File name: Pandora159s1_Wakkerstroom_20210624_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T031132.0Z 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_20210624_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: 20210624 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 20210624T052028.8Z 7845.222556 190 1 48.02 2 84.75 60.22 101.86 234.72 0.00 1 0.00 1 0 25 5.382e-01 6.631e-02 5.138e-01 6.511e-02 9.030349e-01 3.891296e-02 9.178178e-03 -6.000000e+00 3.249277e-01 224.87 -2.00 3.06 -2.00 321.97 0.00e+00 5.836580e-03 1.506298e-02 1.102778e-03 -6.000000e+00 1.529277e-02 277.14 -2.00 20.00 -2.00 321.49 0.00e+00 9.517 0.005 302.00 328.00 3 2.0939e+00 1.2774e-01 8.7022e-02 -6.0000e+00 8.1217e-01 1.5948e+00 1.4943e-01 4.0477e-02 -6.0000e+00 8.9422e-01 -1.9216e+00 9.3673e-02 2.0450e-02 -6.0000e+00 5.2171e-01 7.7857e-01 5.1912e-02 7.0251e-03 -6.0000e+00 2.2104e-01 9.0877e-06 -6.0711e-03 1.8182e-03 1.1068e-04 -6.0000e+00 1.5372e-02 3.4038e-03 12 8 8 10 0 0 22.26 18.13 1.53 0.00340 -0.04222 12 3 4 8 0 4000.000 14.99 18.13 3.54 20.67 20.67 15.8 813.03 -12889 900000 94310 900000 -53925 -46833 -48782 900000 900000 -75638 -53677 -68160 900000 124800 101254 7771 900000 900000 60539 116366 -25442 -63335 900000 900000 261180 44461 900000 143073 103062 900000 900000 126732 900000 900000 -21091 900000 -11963 102089 -12663 97599 77719 900000 36322 900000 38615 900000 900000 900000 12967 -15424 -20960 34873 900000 900000 900000 146520 21622 900000 20762 8016 131511 -40685 115002 67655 66879 30444 16274 110061 21442 34339 -14201 -13149 59356 77608 21298 2309 10786 -28171 43453 22265 20354 -3919 -20009 17534 -7213 6924 26422 6525 24424 -1391 2995 -24368 -3550 2218 -12913 2793 -13775 11027 1748 -1683 -6703 18513 -5323 -19479 1138 7966 -7481 299 3607 -5853 1023 -613 -4104 -7914 -1770 -8158 10790 1927 5945 4588 4450 13579 -240 1292 780 8674 2064 -14240 7782 2428 -4407 3670 1258 1323 -1423 1697 2006 -1841 -1647 -2777 468 146 529 -1380 900000 5957 900000 -6128 -4144 -4037 900000 900000 -7454 -4040 -6067 900000 7883 6396 645 900000 900000 3824 7350 -2797 -9034 900000 900000 16497 2808 900000 9037 6510 900000 900000 8005 900000 900000 -2066 900000 -966 6448 -1297 6165 4909 900000 2913 900000 2860 900000 900000 900000 1251 -2053 -3197 3391 900000 900000 900000 9255 2840 900000 2466 1008 8307 -8553 7264 6356 6835 4432 2670 7448 3733 5978 -4335 -4096 8911 9008 3806 435 1720 -6682 5782 4382 4853 -1368 -9090 5868 -3237 2852 9379 2879 8986 -634 1224 -12199 -1418 875 -6737 1484 -10152 7464 1453 -1495 -5935 11511 -3683 -14924 755 5257 -6043 242 3143 -6457 1214 -816 -5863 -11748 -2385 -11296 12425 2533 7941 6450 6155 16306 -314 1623 955 9561 2350 -19693 10013 3856 -8449 7096 2660 2994 -3535 4315 5179 -4973 -4416 -7239 1093 313 1062 SS 20210624T053602.3Z 7845.233360 193 1 49.25 2 81.78 58.23 104.50 232.57 0.00 1 0.00 1 0 25 5.149e-01 1.370e-02 3.149e-01 6.887e-03 6.952452e-01 3.725475e-03 6.780269e-03 -6.000000e+00 2.890500e-01 224.87 -2.00 3.06 -2.00 321.64 0.00e+00 4.928593e-03 1.909977e-03 3.895642e-03 -6.000000e+00 1.280134e-02 277.14 -2.00 20.00 -2.00 321.16 0.00e+00 6.578 0.002 302.00 328.00 3 1.9341e+00 1.3063e-02 6.7050e-02 -6.0000e+00 7.1484e-01 1.7139e-01 1.8671e-02 4.7927e-02 -6.0000e+00 7.7922e-01 -2.6797e-01 1.9865e-02 1.8743e-02 -6.0000e+00 4.6373e-01 1.0559e-01 9.3207e-03 7.8555e-03 -6.0000e+00 1.9721e-01 1.8131e-04 -1.2725e-03 1.9672e-04 6.9917e-05 -6.0000e+00 1.3792e-02 4.0792e-03 12 8 8 10 0 0 62.40 18.12 0.30 0.00408 -0.00548 70 15 4 8 0 703.410 14.99 18.12 4.85 20.67 20.67 16.0 821.07 -257829 -81866 -142411 -84677 -165385 -202007 -88769 -207614 -81696 -188734 -23616 -165159 900000 -142602 66757 -22592 46841 -55968 7722 -21770 -21201 -14823 -26192 13024 -82651 47390 -6126 115878 -30688 57481 13234 19953 40257 -7522 -2674 -21796 -22748 -14600 20781 -16410 24623 1284 13058 7929 4967 16113 7959 25463 -1928 23236 1598 24257 5576 18572 3754 10151 -103 10539 4383 11585 9328 -4211 12978 3742 5270 -1605 10359 3280 7266 -463 3260 -793 2624 3648 -3976 3433 -881 4748 -4061 2577 -202 -1345 -2113 -479 -1757 -1195 407 -2022 1727 -1509 3497 -1499 1965 -1459 550 -918 -1115 -930 -1017 -660 -515 1407 471 1145 -2401 -1224 1069 -739 -1027 -386 -945 -1257 -75 -104 331 551 1943 -410 410 -996 30 116 595 125 357 992 1432 2256 -433 311 -89 1297 137 660 -396 173 381 -263 -827 -624 83 -715 418 -5786 -550 -1323 -569 -1705 -2893 -596 -3754 -549 -3387 -159 -2846 900000 -3309 448 -252 315 -1084 87 -344 -339 -223 -453 168 -2848 492 -108 778 -668 592 253 430 826 -258 -85 -819 -946 -662 819 -1087 1237 87 828 544 357 1065 588 1663 -172 1753 166 2259 683 2172 539 1424 -16 1498 642 1565 1336 -754 2269 806 1185 -380 2152 760 1804 -142 1062 -280 880 1147 -1225 887 -223 1168 -1240 875 -83 -636 -1097 -262 -1029 -742 262 -1369 1131 -982 2020 -860 1053 -843 353 -693 -974 -932 -1107 -719 -527 1271 392 959 -2226 -1188 1071 -811 -1236 -517 -1422 -2001 -119 -161 482 776 2719 -617 645 -1649 49 181 890 183 504 1353 1880 3078 -685 553 -174 2662 296 1515 -978 442 993 -701 -2210 -1612 200 -1630 919 SS 20210624T054223.3Z 7845.237770 196 1 49.43 2 80.59 57.38 105.55 231.66 0.00 1 0.00 1 0 25 3.662e-01 7.873e-03 2.464e-01 4.095e-03 6.276960e-01 2.169761e-03 6.138239e-03 -6.000000e+00 2.055805e-01 224.87 -2.00 3.06 -2.00 321.32 0.00e+00 2.871553e-03 1.025290e-03 1.683940e-03 -6.000000e+00 9.005550e-03 277.14 -2.00 20.00 -2.00 320.81 0.00e+00 5.831 0.001 302.00 328.00 3 1.8518e+00 7.2479e-03 5.6305e-02 -6.0000e+00 5.0843e-01 2.1756e-02 1.0118e-02 3.3097e-02 -6.0000e+00 5.5421e-01 -5.1294e-02 1.0866e-02 1.5689e-02 -6.0000e+00 3.2978e-01 1.0601e-02 5.2119e-03 5.9609e-03 -6.0000e+00 1.4014e-01 3.8330e-04 -7.8811e-04 1.1829e-04 5.9132e-05 -6.0000e+00 9.7864e-03 4.0351e-03 11 8 0 10 0 0 71.96 18.12 0.42 0.00404 -0.00189 112 24 4 8 0 441.300 14.99 18.12 5.65 20.67 20.67 16.2 826.86 -156137 -70313 -115038 -124498 -134056 -116882 -152133 172930 -119240 65402 -47374 -7193 -8515 20589 -44364 -34895 -51632 -40752 -14460 -49838 22602 -37135 33853 -24144 8237 -17537 -10612 -22001 -25185 6182 -13543 39672 -10516 -361 -2846 3243 -17671 14395 -2917 -3142 -536 -10073 -1372 -10129 2574 -460 8419 -2965 -2750 -2158 4002 3425 -271 1430 1904 724 -4331 -111 1074 1478 208 3260 1781 4015 1934 3846 2406 1842 3893 1679 1365 1311 2494 -1116 2353 -255 2452 381 1019 -401 -295 -980 -2794 -808 -2027 260 -767 -393 -240 726 228 263 202 781 1688 -38 1295 135 -581 -719 -29 -512 1573 410 -1022 -1246 -1755 -636 -683 -473 -631 83 -487 555 176 1651 696 798 -260 -501 -685 -294 218 -466 961 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