03 2.469007e+06 0.00000 1 None 7 1 14 171.062 643.250 0.000 0.000 4.830 4.830 1932.713 1932.452 2.263 2.933 19.846 6.884 169 173 641 645 9.315611e+07 7.707513e+03 5.604597e+08 0.00000 1 None 8 2 16 114.331 655.969 0.007 0.005 6.073 4.755 2430.157 1902.594 2.431 3.403 21.315 7.990 113 116 654 658 5.200446e+06 7.658011e+03 4.306615e+07 0.00000 1 None 9 1 17 174.478 655.974 0.019 0.010 4.755 4.755 1902.757 1902.583 2.644 3.276 23.180 7.691 172 176 654 658 2.816320e+06 7.869437e+03 2.732312e+07 0.00000 1 None 8 2 18 188.882 656.005 0.005 0.007 4.440 4.755 1776.450 1902.509 2.272 3.543 19.926 8.316 187 190 653 659 4.223560e+06 7.441397e+03 4.123049e+07 0.00000 1 None 10 1 19 196.117 656.034 0.018 0.021 4.281 4.755 1713.009 1902.441 2.303 3.519 20.198 8.261 195 197 654 658 1.298269e+06 7.440735e+03 1.020961e+07 0.00000 1 None 11 1 20 114.314 709.444 0.012 0.030 6.074 4.441 2430.306 1777.061 2.326 4.467 20.399 10.487 113 115 706 712 2.840888e+06 7.679964e+03 2.632965e+07 0.00000 1 None 12 1 21 188.877 709.517 0.007 0.030 4.440 4.441 1776.501 1776.891 2.197 4.590 19.267 10.774 188 190 707 713 3.182321e+06 7.518175e+03 2.995830e+07 0.00000 1 None 13 1 22 174.507 709.519 0.013 0.025 4.755 4.441 1902.504 1776.886 2.529 4.489 22.180 10.537 173 176 707 713 3.996691e+06 7.973801e+03 4.202348e+07 0.00000 1 None 14 1 23 196.145 709.576 0.008 0.031 4.280 4.440 1712.766 1776.751 2.195 4.806 19.251 11.282 195 198 707 713 2.931677e+06 7.434560e+03 2.888240e+07 0.00000 1 None 15 1 24 213.164 709.577 0.042 0.063 3.908 4.440 1563.536 1776.748 3.262 4.449 28.599 10.445 211 215 707 712 1.182403e+06 7.333832e+03 1.903619e+07 0.00000 1 None 16 2 25 215.502 709.565 0.227 0.065 3.856 4.440 1543.038 1776.777 5.746 4.428 50.382 10.394 212 217 707 712 1.180860e+06 7.357757e+03 2.538012e+07 0.00000 1 None 16 2 26 174.468 736.848 0.035 0.038 4.756 4.280 1902.846 1712.730 2.464 4.203 21.606 9.867 173 175 734 739 1.311394e+06 7.844612e+03 1.113310e+07 0.00000 1 None 17 1 27 188.885 736.899 0.006 0.014 4.440 4.280 1776.425 1712.611 2.202 4.528 19.307 10.629 188 190 734 740 3.283672e+06 7.338858e+03 3.010845e+07 0.00000 1 None 18 1 28 196.138 737.452 0.013 0.168 4.281 4.277 1712.831 1711.312 2.113 7.965 18.528 18.699 195 197 734 740 1.508441e+06 7.279150e+03 1.708324e+07 0.00000 1 None 19 1 29 213.123 736.888 0.008 0.005 3.908 4.280 1563.897 1712.638 3.399 3.631 29.808 8.525 211 215 734 740 6.452069e+06 7.233463e+03 9.565272e+07 0.00000 1 None 20 2 30 215.415 736.895 0.030 0.004 3.858 4.280 1543.795 1712.619 5.349 3.496 46.901 8.207 211 219 735 739 6.500736e+06 7.234657e+03 1.298628e+08 0.00000 1 None 20 2 31 188.948 794.508 0.050 0.106 4.438 3.942 1775.872 1577.374 2.144 3.188 18.801 7.485 189 189 794 795 4.355535e+05 8.026358e+03 8.161220e+05 0.00000 1 None 21 1 32 196.141 794.356 0.015 0.020 4.281 3.943 1712.803 1577.730 2.240 3.070 19.646 7.207 195 197 793 796 1.673785e+06 7.813417e+03 9.395865e+06 0.00000 1 None 22 1 33 212.661 794.816 0.016 0.005 3.919 3.940 1567.948 1576.650 3.246 2.907 28.461 6.824 211 215 793 797 4.247336e+06 7.508649e+03 4.167462e+07 0.00000 1 None 23 2 34 188.903 799.960 0.021 0.021 4.439 3.910 1776.271 1564.574 2.217 3.056 19.441 7.174 188 190 799 801 1.025274e+06 7.580596e+03 5.056770e+06 0.00000 1 None 24 1 35 196.153 799.882 0.006 0.005 4.280 3.911 1712.697 1564.759 2.296 3.050 20.132 7.161 195 198 798 802 4.150559e+06 7.607781e+03 2.626526e+07 0.00000 1 None 25 1 36 213.067 799.739 0.006 0.004 3.910 3.911 1564.387 1565.093 3.120 2.982 27.355 7.001 211 215 798 802 6.926286e+06 7.419277e+03 7.306991e+07 0.00000 1 None 23 2 37 188.869 808.016 0.027 0.041 4.440 3.863 1776.570 1545.662 2.163 3.779 18.962 8.871 188 190 807 809 7.786857e+05 7.455664e+03 4.135552e+06 0.00000 1 None 26 1 38 196.160 808.037 0.006 0.009 4.280 3.863 1712.640 1545.614 2.232 3.804 19.572 8.930 195 198 806 811 3.620898e+06 7.443599e+03 2.789375e+07 0.00000 1 None 27 2 39 213.339 807.667 0.026 0.008 3.904 3.865 1562.001 1546.483 4.244 3.365 37.212 7.899 211 216 806 810 4.419266e+06 7.403821e+03 8.209282e+07 0.00000 1 None 28 3 40 215.535 808.264 0.013 0.007 3.856 3.861 1542.751 1545.080 3.184 3.598 27.918 8.446 214 218 806 811 6.098084e+06 7.613039e+03 7.572818e+07 0.00000 1 None 28 3 41 196.173 813.447 0.014 0.038 4.280 3.831 1712.525 1532.914 2.197 3.998 19.266 9.386 195 197 810 816 1.741282e+06 7.627174e+03 1.634534e+07 0.00000 1 None 27 2 42 215.894 812.959 0.009 0.008 3.848 3.834 1539.597 1534.059 2.977 3.735 26.105 8.768 214 218 810 816 3.996752e+06 7.247920e+03 5.689532e+07 0.00000 1 None 28 3 43 188.893 813.881 0.057 0.087 4.439 3.828 1776.359 1531.895 2.162 3.584 18.959 8.414 189 189 813 814 3.550456e+05 7.471139e+03 6.567789e+05 0.00000 1 None 29 1