REMARK ROI 2D Peak Detection System, File: ./test.ft2 REMARK Detection Levels: -6.46759e+08 and 646758 REMARK Detection: X(+/-1) Y(+/-1) REMARK Interpolation: X(+/-1) Y(+/-1) REMARK Noise: 11585.9, 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: 44, Good Peaks: 44, Questionable Peaks: 0 REMARK Clusters: 14, Max Cluster Size: 8 REMARK ROI Spectral Axis Limits: DATA X_AXIS 1H 1 199 4.565ppm 0.737ppm DATA Y_AXIS 1H 1 643 4.557ppm 0.791ppm 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 15.878 47.186 0.069 0.039 4.278 4.286 1711.578 1715.151 3.382 3.325 26.163 7.806 15 16 47 49 8.901671e+05 9.018536e+03 4.903174e+06 0.00000 1 None 1 8 2 173.136 48.105 0.029 0.034 1.237 4.281 494.880 1712.994 2.311 3.454 17.878 8.109 173 174 47 50 9.989700e+05 9.089581e+03 6.386530e+06 0.00000 1 None 2 7 3 16.620 50.956 0.024 0.007 4.263 4.264 1705.835 1706.300 3.057 2.832 23.652 6.649 15 18 49 53 3.187856e+06 9.174896e+03 3.412094e+07 0.00000 1 None 1 8 4 173.119 51.174 0.015 0.014 1.237 4.263 495.017 1705.788 2.403 3.040 18.591 7.137 172 174 49 53 2.033569e+06 9.197804e+03 1.592991e+07 0.00000 1 None 2 7 5 17.019 54.147 0.009 0.004 4.255 4.246 1702.748 1698.811 3.091 2.651 23.917 6.224 15 19 52 56 5.459837e+06 9.049151e+03 5.350427e+07 0.00000 1 None 1 8 6 173.125 54.178 0.014 0.015 1.237 4.245 494.971 1698.736 2.419 3.301 18.713 7.750 172 174 52 56 2.309314e+06 9.115334e+03 2.075624e+07 0.00000 1 None 2 7 7 172.713 57.313 0.021 0.013 1.245 4.227 498.159 1691.378 2.970 3.115 22.975 7.312 171 174 55 59 3.011180e+06 9.181558e+03 3.317806e+07 0.00000 1 None 2 7 8 19.274 60.432 0.008 0.005 4.212 4.209 1685.300 1684.055 2.956 3.056 22.868 7.173 17 21 58 62 8.390911e+06 9.495456e+03 8.499618e+07 0.00000 1 None 1 8 9 171.833 60.353 0.037 0.022 1.262 4.209 504.967 1684.241 4.097 3.701 31.701 8.688 170 174 57 63 2.617773e+06 8.945485e+03 5.880532e+07 0.00000 1 None 2 7 10 19.554 63.395 0.007 0.008 4.206 4.191 1683.134 1677.100 2.551 3.694 19.740 8.672 18 21 60 66 8.707567e+06 9.717076e+03 1.142229e+08 0.00000 1 None 1 8 11 171.439 63.427 0.034 0.028 1.270 4.191 508.016 1677.025 3.090 3.780 23.911 8.873 170 173 60 66 2.630006e+06 9.527802e+03 4.843456e+07 0.00000 1 None 2 7 12 171.510 66.325 0.047 0.032 1.268 4.174 507.464 1670.220 3.241 4.047 25.077 9.501 170 173 63 68 2.230205e+06 9.352306e+03 3.553837e+07 0.00000 1 None 2 7 13 22.297 70.445 0.051 0.048 4.153 4.150 1661.915 1660.550 3.047 3.601 23.578 8.454 21 23 69 73 1.348535e+06 9.299041e+03 2.544248e+07 0.00000 1 None 1 8 14 176.009 70.452 0.025 0.021 1.181 4.150 472.655 1660.534 2.856 2.785 22.100 6.537 175 177 69 72 1.843345e+06 9.559119e+03 1.322286e+07 0.00000 1 None 3 4 15 23.362 73.435 0.010 0.006 4.133 4.132 1653.677 1653.531 2.866 2.864 22.178 6.723 21 25 71 75 7.379212e+06 9.713808e+03 6.465684e+07 0.00000 1 None 1 8 16 176.014 73.443 0.017 0.028 1.181 4.132 472.616 1653.511 2.708 3.606 20.955 8.465 175 177 70 76 2.205786e+06 9.172761e+03 3.079436e+07 0.00000 1 None 3 4 17 176.081 76.471 0.016 0.034 1.180 4.115 472.097 1646.403 2.643 3.963 20.450 9.303 175 177 73 79 2.320755e+06 9.128438e+03 3.281860e+07 0.00000 1 None 3 4 18 23.536 76.532 0.009 0.007 4.129 4.114 1652.326 1646.261 2.624 2.919 20.298 6.852 22 25 75 79 7.515528e+06 1.010884e+04 6.078900e+07 0.00000 1 None 1 8 19 176.136 79.530 0.022 0.021 1.179 4.097 471.673 1639.222 2.781 2.930 21.517 6.879 175 177 78 81 2.109176e+06 9.507501e+03 1.518339e+07 0.00000 1 None 3 4 20 43.852 141.790 0.034 0.032 3.737 3.731 1495.147 1493.067 2.205 2.813 17.063 6.603 44 44 141 142 8.543765e+05 9.547571e+03 1.511623e+06 0.00000 1 None 4 1 21 47.072 152.283 0.025 0.094 3.674 3.670 1470.228 1468.435 2.290 5.243 17.718 12.308 46 47 151 156 1.130340e+06 9.397602e+03 1.028216e+07 0.00000 1 None 5 3 22 176.266 151.784 0.073 0.036 1.176 3.673 470.664 1469.606 3.036 3.040 23.490 7.136 176 177 151 152 8.517897e+05 9.045260e+03 2.918327e+06 0.00000 1 None 6 1 23 48.125 154.745 0.010 0.010 3.654 3.655 1462.083 1462.655 2.513 3.113 19.440 7.307 47 49 153 157 3.361324e+06 9.160095e+03 2.761430e+07 0.00000 1 None 5 3 24 176.277 154.737 0.053 0.028 1.176 3.655 470.578 1462.673 2.927 2.940 22.643 6.902 176 177 154 155 1.136304e+06 9.195192e+03 3.870097e+06 0.00000 1 None 7 1 25 48.161 157.738 0.011 0.007 3.653 3.638 1461.807 1455.630 2.625 2.635 20.308 6.185 47 49 156 159 3.651308e+06 9.428173e+03 2.302078e+07 0.00000 1 None 5 3 26 176.339 157.794 0.056 0.021 1.175 3.638 470.104 1455.499 3.003 2.799 23.236 6.570 175 177 157 160 1.250020e+06 9.269468e+03 9.286954e+06 0.00000 1 None 8 2 27 176.409 160.719 0.091 0.022 1.174 3.620 469.560 1448.631 3.287 2.468 25.434 5.794 176 177 159 161 1.068044e+06 9.495049e+03 4.965228e+06 0.00000 1 None 8 2 28 19.355 557.715 0.031 0.010 4.210 1.291 1684.677 516.681 3.486 2.921 26.970 6.857 17 21 557 560 3.163460e+06 9.176406e+03 3.345256e+07 0.00000 1 None 9 5 29 19.435 560.764 0.036 0.016 4.209 1.273 1684.060 509.524 3.330 3.447 25.766 8.091 18 21 559 563 2.748110e+06 9.188446e+03 3.767125e+07 0.00000 1 None 9 5 30 171.210 560.726 0.002 0.002 1.274 1.274 509.781 509.612 2.440 2.890 18.879 6.785 170 173 559 563 1.980409e+07 9.486001e+03 1.503833e+08 0.00000 1 None 10 6 31 18.866 563.791 0.023 0.005 4.220 1.256 1688.461 502.417 4.288 2.505 33.173 5.881 16 21 562 566 4.285842e+06 8.958730e+03 5.615700e+07 0.00000 1 None 9 5 32 172.372 563.925 0.009 0.002 1.252 1.255 500.794 502.104 3.636 2.675 28.132 6.279 170 175 562 566 1.186112e+07 9.044857e+03 1.561177e+08 0.00000 1 None 10 6 33 17.106 567.030 0.023 0.004 4.254 1.237 1702.079 494.812 4.073 2.481 31.512 5.824 14 19 565 569 3.661088e+06 8.880228e+03 4.727600e+07 0.00000 1 None 9 5 34 173.111 567.030 0.003 0.001 1.237 1.237 495.080 494.814 2.850 2.719 22.049 6.384 171 175 565 569 1.679633e+07 9.070447e+03 1.560933e+08 0.00000 1 None 10 6 35 17.028 569.941 0.039 0.009 4.255 1.220 1702.676 487.980 4.079 2.719 31.561 6.384 15 19 568 571 2.078317e+06 8.807032e+03 2.756574e+07 0.00000 1 None 9 5 36 173.193 569.857 0.005 0.004 1.236 1.220 494.440 488.178 2.693 3.259 20.839 7.651 171 175 568 572 8.551531e+06 9.135836e+03 9.742471e+07 0.00000 1 None 10 6 37 23.252 573.652 0.028 0.014 4.135 1.198 1654.529 479.268 3.426 3.088 26.508 7.250 21 25 572 576 2.861407e+06 9.108115e+03 3.351997e+07 0.00000 1 None 11 3 38 47.948 574.419 0.059 0.024 3.657 1.193 1463.450 477.469 3.575 2.495 27.656 5.857 47 49 574 575 1.209182e+06 9.479514e+03 5.777151e+06 0.00000 1 None 12 1 39 23.380 576.588 0.036 0.020 4.132 1.181 1653.533 472.375 3.261 3.245 25.228 7.617 22 25 575 579 2.533541e+06 9.356226e+03 3.135016e+07 0.00000 1 None 11 3 40 48.045 577.192 0.062 0.043 3.656 1.177 1462.702 470.957 3.266 3.404 25.269 7.992 47 49 577 578 8.480904e+05 8.848642e+03 4.083903e+06 0.00000 1 None 13 1 41 176.151 576.939 0.001 0.001 1.178 1.178 471.554 471.552 2.502 2.812 19.358 6.602 174 178 575 579 2.567680e+07 9.243178e+03 1.935367e+08 0.00000 1 None 10 6 42 23.430 579.724 0.045 0.008 4.132 1.162 1653.150 465.015 3.840 2.441 29.712 5.730 21 25 578 581 2.975487e+06 9.333438e+03 2.718579e+07 0.00000 1 None 11 3 43 48.132 580.467 0.060 0.039 3.654 1.158 1462.031 463.271 3.421 2.991 26.465 7.022 47 49 580 581 1.135282e+06 9.259467e+03 5.614389e+06 0.00000 1 None 14 1 44 176.216 579.609 0.005 0.005 1.177 1.163 471.052 465.285 2.674 3.412 20.690 8.010 174 178 578 582 9.715344e+06 9.211462e+03 1.138709e+08 0.00000 1 None 10 6