File name: Pandora159s1_Wakkerstroom_20210109_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T024359.8Z 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_20210109_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: 20210109 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 20210109T034120.8Z 7679.153713 125 1 47.62 2 85.27 112.44 38.23 82.49 0.00 1 0.00 1 0 17 8.179e-01 8.193e-02 5.263e-01 6.522e-02 8.563016e-01 3.720617e-02 8.968841e-03 -6.000000e+00 4.726784e-01 227.67 -2.00 3.06 -2.00 321.67 0.00e+00 -3.665022e-02 1.169446e-02 7.287678e-03 -6.000000e+00 2.139399e-02 282.27 -2.00 20.00 -2.00 320.93 0.00e+00 10.274 0.007 302.00 328.00 3 1.7522e+00 1.1721e-01 1.1880e-01 -6.0000e+00 1.1747e+00 1.5600e+00 1.4272e-01 1.2696e-01 -6.0000e+00 1.2864e+00 -1.8273e+00 8.9913e-02 2.3696e-02 -6.0000e+00 7.6162e-01 6.5596e-01 4.7074e-02 2.9907e-02 -6.0000e+00 3.2691e-01 9.2659e-06 2.1495e-03 1.8187e-03 2.3991e-04 -6.0000e+00 2.2996e-02 2.1789e-03 12 8 8 10 0 0 45.12 19.59 1.08 0.00218 0.01833 12 3 4 8 0 3967.620 14.99 19.59 18.93 21.79 21.69 14.5 905.09 900000 900000 18919 221603 48956 79103 -40063 82195 49354 -2784 205721 -52654 68916 56553 900000 18501 17176 310318 8724 55413 48875 44448 -79092 249640 8005 240799 -24651 -55499 32955 138565 900000 38423 900000 -15413 49139 128116 900000 211833 900000 174474 900000 88124 57019 64922 298554 -70401 -33666 -11452 900000 183478 -11759 900000 59837 39991 -13275 152630 56350 136800 241881 114068 45112 24835 243740 38039 -6849 88501 -11686 -23712 48510 5686 93485 45498 8924 -9517 -19009 50844 -14603 38643 1210 7752 -7000 -1330 8156 345 25701 21312 -12448 13533 1943 -22297 7141 -30417 13923 -5851 31413 -8762 26825 7836 1457 -6930 -5281 -17800 -2958 18915 -8966 10641 900000 5280 -8163 6844 -8752 3777 -1683 7091 5868 799 -1963 -4428 2562 -5698 8471 -4406 4599 9682 3197 378 -2409 5324 739 -3811 -815 3938 -4832 -81 371 -881 -1824 2059 1487 3005 -519 -2802 -489 900000 900000 1714 14064 3107 5020 -5279 5216 3987 -402 13056 -12049 4715 4323 900000 2067 1885 19694 961 3676 3255 3013 -19931 15843 1237 15282 -4873 -11892 2444 8794 900000 2767 900000 -1934 3119 8131 900000 13444 900000 11073 900000 7934 6486 6132 18947 -20114 -6328 -1694 900000 11644 -2067 900000 6260 5520 -3306 9686 7918 8682 15351 7239 5262 3671 15469 5879 -1663 8223 -2860 -6943 7975 1613 12244 9693 2616 -3053 -5924 7099 -3591 5827 293 2060 -2498 -515 3158 154 9506 8681 -7303 6207 973 -13306 2999 -17524 5228 -2867 12294 -5848 14544 5795 1231 -6273 -4370 -14950 -1995 10618 -7112 7383 900000 4410 -8700 7251 -12158 4998 -2402 9133 7339 1020 -2616 -6345 3617 -8946 11273 -6350 5883 11533 3951 466 -3000 6641 1118 -6925 -1598 7918 -11357 -197 965 -2437 -5193 5724 4103 7757 -1284 -6617 -1101 SS 20210109T035544.7Z 7679.163712 128 1 49.45 2 82.30 110.92 35.12 80.34 0.00 1 0.00 1 0 25 5.557e-01 1.085e-02 3.456e-01 6.746e-03 7.338479e-01 3.797013e-03 7.073347e-03 -6.000000e+00 3.206750e-01 227.67 -2.00 3.06 -2.00 321.77 0.00e+00 3.940238e-03 2.079971e-03 1.181891e-03 -6.000000e+00 1.460125e-02 282.27 -2.00 20.00 -2.00 321.26 0.00e+00 6.962 0.002 302.00 328.00 3 1.6712e+00 1.4124e-02 6.6769e-02 -6.0000e+00 8.0042e-01 1.2474e-01 2.0894e-02 3.8348e-02 -6.0000e+00 8.7197e-01 -1.5792e-01 2.2455e-02 1.9094e-02 -6.0000e+00 5.1225e-01 5.7419e-02 1.0358e-02 7.5368e-03 -6.0000e+00 2.1755e-01 1.6806e-04 -9.3389e-04 1.9502e-04 8.0750e-05 -6.0000e+00 1.5570e-02 2.6355e-03 12 8 8 10 0 0 98.31 19.58 0.45 0.00264 -0.00438 69 15 4 8 0 716.490 15.00 19.58 19.78 21.79 21.69 14.5 910.02 900000 -237093 -175687 -177783 -232198 -163788 900000 900000 -209465 900000 -168935 -172156 -145034 900000 -140305 -57640 -81627 -86452 8746 -28729 49416 49968 900000 93645 73682 -34401 -15121 4298 32126 -74354 63822 8076 8070 -31986 -35151 43689 -54462 14489 7817 66 -16491 -6354 -4719 12180 -8963 3683 15506 -569 8397 -15417 10538 -4540 9809 -703 10694 1370 4463 1838 7307 -7882 8467 5972 8922 5125 5212 9134 3787 6109 2861 6268 -2503 2356 1665 2690 936 234 -563 3446 3603 914 1309 -693 -3023 -1685 -319 -1447 -1693 -1095 848 596 -66 357 1735 830 -260 1162 -112 314 -2180 -305 -507 737 781 19 -1108 -930 -4994 -1062 107 -363 274 -917 530 324 448 1873 575 418 -531 -94 -637 375 -332 486 989 506 448 1310 686 211 605 319 155 282 -222 -878 190 -187 -355 -467 255 -27 387 900000 -2408 -1155 -1168 -2220 -1076 900000 900000 -2253 900000 -1413 -1748 -1473 900000 -2347 -517 -1073 -1343 57 -292 325 328 900000 615 484 -514 -190 44 250 -1866 496 135 159 -1013 -1113 626 -2310 372 266 3 -975 -368 -285 640 -594 222 862 -39 562 -1428 850 -483 1002 -87 1265 187 608 256 934 -1154 1093 881 1476 1004 1087 1812 790 1303 649 1593 -766 716 502 753 264 60 -136 828 988 310 480 -298 -1465 -857 -171 -836 -1032 -682 516 349 -36 184 934 472 -156 807 -92 296 -2308 -318 -494 632 609 15 -954 -846 -4999 -1099 121 -469 394 -1422 817 486 638 2524 793 606 -825 -150 -1008 561 -481 677 1320 654 561 1711 1032 365 1152 651 335 648 -552 -2308 505 -505 -958 -1211 613 -61 838 SS 20210109T040206.2Z 7679.168128 131 1 50.46 2 80.98 110.26 33.76 79.31 0.00 1 0.00 1 0 25 3.982e-01 8.314e-03 1.763e-01 2.862e-03 6.575169e-01 1.535976e-03 6.395210e-03 -6.000000e+00 2.259820e-01 227.67 -2.00 3.06 -2.00 321.32 0.00e+00 3.543424e-03 7.572503e-04 1.178343e-03 -6.000000e+00 1.000461e-02 282.27 -2.00 20.00 -2.00 320.75 0.00e+00 6.058 0.001 302.00 328.00 3 1.1338e+00 5.3052e-03 5.8425e-02 -6.0000e+00 5.6152e-01 1.0836e-01 7.3822e-03 3.3769e-02 -6.0000e+00 6.1025e-01 -1.1385e-01 7.5843e-03 1.6348e-02 -6.0000e+00 3.6343e-01 3.3704e-02 3.5982e-03 7.1669e-03 -6.0000e+00 1.5429e-01 6.1506e-04 -8.5777e-04 8.1204e-05 6.6599e-05 -6.0000e+00 1.0649e-02 1.9878e-03 11 8 0 10 0 0 32.91 19.58 0.35 0.00199 -0.00446 171 37 4 8 0 288.310 15.00 19.58 20.26 21.79 21.69 14.6 913.29 -204004 -71619 -171837 -29250 -198069 6682 -161633 -59768 -100844 -39674 -121911 -97485 -67114 -103783 9561 -58076 33994 -35955 56772 -33268 15632 -39318 -9067 -7861 -8072 -20056 -31483 -19726 -36946 -13374 -19831 19869 -9703 26605 -10114 14264 -9102 -2898 -7718 -5492 -1159 -5253 -288 -4350 7922 -3416 9106 -1481 6622 3321 1336 4320 3982 4453 371 3861 -306 3705 -2330 5350 790 3779 3202 4660 2350 2189 2928 1574 4887 313 2503 -1204 1236 -1032 2284 -1908 2620 -404 651 868 -703 -1270 -2756 -880 -1528 7 -887 443 53 107 -163 712 677 639 3 -267 672 -305 -354 -931 117 -576 954 39 -1422 -1396 1102 -908 -564 -234 -767 -214 -280 481 96 1424 988 1008 24 -653 -619 -107 35 -283 717 -128 1459 998 436 32 470 43 151 417 -458 -413 19 -11 -558 140 -65 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