File name: Pandora25s1_HoustonTX_20240703_L2Fit_fout2c9d20230101p1-8.txt File generation date: 20241218T073741.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c9p1-8 Local principal investigator: Jimmy Flynn Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 25 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora25_OF_v7d20190903.txt Instrument calibration file used: Pandora25s1_CF_v9d20230101.txt Level 1 file used: Pandora25s1_HoustonTX_20240703_L1_smca1c9d20230101p1-8.txt Full location name: University Of Houston Short location name: HoustonTX Country of location: United States Location latitude [deg]: 29.7200 Location longitude [deg]: -95.3400 Location altitude [m]: 19 Local noon date: 20240703 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: Modification of session 8, but repeated E-MLE of HCHO. First and last pixel inside fitting window: 281 423 Nominal wavelengths inside fitting window [nm]: 305.0808 305.2213 305.3618 305.5022 305.6427 305.7831 305.9235 306.0640 306.2044 306.3447 306.4851 306.6255 306.7658 306.9062 307.0465 307.1868 307.3272 307.4675 307.6077 307.7480 307.8883 308.0285 308.1688 308.3090 308.4492 308.5894 308.7296 308.8698 309.0100 309.1501 309.2903 309.4304 309.5705 309.7106 309.8507 309.9908 310.1309 310.2710 310.4110 310.5511 310.6911 310.8311 310.9711 311.1111 311.2511 311.3911 311.5310 311.6710 311.8109 311.9508 312.0907 312.2306 312.3705 312.5104 312.6503 312.7901 312.9300 313.0698 313.2096 313.3494 313.4892 313.6290 313.7688 313.9085 314.0483 314.1880 314.3277 314.4675 314.6072 314.7468 314.8865 315.0262 315.1658 315.3055 315.4451 315.5847 315.7243 315.8639 316.0035 316.1431 316.2826 316.4222 316.5617 316.7013 316.8408 316.9803 317.1198 317.2592 317.3987 317.5382 317.6776 317.8170 317.9564 318.0958 318.2352 318.3746 318.5140 318.6534 318.7927 318.9320 319.0714 319.2107 319.3500 319.4893 319.6285 319.7678 319.9070 320.0463 320.1855 320.3247 320.4639 320.6031 320.7423 320.8815 321.0206 321.1598 321.2989 321.4380 321.5771 321.7162 321.8553 321.9944 322.1334 322.2725 322.4115 322.5506 322.6896 322.8286 322.9676 323.1065 323.2455 323.3845 323.5234 323.6623 323.8012 323.9402 324.0790 324.2179 324.3568 324.4957 324.6345 324.7733 324.9122 --------------------------------------------------------------------------------------- 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 100-242: 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 20240703T120646.3Z 8950.504703 123 1 50.22 2 82.73 67.75 54.09 77.60 0.00 1 0.00 1 0 33 8.540e-01 4.886e-02 3.020e-01 1.052e-02 8.766927e-01 6.367201e-03 9.629540e-03 -6.000000e+00 5.147110e-01 230.38 -2.00 3.24 -2.00 321.90 0.00e+00 -6.144367e-04 3.405852e-03 5.935609e-03 -6.000000e+00 2.644018e-02 293.63 -2.00 20.00 -2.00 321.32 0.00e+00 7.276 0.005 302.00 328.00 3 1.7790e+00 2.4493e-02 8.9943e-02 -6.0000e+00 1.2916e+00 1.1254e+00 3.2068e-02 5.9988e-02 -6.0000e+00 1.4030e+00 -1.4975e+00 2.3241e-02 2.4230e-02 -6.0000e+00 8.2982e-01 6.2529e-01 1.1037e-02 6.5529e-03 -6.0000e+00 3.6512e-01 2.3451e-05 -4.7678e-03 2.9871e-04 1.1261e-04 -6.0000e+00 2.6633e-02 2.4641e-03 0.0000e+00 12 8 8 10 0 0 63.44 24.28 0.70 0.00246 -0.03336 23 5 1 5 0 2183.010 26.83 19.99 24.28 34.60 32.5 1100.00 900000 900000 -100214 900000 -68949 -38733 900000 23623 900000 900000 -97765 900000 -106515 72684 -565 900000 167836 900000 46010 375107 337014 57496 900000 161527 -6596 154005 11889 79819 -21340 -36654 900000 134750 79350 80063 -18552 900000 900000 900000 900000 86691 137072 387905 79048 134558 900000 195581 11460 2580 900000 29584 366775 37223 70910 117075 148679 46826 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-5932 -3755 -5187 -5699 96 -4483 -245 -8053 4079 -665 -6265 -7578 1026 32869 -5100 -1200 2104 677 -141 4219 924 -465 -2714 -306 -1186 5858 3794 5197 -1574 4452 -192 2070 -4581 -106 904 -2610 1279 7914 -3339 -2865 3437 1041 736 -1940 3204 -6687 -2660 SS 20240703T121810.0Z 8950.512615 126 1 49.50 2 80.43 69.03 51.73 78.55 0.00 1 0.00 1 0 33 9.793e-01 4.653e-02 1.406e-01 2.860e-03 6.612340e-01 1.572973e-03 1.348641e-02 -6.000000e+00 5.814490e-01 230.38 -2.00 3.24 -2.00 321.07 0.00e+00 3.554998e-02 7.681595e-04 1.735578e-02 -6.000000e+00 2.793318e-02 293.63 -2.00 20.00 -2.00 320.39 0.00e+00 5.726 0.002 302.00 328.00 3 1.4050e+00 5.5077e-03 9.5181e-02 -6.0000e+00 1.4536e+00 8.6220e-01 6.5266e-03 7.2105e-02 -6.0000e+00 1.5735e+00 -1.3009e+00 3.8939e-03 2.2835e-02 -6.0000e+00 9.3350e-01 5.8339e-01 2.0602e-03 5.6909e-03 -6.0000e+00 3.9803e-01 1.8340e-04 -2.0855e-03 7.8861e-05 5.1307e-04 -6.0000e+00 2.8278e-02 2.4530e-03 0.0000e+00 12 8 8 10 0 0 21.67 24.26 0.41 0.00245 -0.01322 83 18 1 5 0 596.290 26.83 20.01 24.26 35.18 32.5 1100.00 -99429 356975 265929 900000 227252 211708 900000 155738 900000 243697 84880 900000 133317 276455 164678 900000 217051 297079 230144 231065 211554 160737 197368 128311 142797 111868 114370 83233 135668 94194 213638 152602 141896 131298 99906 140867 121126 222821 91148 82693 62404 85243 58867 73888 77985 81519 67319 67806 84885 62067 75562 53602 52942 47491 43962 31484 29070 10148 19150 15427 23025 20716 22970 24120 21343 23302 19354 16602 13414 11021 7714 7193 3283 924 933 1899 -6833 -2468 1292 24 584 -3409 -3664 -5102 -5501 -7954 -6199 -6229 -5185 -3900 -3966 -4172 -5830 -7405 -9117 -6115 -4936 -2880 -3240 -2094 -1341 -2393 -2366 -3511 -3718 -4071 -3041 -2972 -591 -956 -417 -260 -101 -526 -69 505 823 1251 1676 2472 2736 3937 3807 4021 3116 4262 2706 3334 2422 2375 2343 1753 1504 1505 -287 -767 -649 -937 -1211 -1671 -1275 -2384 -2754 -22377 1224 2280 900000 2095 1861 900000 1736 900000 888 1401 900000 2000 1363 3212 900000 3303 2165 3354 3269 3401 3824 2877 3273 2785 2734 2599 2533 2559 3109 2656 4220 4927 5178 4574 4257 4492 3200 4971 5316 5155 5803 5472 6191 6519 6863 6766 7018 7637 7301 8317 7398 7770 7631 7317 5773 5276 2132 3547 2978 4376 4518 5624 6591 6356 6684 5605 4965 4144 3912 3075 2964 1372 369 337 609 -2226 -834 445 10 287 -1873 -2207 -3288 -3760 -5908 -4754 -4941 -4100 -2967 -2837 -2783 -3767 -4948 -6913 -5287 -4710 -3138 -3735 -2445 -1479 -2550 -2281 -3350 -3769 -4422 -3477 -3478 -744 -1294 -629 -420 -166 -845 -105 735 1198 1902 2705 3964 4398 6371 5934 6043 4539 6224 3883 4864 3770 4003 4380 3383 3061 3236 -638 -1808 -1502 -2205 -2862 -3847 -2873 -5079 -5850 SS 20240703T122657.5Z 8950.518721 131 1 49.44 2 78.64 70.00 49.91 79.28 0.00 1 0.00 1 0 25 2.196e-01 5.583e-03 5.555e-02 1.423e-03 6.113553e-01 7.649456e-04 6.514007e-03 -6.000000e+00 1.286415e-01 230.38 -2.00 3.24 -2.00 320.50 0.00e+00 1.413986e-03 3.102335e-04 4.209983e-04 -6.000000e+00 5.907843e-03 293.63 -2.00 20.00 -2.00 319.73 0.00e+00 4.901 0.001 302.00 328.00 3 1.2257e+00 2.4309e-03 5.7143e-02 -6.0000e+00 3.2026e-01 2.6579e-02 3.1414e-03 2.9941e-02 -6.0000e+00 3.4594e-01 -2.9204e-02 2.8269e-03 1.5046e-02 -6.0000e+00 2.0701e-01 2.3033e-03 1.4159e-03 4.7679e-03 -6.0000e+00 8.9193e-02 6.1942e-04 -8.1662e-04 4.0099e-05 5.3672e-05 -6.0000e+00 6.1872e-03 2.2851e-03 0.0000e+00 10 0 0 10 0 0 5.13 24.28 0.28 0.00229 -0.00385 183 39 1 5 0 270.120 26.83 19.99 24.28 35.78 32.6 1100.00 900000 -54110 -102234 -37290 -119948 -74183 -5200 -86829 -10939 -58622 -68642 -34953 -61414 -37007 -48838 58071 -12013 -10994 -2572 -12646 -10295 -20597 -5604 -14288 -11608 -9916 -16399 -8796 -14218 -11971 5050 -1758 -3029 -1018 -10625 -1603 -1302 10723 188 -2851 -1779 480 -746 -423 3929 1771 -905 -2749 2987 142 3244 -24 1582 2059 1472 1966 1599 -1707 516 438 1724 1065 1491 1837 1043 963 301 315 1914 1520 658 465 -32 -286 827 -329 -1767 -1015 -2 -665 -513 -1389 -1645 -1015 -730 -458 -302 -12 12 525 828 844 430 531 277 0 105 282 -223 -424 -155 -321 -148 -347 -363 -1196 -940 -960 -102 1407 10 61 -44 262 161 609 516 336 -110 -194 -646 23 143 37 42 411 218 910 411 -2 -84 -280 -106 88 -91 -174 -91 254 -116 -116 53 -133 -15 900000 -375 -1153 -228 -1467 -618 -24 -987 -71 -625 -863 -361 -1039 -626 -1161 602 -266 -267 -62 -340 -279 -629 -166 -479 -414 -370 -665 -322 -546 -486 204 -90 -182 -64 -676 -99 -84 740 18 -334 -221 63 -104 -60 547 258 -138 -442 474 25 612 -5 374 501 384 534 451 -499 144 121 487 332 524 686 413 374 116 125 820 750 346 258 -18 -151 418 -151 -767 -438 -1 -354 -319 -950 -1241 -811 -596 -399 -277 -11 11 479 706 700 342 429 236 0 115 336 -281 -542 -187 -367 -161 -376 -403 -1426 -1134 -1237 -137 2062 16 100 -73 414 248 894 756 512 -178 -320 -1075 37 229 58 65 607 311 1317 636 -3 -151 -522 -207 176 -188 -383 -200 566 -261 -255 113 -278 -29 SS 20240703T123316.6Z 8950.523109 134 1 49.58 2 77.35 70.68 48.59 79.81 0.00 1 0.00 1 0 25 1.226e-01 4.764e-03 2.577e-02 9.915e-04 5.582333e-01 5.267662e-04 5.972522e-03 -6.000000e+00 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