REMARK ROI 2D Peak Detection System, File: ./test.ft2 REMARK Detection Levels: -5.80876e+08 and 580876 REMARK Detection: X(+/-1) Y(+/-1) REMARK Interpolation: X(+/-1) Y(+/-1) REMARK Noise: 9129.42, 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: 47, Good Peaks: 45, Questionable Peaks: 2 REMARK Clusters: 24, Max Cluster Size: 5 REMARK ROI Spectral Axis Limits: DATA X_AXIS 1H 1 228 8.918ppm 1.505ppm DATA Y_AXIS 1H 1 1299 8.932ppm 1.316ppm 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 17.300 94.327 0.002 0.002 8.386 8.384 3355.390 3354.728 2.302 3.262 30.074 7.658 16 19 92 96 1.589834e+07 7.559811e+03 1.073859e+08 0.00000 1 None 1 1 2 48.063 263.956 0.005 0.011 7.381 7.389 2953.420 2956.523 2.178 4.455 28.456 10.458 47 49 261 267 3.884027e+06 7.011854e+03 4.338970e+07 0.00000 1 None 2 2 3 84.767 264.005 0.002 0.003 6.182 7.389 2473.816 2956.409 2.357 4.119 30.802 9.669 83 86 261 267 1.109000e+07 7.131130e+03 1.352562e+08 0.00000 1 None 3 2 4 48.083 266.903 0.005 0.008 7.380 7.372 2953.160 2949.605 2.213 3.901 28.914 9.157 47 49 264 269 4.046552e+06 7.099146e+03 4.040742e+07 0.00000 1 None 2 2 5 84.793 266.943 0.002 0.003 6.182 7.371 2473.467 2949.512 2.363 3.886 30.875 9.122 83 86 264 270 1.130766e+07 7.155735e+03 1.317695e+08 0.00000 1 None 3 2 6 48.059 468.189 0.002 0.008 7.381 6.191 2953.473 2477.086 2.183 5.101 28.525 11.974 47 49 464 472 8.015418e+06 6.972925e+03 1.092467e+08 0.00000 1 None 4 2 7 84.762 468.222 0.006 0.016 6.183 6.190 2473.882 2477.008 2.297 4.979 30.020 11.689 83 86 464 472 4.105609e+06 7.118849e+03 6.019070e+07 0.00000 1 None 5 2 8 48.076 470.746 0.002 0.009 7.381 6.176 2953.249 2471.083 2.193 5.150 28.651 12.089 47 49 467 475 7.764384e+06 7.014931e+03 1.064376e+08 0.00000 1 None 4 2 9 84.799 470.691 0.006 0.023 6.181 6.176 2473.392 2471.212 2.280 5.320 29.789 12.488 84 86 467 474 3.886019e+06 7.094070e+03 5.398867e+07 0.00000 1 None 5 2 10 126.267 694.464 0.013 0.030 4.827 4.863 1931.537 1945.902 2.163 3.777 28.259 8.867 126 127 691 697 1.989521e+06 7.539153e+03 2.617342e+07 0.00000 1 None 6 4 11 126.228 696.361 0.006 0.007 4.829 4.852 1932.052 1941.450 2.236 2.894 29.216 6.793 125 127 694 698 4.474944e+06 7.707757e+03 9.200436e+07 0.00000 1 None 6 4 12 126.091 699.863 0.000 0.000 4.833 4.831 1933.836 1933.229 2.255 2.655 29.461 6.233 125 128 698 702 1.980960e+08 7.482648e+03 9.925258e+08 0.00000 1 None 6 4 13 121.235 701.155 0.074 0.016 4.992 4.824 1997.296 1930.196 3.010 2.055 39.336 4.824 121 121 701 701 5.972446e+05 6.948914e+03 5.835061e+05 0.00000 3 None 7 1 14 123.053 701.012 0.009 0.010 4.932 4.825 1973.531 1930.532 1.926 2.684 25.161 6.302 123 124 700 702 1.578454e+06 7.034469e+03 4.657610e+06 0.00000 3 None 6 4 15 225.659 702.214 0.312 0.013 1.581 4.818 632.801 1927.711 4.602 1.758 60.140 4.127 225 226 702 702 7.121252e+05 7.772187e+03 1.325373e+06 0.00000 1 None 8 1 16 124.910 703.774 0.043 0.019 4.872 4.809 1949.273 1924.049 2.549 2.123 33.302 4.984 125 125 704 704 6.467748e+05 7.291285e+03 6.306128e+05 0.00000 1 None 9 1 17 142.900 793.138 0.005 0.023 4.284 4.284 1714.195 1714.265 2.181 6.283 28.493 14.749 142 144 789 797 3.991848e+06 6.943443e+03 5.714978e+07 0.00000 1 None 10 1 18 202.346 792.994 0.010 0.015 2.343 4.285 937.431 1714.604 2.489 5.080 32.525 11.926 201 204 789 797 3.740814e+06 7.199035e+03 5.704340e+07 0.00000 1 None 11 1 19 210.973 793.341 0.012 0.031 2.061 4.283 824.702 1713.790 2.716 4.861 35.496 11.411 209 212 790 796 2.428604e+06 6.985772e+03 3.728430e+07 0.00000 1 None 12 2 20 208.115 793.607 0.032 0.091 2.154 4.281 862.042 1713.163 3.299 6.099 43.111 14.318 207 210 790 797 1.394484e+06 6.853710e+03 3.316931e+07 0.00000 1 None 12 2 21 152.930 849.026 0.004 0.008 3.957 3.956 1583.135 1583.067 2.357 5.007 30.799 11.754 151 155 845 853 6.183344e+06 6.942155e+03 8.624754e+07 0.00000 1 None 13 1 22 142.894 1123.957 0.007 0.013 4.284 2.343 1714.278 937.666 2.193 4.053 28.657 9.514 142 144 1121 1127 2.650852e+06 7.078935e+03 2.786758e+07 0.00000 1 None 14 2 23 202.331 1124.055 0.003 0.003 2.343 2.343 937.620 937.437 2.508 3.962 32.773 9.300 201 204 1121 1127 1.084206e+07 7.237090e+03 1.384065e+08 0.00000 1 None 15 2 24 207.897 1124.250 0.011 0.013 2.162 2.342 864.893 936.977 2.923 3.929 38.194 9.225 206 210 1121 1127 3.228478e+06 7.006101e+03 5.684828e+07 0.00000 1 None 16 3 25 210.871 1124.256 0.012 0.014 2.064 2.342 826.031 936.964 2.856 3.796 37.314 8.911 209 212 1121 1127 2.807392e+06 7.046480e+03 4.507864e+07 0.00000 1 None 16 3 26 142.901 1126.624 0.011 0.043 4.284 2.328 1714.185 931.406 2.155 4.800 28.165 11.268 142 144 1124 1129 1.825920e+06 7.074785e+03 2.174793e+07 0.00000 1 None 14 2 27 202.473 1126.595 0.007 0.014 2.339 2.328 935.774 931.473 2.602 5.208 33.996 12.225 201 204 1123 1131 7.705308e+06 7.499783e+03 1.396172e+08 0.00000 1 None 15 2 28 210.927 1126.372 0.015 0.214 2.063 2.329 825.306 931.998 2.756 9.301 36.015 21.835 209 212 1120 1129 1.981406e+06 6.976642e+03 5.693896e+07 0.00000 1 None 16 3 29 142.904 1152.249 0.031 0.093 4.284 2.177 1714.151 871.250 2.194 4.622 28.667 10.851 143 143 1152 1153 6.323301e+05 7.043854e+03 1.213630e+06 0.00000 1 None 17 1 30 202.531 1153.074 0.022 0.042 2.337 2.173 935.010 869.314 2.556 6.084 33.399 14.282 201 204 1149 1157 2.111490e+06 7.336765e+03 4.013366e+07 0.00000 1 None 18 2 31 208.108 1152.864 0.043 0.094 2.155 2.174 862.138 869.807 3.297 6.542 43.079 15.357 207 210 1149 1158 1.012854e+06 6.820459e+03 3.783309e+07 0.00000 1 None 19 4 32 210.995 1152.928 0.014 0.071 2.060 2.173 824.420 869.657 2.579 7.721 33.704 18.126 209 212 1149 1158 1.751459e+06 6.825525e+03 4.461032e+07 0.00000 1 None 19 4 33 142.899 1155.849 0.024 0.094 4.284 2.156 1714.210 862.798 2.165 5.619 28.292 13.190 143 143 1155 1158 7.770193e+05 6.961561e+03 2.802629e+06 0.00000 1 None 20 1 34 202.562 1155.605 0.020 0.050 2.336 2.158 934.610 863.371 2.549 5.371 33.303 12.609 201 204 1152 1160 2.238580e+06 7.383097e+03 4.087994e+07 0.00000 1 None 18 2 35 208.027 1156.237 0.024 0.036 2.157 2.154 863.204 861.888 3.063 4.529 40.020 10.632 207 210 1153 1159 1.497639e+06 6.924491e+03 2.978155e+07 0.00000 1 None 19 4 36 210.982 1155.629 0.015 0.052 2.061 2.158 824.591 863.317 2.703 5.430 35.323 12.747 209 212 1152 1160 1.870520e+06 6.926132e+03 4.040584e+07 0.00000 1 None 19 4 37 142.904 1169.248 0.020 0.063 4.284 2.078 1714.149 831.346 2.171 4.744 28.368 11.138 142 143 1168 1172 9.848076e+05 7.051683e+03 7.964673e+06 0.00000 1 None 21 2 38 202.282 1169.298 0.018 0.031 2.345 2.077 938.263 831.228 2.437 4.192 31.848 9.841 201 203 1166 1172 1.753876e+06 7.202401e+03 2.233522e+07 0.00000 1 None 22 3 39 207.872 1169.443 0.024 0.046 2.162 2.077 865.224 830.887 2.849 4.246 37.223 9.968 207 210 1167 1172 1.485732e+06 7.089164e+03 2.395805e+07 0.00000 1 None 23 5 40 210.815 1169.068 0.041 0.032 2.066 2.079 826.769 831.767 3.024 3.906 39.511 9.170 209 212 1167 1172 1.008694e+06 6.970533e+03 1.852270e+07 0.00000 1 None 23 5 41 142.906 1172.081 0.016 0.045 4.284 2.061 1714.120 824.694 2.178 4.972 28.463 11.671 142 143 1168 1176 1.171118e+06 6.980536e+03 1.423969e+07 0.00000 1 None 21 2 42 202.253 1172.057 0.015 0.023 2.346 2.061 938.644 824.751 2.416 4.552 31.573 10.686 201 203 1169 1175 1.990024e+06 7.121041e+03 2.632647e+07 0.00000 1 None 22 3 43 210.808 1171.950 0.045 0.024 2.066 2.062 826.863 825.002 3.261 3.520 42.606 8.263 209 212 1170 1174 1.086921e+06 7.058658e+03 1.634799e+07 0.00000 1 None 23 5 44 207.846 1172.628 0.017 0.074 2.163 2.058 865.561 823.409 2.698 6.385 35.255 14.989 207 210 1168 1178 1.844606e+06 6.945685e+03 4.503923e+07 0.00000 1 None 23 5 45 202.245 1174.727 0.018 0.053 2.346 2.046 938.755 818.483 2.388 5.386 31.206 12.644 201 203 1171 1179 1.597407e+06 7.126569e+03 2.775152e+07 0.00000 1 None 22 3 46 210.802 1175.151 0.064 0.043 2.067 2.043 826.935 817.488 3.374 3.894 44.088 9.140 209 212 1172 1176 8.358791e+05 7.074034e+03 1.574158e+07 0.00000 1 None 23 5 47 210.969 1178.644 0.053 0.057 2.061 2.023 824.752 809.288 2.964 3.404 38.725 7.990 211 211 1178 1179 6.693451e+05 7.175116e+03 1.256394e+06 0.00000 1 None 24 1