File name: Pandora64s1_NewHavenCT_20240725_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240726T050535.3Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 64 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora64_OF_v3d20190516.txt Instrument calibration file used: Pandora64s1_CF_v4d20190911.txt Level 1 file used: Pandora64s1_NewHavenCT_20240725_L1_smca1c4d20190911p1-8.txt Full location name: New Haven - Criscuolo Park CTDEEP (USEPA AQS ID 34-017-0006) Short location name: NewHavenCT Country of location: USA Location latitude [deg]: 41.3014 Location longitude [deg]: -72.9029 Location altitude [m]: 4 Local noon date: 20240725 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are latency correction, matrix method stray light correction (replaced by simple method) Data caveats: Mod WL cal slit func 9 First and last pixel inside fitting window: 249 390 Nominal wavelengths inside fitting window [nm]: 305.1279 305.2688 305.4097 305.5506 305.6915 305.8324 305.9732 306.1141 306.2549 306.3958 306.5366 306.6774 306.8182 306.9590 307.0997 307.2405 307.3812 307.5220 307.6627 307.8034 307.9441 308.0848 308.2255 308.3662 308.5068 308.6475 308.7881 308.9287 309.0693 309.2099 309.3505 309.4911 309.6316 309.7722 309.9127 310.0533 310.1938 310.3343 310.4748 310.6153 310.7557 310.8962 311.0366 311.1771 311.3175 311.4579 311.5983 311.7387 311.8791 312.0195 312.1598 312.3002 312.4405 312.5808 312.7211 312.8614 313.0017 313.1420 313.2822 313.4225 313.5627 313.7030 313.8432 313.9834 314.1236 314.2638 314.4039 314.5441 314.6842 314.8244 314.9645 315.1046 315.2447 315.3848 315.5249 315.6649 315.8050 315.9450 316.0851 316.2251 316.3651 316.5051 316.6451 316.7850 316.9250 317.0649 317.2049 317.3448 317.4847 317.6246 317.7645 317.9044 318.0442 318.1841 318.3239 318.4638 318.6036 318.7434 318.8832 319.0230 319.1628 319.3025 319.4423 319.5820 319.7217 319.8614 320.0011 320.1408 320.2805 320.4202 320.5598 320.6995 320.8391 320.9787 321.1183 321.2579 321.3975 321.5371 321.6766 321.8162 321.9557 322.0953 322.2348 322.3743 322.5138 322.6532 322.7927 322.9322 323.0716 323.2110 323.3504 323.4899 323.6292 323.7686 323.9080 324.0474 324.1867 324.3260 324.4654 324.6047 324.7440 324.8833 --------------------------------------------------------------------------------------- Column 1: Two letter code of measurement routine Column 2: UT date and time for center-time of measurement, yyyymmddThhmmssZ (ISO 8601) Column 3: Fractional days since 1-Jan-2000 midnight for center-time of measurement Column 4: Routine count (1 for the first routine of the day, 2 for the second, etc.) Column 5: Repetition count (1 for the first set in the routine, 2 for the second, etc.) Column 6: Total duration of measurement set in seconds Column 7: Data processing type index Column 8: Solar zenith angle for center-time of measurement in degree Column 9: Solar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 10: Lunar zenith angle for center-time of measurement in degree Column 11: Lunar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 12: Pointing zenith angle in degree, absolute or relative (see next column), 999=tracker not used Column 13: Zenith pointing mode: zenith angle is... 0=absolute, 1=relative to sun, 2=relative to moon Column 14: Pointing azimuth in degree, increases clockwise, absolute (0=north) or relative (see next column), 999=tracker not used Column 15: Azimuth pointing mode: like zenith angle mode but also fixed scattering angles relative to sun (3) or moon (4) Column 16: Fitting result index: 0=no error or warning, 1, 2=warning, >2=error Column 17: Number of function evaluations used, 0=linear fitting or fitting not successful or no fitting done Column 18: rms of unweighted fitting residuals, -9=fitting not successful Column 19: Normalized rms of fitting residuals weighted with independent uncertainty, -9=fitting not successful or no uncertainty used Column 20: Expected rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 21: Expected normalized weighted rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 22: Ozone slant column amount [moles per square meter], -9e99=fitting not successful Column 23: Independent uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 24: Structured uncertainty of ozone slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 25: Common uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 26: rms-based uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 27: Ozone effective temperature [K] Column 28: Independent uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 29: Structured uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 30: Common uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 31: Effective ozone fitting wavelength [nm], -9=fitting not successful Column 32: Diffuse correction applied before fitting at effective fitting wavelength for ozone [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 33: Sulfur dioxide slant column amount [moles per square meter], -9e99=fitting not successful Column 34: Independent uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 35: Structured uncertainty of sulfur dioxide slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 36: Common uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 37: rms-based uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 38: Sulfur dioxide effective temperature [K] Column 39: Independent uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 40: Structured uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 41: Common uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 42: Effective sulfur dioxide fitting wavelength [nm], -9=fitting not successful Column 43: Diffuse correction applied before fitting at effective fitting wavelength for sulfur dioxide [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 44: Molecular scattering air mass factor used for molecular scattering subtraction before the fitting Column 45: Estimated uncertainty of molecular scattering air mass factor, -9=molecular scattering was not subtracted before the fitting Column 46: Lower limit used for wavelength scaling [nm] Column 47: Upper limit used for wavelength scaling [nm] Column 48: Order of smoothing polynomial Column 49: Smoothing polynomial coefficient, order 0 Column 50: Independent uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 51: Structured uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 52: Common uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 53: rms-based uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 54: Smoothing polynomial coefficient, order 1 Column 55: Independent uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 56: Structured uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 57: Common uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 58: rms-based uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 59: Smoothing polynomial coefficient, order 2 Column 60: Independent uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 61: Structured uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 62: Common uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 63: rms-based uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 64: Smoothing polynomial coefficient, order 3 Column 65: Independent uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 66: Structured uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 67: Common uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 68: rms-based uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 69: Mean value of measured data inside fitting window [same units as measurements] Column 70: Wavelength change polynomial coefficient, order 0 Column 71: Independent uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 72: Structured uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 73: Common uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 74: rms-based uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 75: L1 based wavelength change coefficient, order 0, -9=no L1 wavelength change determination Column 76: L1 based wavelength change coefficient, order 1, -9=no L1 wavelength change determination Column 77: L2Fit data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 78: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ1 limit, 0=L1 data quality above 0, 1=Spectral fitting was not successful, 2=Wavelength shift too large, 3=Normalized rms of fitting residuals weighted with independent uncertainty too large Column 79: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 80: L1 data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 81: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ1 limit, 0=Saturated data, 1=Too few dark counts measurements, 2=No temperature given or effective temperature too different from the reference temperature, 3=Dark count too high, 4=Unsuccessful dark background fitting, 5=The dark count differs significantly from the dark map for too many pixels, 6=Absolute value of estimated average residual stray light level too high, 7=Although attempted, no wavelength change could be retrieved, 8=Absolute value of retrieved wavelength shift too large, 9=Retrieved wavelength shift differs too much from the shift predicted by the effective temperature Column 82: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 83: Atmospheric variability [%], 999=no atmospheric variability was determined Column 84: Wavelength effective temperature [°C], 999=no effective temperature given Column 85: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 86: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 87: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 88: Number of bright count cycles Column 89: Number of dark count cycles Column 90: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 91: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 92: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 93: Integration time [ms] Column 94: Temperature at electronics board [°C], 999=no temperature signal Column 95: Spectrometer control temperature [°C], 999=no temperature signal Column 96: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 97: Temperature in head sensor [°C], 999=no temperature signal Column 98: Humidity in head sensor [%], -9=no humidity signal Column 99: Pressure in head sensor [hPa], -9=no pressure signal Columns 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: Normalized slant column residuals weighted with independent instrumental uncertainty for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting, 0=no independent instrumental uncertainty was given --------------------------------------------------------------------------------------- SS 20240725T121632.4Z 8972.511486 262 1 4.06 2 62.78 87.30 67.18 244.92 0.00 1 0.00 1 0 17 1.780e-02 7.823e-03 9.304e-03 3.048e-03 2.981979e-01 1.651976e-03 3.557470e-03 -6.000000e+00 1.093777e-02 232.57 -2.00 3.52 -2.00 317.18 0.00e+00 9.696293e-04 2.349582e-04 1.061175e-04 -6.000000e+00 4.885189e-04 289.57 -2.00 20.00 -2.00 316.33 0.00e+00 2.174 0.000 302.00 328.00 3 3.3442e+00 4.3850e-03 2.6984e-02 -6.0000e+00 2.7419e-02 3.8240e-03 4.8972e-03 1.5747e-02 -6.0000e+00 2.9525e-02 6.5473e-04 2.9063e-03 7.6020e-03 -6.0000e+00 1.7589e-02 -5.3190e-03 1.4057e-03 2.1751e-03 -6.0000e+00 7.4362e-03 1.4630e-03 -1.2005e-04 9.4390e-05 2.5985e-05 -6.0000e+00 5.3031e-04 8.8552e-03 -7.7756e-05 12 9 1 12 1 1 87.89 21.72 0.19 0.00886 0.00795 6 20 1 5 0 579.400 26.11 20.01 21.72 31.45 40.2 1057.16 805 -3494 -291 -6447 -14077 -2293 -4823 -145 2283 -2806 -2408 -562 -1376 1072 1400 -1211 -207 1744 916 2011 -305 -235 1464 1618 711 1691 -911 -1179 -162 1721 715 1247 2497 413 -3261 -2606 -2019 -92 -500 -152 -1639 21 -966 -1213 -292 -538 -309 -285 -1407 -23 1813 1545 243 1118 137 660 1182 425 -149 921 1018 1598 1593 1797 270 -894 -213 -678 1109 1297 469 -144 -71 250 -4 -758 -470 -1411 -579 -252 -1267 -1082 -2068 -1718 -366 -554 31 125 1215 402 538 595 -384 378 1105 379 -476 574 194 -305 -399 -2258 -1493 489 198 -1214 -294 -882 -372 176 537 25 425 6 207 376 857 -232 626 158 -189 -181 661 -118 1132 527 -550 969 989 513 503 -527 -643 -119 475 -322 -428 278 -16 -729 358 -858 88 -419 -34 -723 -1593 -236 -555 -18 297 -394 -338 -80 -228 199 294 -282 -47 407 223 505 -79 -61 392 456 210 508 -273 -333 -44 478 218 405 869 143 -1119 -945 -775 -41 -250 -81 -938 12 -588 -739 -177 -326 -184 -168 -836 -14 1108 1005 169 772 97 479 861 308 -108 670 781 1260 1346 1509 231 -719 -166 -538 964 1191 440 -138 -66 231 -4 -616 -376 -1141 -489 -228 -1231 -1102 -2235 -1889 -428 -660 38 151 1475 463 593 631 -389 391 1236 436 -589 738 253 -398 -489 -2725 -1767 608 254 -1588 -404 -1229 -531 265 809 38 620 9 281 497 1159 -322 921 234 -281 -263 956 -168 1538 713 -733 1291 1414 754 748 -810 -992 -192 785 -537 -730 478 -27 -1208 587 -1380 SS 20240725T131320.8Z 8972.550935 302 1 1.65 2 52.13 96.97 76.74 255.42 0.00 1 0.00 1 0 17 1.691e-02 9.630e-03 1.112e-02 5.980e-03 2.260432e-01 3.260053e-03 2.762368e-03 -6.000000e+00 1.038771e-02 232.57 -2.00 3.52 -2.00 315.93 0.00e+00 5.800440e-04 3.440342e-04 3.555961e-05 -6.000000e+00 4.638670e-04 289.57 -2.00 20.00 -2.00 315.15 0.00e+00 1.625 0.000 302.00 328.00 3 3.9390e+00 8.5030e-03 2.0317e-02 -6.0000e+00 2.6040e-02 1.0526e-02 9.4246e-03 1.1993e-02 -6.0000e+00 2.8038e-02 -2.2691e-03 5.4064e-03 5.7973e-03 -6.0000e+00 1.6704e-02 -6.0929e-03 2.4439e-03 1.6237e-03 -6.0000e+00 7.0630e-03 1.5561e-03 -1.0452e-04 1.8449e-04 2.1764e-05 -6.0000e+00 5.0357e-04 9.2826e-03 -2.1650e-05 12 9 9 12 1 1 999.00 21.75 0.17 0.00928 0.00850 1 14 1 5 0 818.240 26.21 19.96 21.75 32.34 40.3 1061.64 488 1014 -3502 -1319 -10875 -2919 -1397 5204 -1281 -55 -2731 1050 219 380 680 1483 -74 2867 -626 1748 1385 -1783 807 3232 1910 748 2189 -1449 -590 -1584 3785 -3372 4444 -48 -4228 -1006 11 -3061 140 -1289 -771 -1647 103 -2188 575 -1460 506 534 149 -1276 1187 1725 1313 -659 752 974 885 -1082 319 -73 100 1288 976 2354 417 -1504 929 -643 1110 1316 357 948 90 -284 260 661 -697 -1455 -429 -1196 -1470 -397 -2470 -1389 -193 -1296 22 271 734 293 40 888 -142 764 1765 398 -17 1063 4 -430 -1710 -956 -1535 1147 -569 -1202 -175 -50 -517 838 513 152 199 235 -144 -408 379 8 227 169 -293 -785 1034 -331 1388 849 -1110 896 1106 619 243 -806 -19 2 132 -728 90 336 541 -192 -236 -1102 105 226 -808 -281 -2363 -594 -303 1170 -315 -14 -684 274 65 120 239 523 -27 1068 -248 701 556 -739 340 1391 824 333 968 -619 -239 -661 1591 -1534 2003 -22 -1908 -465 6 -1753 88 -885 -536 -1196 75 -1627 417 -1067 365 377 104 -926 864 1314 1018 -543 620 818 725 -893 266 -60 86 1143 894 2192 387 -1356 786 -555 1009 1278 358 965 90 -282 243 573 -591 -1227 -378 -1144 -1459 -411 -2736 -1569 -226 -1575 26 333 908 352 46 949 -148 801 1919 466 -21 1353 5 -538 -2092 -1118 -1792 1400 -715 -1579 -234 -68 -722 1187 749 218 276 317 -187 -514 486 10 313 236 -414 -1118 1408 -443 1801 1084 -1401 1156 1473 848 339 -1154 -27 2 200 -1145 141 533 848 -301 -360 -1687 SS 20240725T131752.3Z 8972.554078 305 1 48.42 2 51.29 97.80 77.52 256.21 0.00 1 0.00 1 0 17 1.064e-02 7.451e-03 7.145e-04 3.800e-04 2.223245e-01 2.066438e-04 2.671080e-03 -6.000000e+00 6.540236e-03 232.57 -2.00 3.52 -2.00 315.97 0.00e+00 2.807494e-04 2.201513e-05 5.473880e-05 -6.000000e+00 2.920155e-04 289.57 -2.00 20.00 -2.00 315.20 0.00e+00 1.595 0.000 302.00 328.00 3 2.5318e+00 5.3912e-04 1.9892e-02 -6.0000e+00 1.6395e-02 -2.7128e-03 5.9781e-04 1.1664e-02 -6.0000e+00 1.7653e-02 -2.6465e-04 3.4244e-04 5.6316e-03 -6.0000e+00 1.0517e-02 -3.8366e-03 1.5497e-04 1.5378e-03 -6.0000e+00 4.4475e-03 6.6226e-03 2.3743e-04 1.1744e-05 2.0414e-05 -6.0000e+00 3.1701e-04 8.5938e-03 -1.2126e-05 11 8 0 10 0 0 99.91 21.73 0.18 0.00859 0.01038 375 90 1 5 0 129.110 26.11 20.02 21.73 32.46 40.2 1062.70 676 -1568 6 -3818 -4286 -1868 -103 455 1416 -598 -2978 -1193 251 -305 1146 82 -629 855 360 1687 875 -192 1179 774 396 863 407 -811 -436 606 1679 258 2321 -902 -4155 -1782 -1377 -606 350 -128 -1210 -1072 -327 -1054 -379 -202 -745 -111 -704 -26 1348 898 737 1266 153 961 1016 610 283 635 701 1303 1101 1950 57 -1143 -206 -1174 1127 1280 57 261 -347 501 10 -525 -624 -1613 -141 -370 -1220 -751 -2149 -1701 -472 -469 -24 34 727 278 483 433 -484 434 1028 253 -43 1051 198 -578 -414 -1404 -1344 414 181 -1319 -211 -766 -157 238 644 99 215 98 15 171 688 -189 568 224 -173 -304 625 -25 1171 807 -550 809 923 343 505 -498 -522 -246 427 -303 -386 242 -14 -480 83 -817 147 -361 1 -798 -834 -361 -21 103 343 -150 -756 -321 75 -95 390 30 -236 330 143 687 359 -80 467 323 171 379 173 -350 -179 251 729 111 1048 -407 -1836 -815 -706 -338 213 -88 -833 -762 -236 -761 -272 -143 -547 -79 -498 -19 960 676 584 1039 121 775 825 492 226 515 598 1186 1010 1825 52 -1015 -174 -1010 1049 1246 56 263 -343 493 9 -456 -535 -1383 -122 -340 -1246 -789 -2397 -1909 -565 -565 -31 43 900 324 543 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