File name: Pandora159s1_Wakkerstroom_20210722_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T031421.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: B. Scholes Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 159 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora159_OF_v5d20191004.txt Instrument calibration file used: Pandora159s1_CF_v3d20201207.txt Level 1 file used: Pandora159s1_Wakkerstroom_20210722_L1_smca1c3d20201207p1-8.txt Full location name: Global Change Institute, University of Witwatersrand field site in Wakkerstroom Short location name: Wakkerstroom Country of location: South Africa Location latitude [deg]: -27.3493 Location longitude [deg]: 30.1438 Location altitude [m]: 1760 Local noon date: 20210722 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: None First and last pixel inside fitting window: 222 364 Nominal wavelengths inside fitting window [nm]: 305.0731 305.2139 305.3547 305.4955 305.6363 305.7770 305.9178 306.0585 306.1992 306.3399 306.4806 306.6213 306.7620 306.9026 307.0433 307.1839 307.3246 307.4652 307.6058 307.7464 307.8869 308.0275 308.1681 308.3086 308.4492 308.5897 308.7302 308.8707 309.0112 309.1517 309.2921 309.4326 309.5730 309.7135 309.8539 309.9943 310.1347 310.2751 310.4155 310.5558 310.6962 310.8365 310.9769 311.1172 311.2575 311.3978 311.5381 311.6784 311.8186 311.9589 312.0991 312.2393 312.3795 312.5198 312.6599 312.8001 312.9403 313.0805 313.2206 313.3607 313.5009 313.6410 313.7811 313.9212 314.0612 314.2013 314.3414 314.4814 314.6214 314.7615 314.9015 315.0415 315.1814 315.3214 315.4614 315.6013 315.7413 315.8812 316.0211 316.1610 316.3009 316.4408 316.5807 316.7205 316.8604 317.0002 317.1400 317.2798 317.4196 317.5594 317.6992 317.8389 317.9787 318.1184 318.2582 318.3979 318.5376 318.6773 318.8170 318.9566 319.0963 319.2359 319.3756 319.5152 319.6548 319.7944 319.9340 320.0736 320.2131 320.3527 320.4922 320.6318 320.7713 320.9108 321.0503 321.1898 321.3292 321.4687 321.6081 321.7476 321.8870 322.0264 322.1658 322.3052 322.4446 322.5839 322.7233 322.8626 323.0019 323.1413 323.2806 323.4199 323.5591 323.6984 323.8377 323.9769 324.1162 324.2554 324.3946 324.5338 324.6730 324.8121 324.9513 --------------------------------------------------------------------------------------- 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: 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 77: 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 78: 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 79: 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 80: 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 81: 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 82: Atmospheric variability [%], 999=no atmospheric variability was determined Column 83: Wavelength effective temperature [°C], 999=no effective temperature given Column 84: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 85: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 86: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 87: Number of bright count cycles Column 88: Number of dark count cycles Column 89: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 90: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 91: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 92: Integration time [ms] Column 93: Spectrometer control temperature [°C], 999=no temperature signal Column 94: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 95: Temperature in head sensor [°C], 999=no temperature signal Column 96: Temperature at electronics board 1 [°C], 999=no temperature signal Column 97: Temperature at electronics board 2 [°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 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: 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 20210722T051141.9Z 7873.216457 153 1 49.71 2 85.58 64.51 111.85 224.28 0.00 1 0.00 1 0 25 6.964e-01 3.182e-02 5.231e-01 2.938e-02 1.105712e+00 1.846715e-02 1.179067e-02 -6.000000e+00 4.097163e-01 225.68 -2.00 3.06 -2.00 322.66 0.00e+00 -4.641468e-03 1.067075e-02 1.929683e-02 -6.000000e+00 1.971054e-02 276.74 -2.00 20.00 -2.00 322.26 0.00e+00 10.791 0.008 302.00 328.00 3 -6.1205e-02 7.5091e-02 1.4745e-01 -6.0000e+00 1.0204e+00 1.5175e+00 9.7610e-02 1.4417e-01 -6.0000e+00 1.1225e+00 -1.8487e+00 8.0985e-02 5.9834e-02 -6.0000e+00 6.6058e-01 7.0936e-01 3.9312e-02 1.0519e-02 -6.0000e+00 2.8219e-01 2.7654e-05 -2.5998e-03 8.0685e-04 3.9779e-04 -6.0000e+00 2.0010e-02 6.3263e-03 12 8 8 10 0 0 54.31 18.02 0.80 0.00633 -0.01321 46 10 4 8 0 1080.570 15.02 18.02 3.31 20.56 20.67 16.2 813.05 -138286 900000 900000 21187 -153303 106814 900000 -139079 -30657 68177 -177397 -55578 900000 900000 241216 339847 262925 900000 -118875 900000 -66974 900000 -94041 -75558 -55927 -44429 900000 900000 91865 -12078 14535 900000 900000 107181 900000 900000 900000 1306 -30865 -44509 29872 82461 65591 900000 -28954 900000 211337 900000 -1207 900000 -11727 900000 21454 42995 184027 81576 18731 54490 -5146 -14695 69197 68598 48931 54074 28344 -19007 88467 3619 50309 39674 41432 42742 12954 42133 39109 54685 -16482 7051 -225 18819 29116 2896 8703 8526 -9616 7069 -2560 11419 5342 -8737 -5794 -389 -4895 -2877 -943 -373 -9 -2731 -3383 5364 -4388 -61 -2676 1364 1278 3150 -153 877 -1277 -4823 -5349 -5241 1849 -3265 -8 1214 2902 -1636 -329 973 -1399 2319 -1678 3445 3655 3878 1758 2330 3261 -635 -716 933 591 -4 -790 -369 1426 147 1117 -328 -1766 52 -1847 -4687 900000 900000 605 -4401 3048 900000 -3968 -875 1945 -6987 -1586 900000 900000 6882 9696 7502 900000 -7014 900000 -2151 900000 -3679 -2674 -1727 -1268 900000 900000 2621 -345 415 900000 900000 3058 900000 900000 900000 37 -1411 -2726 973 2353 1871 900000 -1626 900000 6030 900000 -56 900000 -747 900000 1224 2165 5251 3108 1340 2659 -414 -1195 2448 2631 2627 3197 2342 -2519 4241 424 4240 4254 4759 4966 1932 4302 3614 3807 -2176 791 -32 2727 4599 690 2193 2298 -3238 2126 -879 3481 1699 -3025 -1830 -112 -1494 -949 -361 -171 -5 -1794 -2503 3706 -3124 -37 -1462 702 701 1797 -96 592 -1013 -4686 -6091 -6651 2300 -4304 -10 1461 3507 -2159 -450 1339 -1900 2844 -2032 3869 4022 4150 1885 2695 4458 -1074 -1394 1964 1356 -10 -2146 -1053 4048 425 3151 -891 -4432 118 -4030 SS 20210722T052557.7Z 7873.226362 156 1 51.17 2 82.74 62.73 113.90 221.81 0.00 1 0.00 1 0 25 7.209e-01 8.268e-03 2.762e-01 3.384e-03 8.295705e-01 1.870482e-03 7.856981e-03 -6.000000e+00 4.058465e-01 225.68 -2.00 3.06 -2.00 321.93 0.00e+00 4.250636e-03 1.037459e-03 3.923114e-03 -6.000000e+00 1.769676e-02 276.74 -2.00 20.00 -2.00 321.48 0.00e+00 7.327 0.002 302.00 328.00 3 -1.4702e-03 6.9262e-03 7.5456e-02 -6.0000e+00 1.0057e+00 1.6911e-01 1.1307e-02 5.4160e-02 -6.0000e+00 1.0957e+00 -1.7001e-01 1.3169e-02 2.4670e-02 -6.0000e+00 6.5144e-01 5.7382e-02 5.9586e-03 8.5655e-03 -6.0000e+00 2.7623e-01 5.9749e-04 -1.0621e-03 9.1845e-05 9.2145e-05 -6.0000e+00 1.9267e-02 4.5342e-03 11 8 0 10 0 0 0.66 18.01 0.28 0.00453 -0.00345 257 55 2 8 0 191.630 15.03 18.01 4.96 20.56 20.56 16.1 821.33 -314320 -226879 -275745 -209085 -183939 -287825 -214736 -197669 -96278 -210156 -163045 -231485 -71188 -149304 -77628 -97905 -30656 -56626 -69917 -60505 -82613 -83558 -45766 -32748 -65100 -25380 -96682 -6910 -81437 -32880 -47782 -1171 -6630 -25655 34226 14385 7688 -17619 7970 -11630 11284 -10460 3768 -12436 7551 7256 -2811 11308 8083 12047 8648 14854 3788 12102 -379 8946 264 1874 2730 1038 7952 1390 6799 5242 6295 494 6905 1158 5457 2738 1173 1256 1200 1031 -81 3788 689 2024 495 1169 -1017 -306 -2019 -1509 -1202 -1103 -808 -986 -182 -714 1208 -99 714 202 906 -616 195 180 -602 -130 -231 526 802 1226 -1837 -1078 -1457 -828 -579 -441 -456 -359 21 416 831 955 1110 202 109 -904 -605 5 -63 -180 418 31 1502 1867 175 366 -103 262 63 228 -408 -474 209 -90 -484 -137 138 -35 393 -2624 -975 -2098 -823 -607 -2282 -920 -831 -318 -1245 -664 -2217 -235 -1177 -404 -770 -148 -399 -617 -522 -908 -935 -378 -264 -787 -223 -1725 -51 -1285 -370 -782 -15 -109 -544 401 204 129 -452 198 -416 369 -457 153 -610 312 313 -139 524 416 660 557 1029 324 1049 -40 899 30 208 290 110 819 171 918 825 1057 88 1168 220 1117 665 319 355 333 269 -19 784 140 426 122 347 -366 -126 -930 -736 -624 -607 -465 -583 -106 -403 629 -49 347 105 537 -437 160 171 -628 -136 -227 457 631 958 -1578 -972 -1393 -846 -656 -569 -662 -558 34 637 1216 1354 1587 304 174 -1484 -970 8 -92 -256 574 41 1924 2533 277 660 -207 558 142 547 -1052 -1279 569 -250 -1335 -361 340 -81 873 SS 20210722T053210.2Z 7873.230674 159 1 51.24 2 81.52 61.93 114.76 220.69 0.00 1 0.00 1 0 25 4.633e-01 6.326e-03 1.833e-01 1.908e-03 7.503259e-01 1.040247e-03 7.299728e-03 -6.000000e+00 2.607964e-01 225.68 -2.00 3.06 -2.00 321.56 0.00e+00 4.128156e-03 5.278827e-04 3.168757e-03 -6.000000e+00 1.137194e-02 276.74 -2.00 20.00 -2.00 321.07 0.00e+00 6.401 0.002 302.00 328.00 3 -6.9814e-02 3.6059e-03 6.5724e-02 -6.0000e+00 6.4625e-01 9.9297e-02 5.4135e-03 4.5277e-02 -6.0000e+00 7.0411e-01 -6.5215e-02 6.1614e-03 2.0005e-02 -6.0000e+00 4.1861e-01 1.2633e-02 2.8744e-03 7.9740e-03 -6.0000e+00 1.7750e-01 1.4006e-03 -9.4027e-04 5.2339e-05 7.5926e-05 -6.0000e+00 1.2381e-02 4.6046e-03 10 0 0 10 0 0 -6.54 18.01 0.25 0.00460 -0.00246 409 88 2 8 0 120.550 14.97 18.01 5.66 20.56 20.67 16.3 825.32 -80499 -209490 -74950 -179186 -129765 -161618 -176119 -111536 -140801 -105426 -147401 -93675 -122925 -76935 -79544 -42194 -62407 -74482 -43413 -31639 -49360 -49761 -43853 -51927 -9012 -37533 -21356 -22461 -2916 -29458 -17939 -19113 -12579 -6317 -9842 -2629 -14584 462 -10970 -229 -2810 844 -1783 -391 -3462 1928 1467 -1707 5102 -15 4638 2909 5327 2166 3456 2463 131 747 765 2443 2368 4944 3032 2773 1925 3168 1584 2520 3145 1359 352 -87 -52 -113 -199 -449 1257 -15 854 -705 106 -1169 -2169 -1079 -1292 -1067 -923 -681 -190 252 484 1098 576 1419 898 818 710 261 -526 -153 211 -141 1102 183 -1414 -1500 -388 -597 -211 -59 -342 -345 -48 422 515 1331 681 344 -437 -883 -797 42 39 -260 397 97 1344 1329 76 65 246 131 209 298 -429 -438 44 -19 -566 -56 162 138 224 -150 -1364 -139 -934 -386 -662 -918 -353 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