File name: Pandora159s1_Wakkerstroom_20210529_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T030446.6Z 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_20210529_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: 20210529 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 20210529T050626.6Z 7819.212808 187 1 49.41 2 85.57 62.82 58.91 255.61 0.00 1 0.00 1 0 25 7.037e-01 3.733e-02 4.142e-01 2.468e-02 9.347699e-01 1.517699e-02 9.145423e-03 -6.000000e+00 4.159440e-01 224.80 -2.00 3.06 -2.00 322.46 0.00e+00 -2.725950e-03 8.243365e-03 4.954235e-03 -6.000000e+00 2.245272e-02 278.11 -2.00 20.00 -2.00 322.04 0.00e+00 10.768 0.007 302.00 328.00 3 -3.7764e-02 5.8735e-02 1.0011e-01 -6.0000e+00 1.0334e+00 1.4553e+00 7.3494e-02 5.1870e-02 -6.0000e+00 1.1356e+00 -1.8764e+00 5.7495e-02 2.4789e-02 -6.0000e+00 6.6799e-01 7.3893e-01 2.8519e-02 7.1421e-03 -6.0000e+00 2.8617e-01 3.4383e-05 -1.9832e-03 7.2887e-04 1.4692e-04 -6.0000e+00 2.1203e-02 6.3023e-03 12 8 8 10 0 0 5.45 18.58 0.81 0.00630 -0.00860 50 11 4 8 0 987.990 15.00 18.58 6.88 21.06 20.96 16.6 835.70 76449 900000 292288 900000 -112193 900000 -59583 900000 -42212 900000 -86310 900000 900000 75637 900000 199256 900000 -6333 900000 14898 900000 900000 221363 156747 900000 -11989 59776 900000 -59676 900000 -24297 65234 2038 900000 -42732 900000 63587 900000 900000 900000 900000 102605 900000 -1042 900000 13427 900000 -2256 351394 68969 137622 56123 115015 83490 87987 238903 -7362 87290 -25744 124826 6395 70167 2103 44705 53272 37874 38017 28692 49912 15333 69544 -1507 44101 5399 48454 27349 38387 -17844 13377 7890 8318 26128 -7726 16887 -8064 12025 -3216 14672 1159 4255 2434 11211 7762 7772 -1001 -14107 2924 -13084 4259 -8785 -1772 -2192 3296 1748 -3003 -4055 -7936 -4953 -5213 156 -4964 495 -2628 1816 942 586 695 1854 1790 -353 2190 -975 3103 174 3110 -234 5056 -1072 3836 32 487 2216 1755 1529 -2566 650 -1029 1185 -1935 679 -1938 567 -254 1830 900000 6997 900000 -8729 900000 -2593 900000 -1654 900000 -5072 900000 900000 1811 900000 4770 900000 -345 900000 616 900000 900000 5299 3753 900000 -574 1431 900000 -3507 900000 -1216 1562 102 900000 -3069 900000 1522 900000 900000 900000 900000 2903 900000 -79 900000 818 900000 -162 8412 2702 3295 3054 3755 3998 4213 5719 -945 4179 -3530 3885 585 3665 247 3892 4522 3709 3723 3247 5105 2536 7265 -328 5855 964 4956 3036 3592 -3068 1951 1477 1847 5629 -2589 4704 -3054 3926 -1274 4949 442 1500 816 3269 2331 2520 -414 -7952 1648 -10109 3068 -7304 -1284 -1412 1800 962 -1863 -2701 -5838 -3859 -4618 153 -5909 612 -3472 2281 1154 702 844 2344 2399 -496 2922 -1269 3714 210 3540 -268 5370 -1299 5218 53 911 4446 3801 3584 -6758 1745 -2860 3253 -5428 1762 -4748 1244 -536 SS 20210529T052035.6Z 7819.222634 190 1 50.93 2 82.80 61.04 61.84 254.52 0.00 1 0.00 1 0 25 5.350e-01 7.366e-03 2.508e-01 3.110e-03 7.256444e-01 1.697918e-03 6.988979e-03 -6.000000e+00 3.019561e-01 224.80 -2.00 3.06 -2.00 321.75 0.00e+00 3.835561e-03 9.135128e-04 3.000135e-03 -6.000000e+00 1.383274e-02 278.11 -2.00 20.00 -2.00 321.26 0.00e+00 7.373 0.002 302.00 328.00 3 -7.2478e-03 6.1309e-03 7.1299e-02 -6.0000e+00 7.4698e-01 9.3744e-02 9.3466e-03 4.4714e-02 -6.0000e+00 8.1481e-01 -8.2464e-02 1.0532e-02 1.9979e-02 -6.0000e+00 4.8288e-01 2.3331e-02 4.8634e-03 7.5109e-03 -6.0000e+00 2.0504e-01 6.6950e-04 -9.1874e-04 8.7874e-05 7.5967e-05 -6.0000e+00 1.4325e-02 5.8319e-03 11 8 0 10 0 0 24.31 18.58 0.28 0.00583 -0.00107 262 56 2 8 0 187.920 15.00 18.58 10.03 21.06 20.96 16.7 852.54 -217324 -224519 -212023 112082 -189146 900000 -155944 19676 -228735 900000 -154362 -63540 134733 -130337 -104174 -69490 -27068 -45563 76770 -50794 69526 -62162 23804 -61285 -8845 -52613 -36395 -37735 -58154 -24920 -24033 6814 -15427 2846 -13303 22977 -13020 19074 -3850 2219 -1785 -3411 1489 -7261 3249 3418 17875 -5732 7103 5590 8180 2678 8525 2978 1206 4865 236 3728 -992 6800 1586 7092 1613 5077 -37 1245 1823 1655 2465 -328 1921 -764 433 -1625 132 -594 2119 46 1081 -550 -555 -212 -2717 -435 -1990 -184 -1226 435 -331 367 649 195 828 1247 697 182 721 -23 -300 -655 455 -170 1373 315 -1528 -1345 -1036 -677 -478 51 -496 -101 -218 495 354 1293 828 756 -420 -820 -495 -274 51 -300 333 63 1608 1245 562 51 138 34 112 383 -630 -243 -88 109 -612 158 -24 162 171 -1258 -1671 -1519 340 -991 900000 -645 60 -2585 900000 -979 -212 409 -1365 -1091 -632 -205 -427 256 -588 274 -840 159 -963 -99 -885 -532 -551 -1058 -364 -431 111 -370 61 -326 393 -355 457 -144 94 -90 -189 83 -458 189 205 966 -414 482 421 679 266 888 360 158 646 34 515 -139 872 223 1056 293 1017 -8 250 396 378 576 -92 577 -246 135 -486 35 -156 513 12 314 -179 -214 -94 -1354 -225 -1118 -108 -767 275 -209 222 365 104 425 670 429 132 608 -23 -321 -705 451 -151 1094 256 -1360 -1265 -1027 -720 -562 68 -740 -160 -348 760 516 1796 1166 1119 -667 -1355 -801 -423 75 -430 458 84 2043 1675 872 91 270 71 248 904 -1612 -653 -223 278 -1569 417 -61 375 381 SS 20210529T052647.2Z 7819.226935 193 1 51.11 2 81.60 60.24 63.12 254.04 0.00 1 0.00 1 0 25 3.231e-01 6.183e-03 1.157e-01 1.797e-03 6.561656e-01 9.618105e-04 6.469886e-03 -6.000000e+00 1.812967e-01 224.80 -2.00 3.06 -2.00 321.32 0.00e+00 3.199441e-03 4.633874e-04 2.163565e-03 -6.000000e+00 7.975996e-03 278.11 -2.00 20.00 -2.00 320.80 0.00e+00 6.453 0.002 302.00 328.00 3 -5.9755e-02 3.2573e-03 6.1832e-02 -6.0000e+00 4.4815e-01 6.5417e-02 4.5985e-03 3.6387e-02 -6.0000e+00 4.8848e-01 -4.0975e-02 4.9687e-03 1.6542e-02 -6.0000e+00 2.9085e-01 5.6873e-03 2.3649e-03 6.4924e-03 -6.0000e+00 1.2369e-01 1.5219e-03 -9.1968e-04 5.1304e-05 6.2241e-05 -6.0000e+00 8.6343e-03 5.4845e-03 10 0 0 10 0 0 29.70 18.58 0.25 0.00548 -0.00143 407 88 2 8 0 121.090 15.01 18.58 11.24 21.06 21.06 16.8 858.04 -67607 -103060 -112098 -93550 -153365 -79872 -95599 -115127 -107258 -88317 -99525 -84448 -65678 -48706 -46994 -32506 -24970 -37481 -14298 -16720 -1168 -23918 -28454 -23457 -18076 -16346 -13666 -19793 -19475 -20915 -3319 -10271 -3740 -9342 -8573 -952 -2216 -1303 -1027 1170 -762 -258 -1794 -727 -619 2871 368 972 -181 2874 3532 2931 3477 1900 2160 435 1418 -188 504 700 1748 1840 3078 2158 1046 2206 2473 1837 2012 998 -9 -329 -424 -447 -691 305 -738 -68 373 -227 -350 -1151 -1886 -946 -1069 -1069 -659 -872 -161 225 938 591 1486 1513 1232 627 798 337 -559 -179 -22 158 938 525 -1689 -929 -840 -853 -68 -357 -372 -396 107 292 623 1394 680 499 -94 -804 -766 -61 -399 -237 437 245 1262 1589 293 197 -49 97 152 160 -326 -436 106 -78 -550 -92 33 80 504 -190 -488 -629 -426 -1183 -294 -452 -767 -752 -557 -750 -637 -530 -435 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