File name: Pandora159s1_Wakkerstroom_20240723_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20240723T221259.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Refilwe Kai Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 159 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora159_OF_v6d20191004.txt Instrument calibration file used: Pandora159s1_CF_v3d20201207.txt Level 1 file used: Pandora159s1_Wakkerstroom_20240723_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: 20240723 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 20240723T054611.8Z 8970.240415 234 1 49.45 2 78.66 60.28 83.00 255.67 0.00 1 0.00 1 0 25 1.081e-01 6.246e-03 7.596e-02 2.163e-03 5.262400e-01 1.119205e-03 5.295116e-03 -6.000000e+00 6.081805e-02 225.73 -2.00 3.06 -2.00 320.62 0.00e+00 4.071275e-03 4.314790e-04 1.423806e-03 -6.000000e+00 2.652498e-03 276.73 -2.00 20.00 -2.00 320.06 0.00e+00 4.919 0.001 302.00 328.00 3 1.7447e+00 3.4181e-03 4.7393e-02 -6.0000e+00 1.5072e-01 4.5363e-02 4.3343e-03 2.7736e-02 -6.0000e+00 1.6428e-01 -1.9783e-02 4.2369e-03 1.2418e-02 -6.0000e+00 9.7665e-02 -3.1038e-03 2.1351e-03 6.0051e-03 -6.0000e+00 4.1347e-02 9.2552e-04 -9.9777e-04 6.2574e-05 4.8557e-05 -6.0000e+00 2.8907e-03 1.3452e-02 10 0 0 10 0 0 99.92 18.46 0.35 0.01345 0.00595 155 33 4 8 0 319.020 14.99 18.46 8.64 20.96 20.87 25.1 793.38 -56744 -26353 -27771 -46870 -49166 -26943 -40786 15039 -36170 -20713 -27924 24823 1374 11383 -1379 -657 9061 -4533 -1953 -8505 -2537 -7210 2826 -9335 -5757 -2042 -9710 -3267 2878 -4957 -6165 1526 1004 -6841 -145 -786 -1993 -1182 -1948 -1159 -4482 -1228 -2454 -1934 -496 -1298 504 -45 925 412 1480 220 2253 682 586 2298 -493 362 515 1877 1203 718 1569 927 -312 1587 1020 1891 1421 449 229 -649 -504 72 66 134 848 371 1026 -124 -367 -1402 -1950 -923 -996 -907 -618 -579 -161 278 848 1129 1435 2017 1556 1113 654 345 -614 -350 -198 50 1463 218 -1402 -918 -574 -821 -76 -219 -501 -433 -169 178 586 1203 844 674 -144 -761 -738 -85 -426 -309 564 122 1459 1213 354 277 302 -72 59 280 -315 -505 136 -167 -509 -35 237 -17 246 -563 -222 -252 -494 -487 -210 -396 95 -427 -223 -336 199 17 166 -28 -16 218 -124 -56 -276 -79 -236 96 -351 -224 -80 -415 -127 115 -208 -306 83 62 -480 -9 -49 -141 -99 -201 -140 -621 -176 -374 -300 -77 -208 81 -7 156 74 288 48 524 173 156 624 -141 102 141 504 339 225 549 361 -127 606 379 710 593 217 121 -361 -276 37 31 56 330 146 446 -64 -219 -955 -1445 -714 -825 -802 -574 -552 -152 251 706 868 1042 1486 1277 1051 709 389 -752 -423 -222 55 1473 228 -1609 -1108 -726 -1014 -101 -322 -806 -722 -277 275 846 1645 1167 979 -224 -1251 -1209 -133 -651 -455 788 179 2031 1756 527 459 541 -136 117 578 -699 -1177 323 -403 -1234 -81 520 -36 499 SS 20240723T055223.7Z 8970.244719 237 1 18.03 2 77.47 59.42 84.30 255.05 0.00 1 0.00 1 0 25 7.809e-02 7.104e-03 8.704e-02 3.370e-03 4.815258e-01 1.702220e-03 4.903240e-03 -6.000000e+00 4.393164e-02 225.73 -2.00 3.06 -2.00 319.99 0.00e+00 2.633262e-03 5.420516e-04 8.634357e-04 -6.000000e+00 1.915978e-03 276.73 -2.00 20.00 -2.00 319.42 0.00e+00 4.485 0.001 302.00 328.00 3 2.5678e+00 4.9108e-03 4.2626e-02 -6.0000e+00 1.0887e-01 4.1341e-02 5.9425e-03 2.3318e-02 -6.0000e+00 1.1866e-01 -9.9968e-03 5.2909e-03 1.0992e-02 -6.0000e+00 7.0547e-02 -5.0090e-03 2.7519e-03 4.3319e-03 -6.0000e+00 2.9868e-02 5.9925e-04 -7.0010e-04 9.5479e-05 3.8057e-05 -6.0000e+00 2.0880e-03 1.3145e-02 12 9 1 12 1 1 99.47 18.46 0.33 0.01314 0.00788 22 14 4 8 0 783.660 14.99 18.46 8.97 20.96 20.87 25.3 795.82 -15745 57288 -21735 9867 -20216 4464 -24105 -3696 -6538 -2834 41494 -185 -24042 1333 -2182 -12367 226 -9455 2268 -1433 -473 -4218 1296 -4602 6458 -6274 -10107 3941 -6049 -6293 1571 3485 550 -1068 -3521 7459 -5106 793 -974 -5745 205 -2575 -1796 -2542 1323 -968 -770 509 1159 2579 1320 757 366 -535 317 1530 -1480 50 790 1124 2398 2278 1828 204 -104 878 52 972 1513 748 70 -770 205 -28 954 975 -249 1513 1405 602 -512 -1287 -2228 -521 -1485 -1447 -142 -605 -98 37 793 722 1046 1717 1479 864 1134 -175 -593 -340 -81 -546 1059 1192 -1190 -1110 -1177 -732 -131 209 -544 -542 122 381 415 1575 764 -40 -275 -988 -616 -336 -7 -157 707 235 1261 1678 404 160 41 -38 -18 467 -531 -259 202 -78 -406 -104 136 -269 96 -190 392 -331 106 -268 46 -355 -51 -104 -46 454 -3 -662 36 -73 -525 9 -461 106 -73 -24 -226 69 -279 376 -432 -726 238 -395 -435 115 289 53 -108 -348 662 -564 99 -149 -1072 40 -546 -394 -574 291 -221 -177 118 273 625 352 223 116 -184 112 554 -562 19 287 404 887 923 820 101 -53 423 24 459 776 436 44 -509 133 -17 545 508 -122 730 741 367 -356 -997 -1859 -448 -1367 -1409 -143 -625 -100 36 733 625 861 1422 1332 874 1271 -218 -784 -445 -100 -623 1128 1304 -1416 -1379 -1522 -986 -187 320 -889 -910 200 600 619 2245 1099 -60 -436 -1631 -1018 -541 -11 -240 1038 335 1730 2358 620 266 72 -68 -34 903 -1078 -546 432 -169 -880 -220 277 -529 186 SS 20240723T055737.3Z 8970.248348 239 1 49.38 2 76.47 58.69 85.39 254.52 0.00 1 0.00 1 0 25 4.972e-02 6.496e-03 2.303e-02 1.256e-03 4.501126e-01 6.311671e-04 4.582167e-03 -6.000000e+00 2.797080e-02 225.73 -2.00 3.06 -2.00 319.96 0.00e+00 3.960816e-03 1.953569e-04 8.553091e-04 -6.000000e+00 1.219885e-03 276.73 -2.00 20.00 -2.00 319.37 0.00e+00 4.176 0.000 302.00 328.00 3 1.6402e+00 1.8113e-03 3.9878e-02 -6.0000e+00 6.9318e-02 3.9826e-02 2.1732e-03 2.2530e-02 -6.0000e+00 7.5552e-02 -1.6388e-02 1.8881e-03 1.0359e-02 -6.0000e+00 4.4917e-02 -7.7522e-04 9.8843e-04 5.1788e-03 -6.0000e+00 1.9017e-02 1.9956e-03 -8.5647e-04 3.6068e-05 4.2373e-05 -6.0000e+00 1.3294e-03 1.3177e-02 11 8 0 10 0 0 99.79 18.46 0.21 0.01318 0.00674 203 44 4 8 0 243.200 14.99 18.46 9.45 20.96 20.87 25.4 798.55 -31171 -20397 -13931 -12291 -13008 -5314 -14356 -12087 -15385 -12016 -7499 -18713 -5525 -6901 -610 -1873 -2668 -2333 -1952 2075 -3441 1364 -1174 -2494 -4108 -3449 -5414 -882 -307 -1047 -2233 985 1082 -3907 -786 -189 -823 -479 178 -2821 -1840 -1223 -1512 -1345 -623 -1373 -469 46 256 1755 835 1003 1729 793 709 696 -25 313 722 1044 1614 1444 1405 868 -412 871 818 1151 1461 216 -5 -451 -313 -100 -94 758 327 1121 888 -405 -289 -1164 -2145 -722 -1176 -1017 -529 -440 -91 75 1016 777 1614 2102 1305 593 853 116 -739 -408 -274 22 1028 626 -1448 -718 -973 -610 -39 -121 -432 -379 -31 213 476 1215 719 379 -26 -978 -820 -238 -256 -183 627 303 1335 1660 473 260 46 37 113 282 -349 -360 67 204 -708 -32 -30 -212 204 -538 -359 -240 -198 -193 -78 -225 -210 -307 -243 -149 -458 -145 -227 -23 -82 -129 -121 -108 115 -206 78 -71 -162 -290 -252 -403 -60 -20 -74 -182 90 110 -435 -80 -19 -92 -64 29 -546 -389 -273 -353 -321 -149 -337 -115 11 64 451 236 310 572 282 263 266 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