File name: Pandora159s1_Wakkerstroom_20211125_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T033925.6Z 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 v1.8.75 Instrument operation file used: Pandora159_OF_v6d20191004.txt Instrument calibration file used: Pandora159s1_CF_v3d20201207.txt Level 1 file used: Pandora159s1_Wakkerstroom_20211125_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: 20211125 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 20211125T051838.5Z 7999.221279 219 1 49.67 2 60.77 99.70 66.73 315.89 0.00 1 0.00 1 0 25 1.539e-02 7.441e-03 1.061e-02 3.016e-03 2.570124e-01 1.508614e-03 2.714826e-03 -6.000000e+00 8.753768e-03 228.13 -2.00 3.06 -2.00 317.74 0.00e+00 2.858549e-04 2.375802e-04 6.195372e-05 -6.000000e+00 3.837145e-04 280.31 -2.00 20.00 -2.00 317.03 0.00e+00 2.039 0.000 302.00 328.00 3 5.0178e+00 4.0160e-03 2.0256e-02 -6.0000e+00 2.1790e-02 5.9084e-02 4.5341e-03 1.1626e-02 -6.0000e+00 2.3676e-02 -6.9893e-03 2.7763e-03 5.7151e-03 -6.0000e+00 1.4079e-02 -3.4307e-03 1.3850e-03 1.6268e-03 -6.0000e+00 5.9638e-03 4.7556e-04 -2.7407e-04 8.7322e-05 1.8136e-05 -6.0000e+00 4.1160e-04 -1.6047e-03 11 8 0 10 0 0 99.98 18.85 0.35 -0.00160 -0.00366 39 8 1 8 0 1273.250 15.00 18.85 13.28 21.27 21.17 17.7 855.73 -6129 -1846 -4331 -4827 165 -5695 4283 854 2246 -5537 1972 -1884 484 -1160 679 -956 1026 1261 -438 1480 -2228 2305 -356 767 12 1108 -2469 400 -998 3250 1487 1038 3749 -3546 -176 -371 552 1042 1870 -1523 -596 -1455 -1584 -1054 -769 -570 -971 392 -869 1296 325 1187 450 631 560 1054 -118 540 430 1301 1278 1027 1469 677 -714 417 -51 377 1217 143 -382 -275 153 594 -541 864 -79 1909 994 86 -597 -978 -2235 -1396 -820 -1118 -156 -976 235 -600 625 -1 1144 2191 1555 663 547 626 -695 -503 -781 61 512 771 -1126 -828 -767 -929 -24 355 -290 -417 -28 -123 642 1124 1047 535 593 -630 -896 -310 -203 131 1079 720 1175 1460 234 397 -265 115 81 340 -406 -290 134 169 -669 -330 211 -470 41 -637 -200 -487 -510 15 -521 378 88 253 -698 229 -233 65 -183 119 -186 204 259 -95 325 -516 508 -82 184 3 291 -664 98 -233 721 353 268 1018 -1050 -48 -98 157 344 733 -709 -298 -767 -857 -571 -416 -306 -516 200 -441 646 173 666 268 393 359 687 -79 357 280 832 842 726 1118 549 -583 313 -36 256 877 117 -340 -253 140 524 -453 645 -54 1222 672 65 -510 -915 -2245 -1448 -900 -1313 -190 -1232 294 -733 703 -1 1085 2000 1503 708 642 805 -952 -677 -997 72 569 884 -1409 -1087 -1046 -1319 -35 549 -474 -690 -44 -184 886 1461 1354 722 855 -969 -1412 -482 -308 191 1488 957 1484 1840 316 570 -400 177 126 546 -691 -516 242 312 -1249 -603 371 -804 68 SS 20211125T054547.1Z 7999.240129 232 1 48.01 2 54.81 97.14 70.95 311.21 0.00 1 0.00 1 0 17 4.305e-02 2.876e-02 2.271e-02 8.256e-03 2.572581e-01 4.166667e-03 2.759691e-03 -6.000000e+00 2.447346e-02 228.13 -2.00 3.06 -2.00 317.20 0.00e+00 -1.215876e-04 5.706235e-04 1.025018e-04 -6.000000e+00 1.072846e-03 280.31 -2.00 20.00 -2.00 316.50 0.00e+00 1.731 0.000 302.00 328.00 3 6.6169e+00 1.0979e-02 1.8347e-02 -6.0000e+00 6.0919e-02 1.8414e-01 1.2370e-02 1.1663e-02 -6.0000e+00 6.6198e-02 -5.4831e-02 7.3161e-03 5.7426e-03 -6.0000e+00 3.9363e-02 5.0636e-03 3.5227e-03 1.6407e-03 -6.0000e+00 1.6671e-02 1.1809e-04 -1.6598e-03 2.3614e-04 1.9089e-05 -6.0000e+00 1.1510e-03 -1.8676e-04 12 8 8 10 0 0 99.88 18.84 0.78 -0.00019 -0.01266 12 3 2 8 0 4000.000 14.99 18.84 15.19 21.27 21.17 18.0 866.81 -14226 -9365 1360 748 1352 -13245 -3132 -5912 -4421 -11167 15746 -10860 6351 -1873 -4857 -1304 1829 4140 3348 6704 4156 1879 -9665 2894 -3590 4136 1699 5347 -1154 4108 -381 6149 7998 -2864 1685 238 -2478 -3001 -1138 -3328 1130 -507 -690 -1813 -1330 385 1797 1160 -1740 1767 2211 1707 -253 2384 -601 3091 2029 1250 760 -446 -37 797 1081 271 1812 -862 1882 -2605 1463 -1080 930 252 850 1975 -296 -877 -1614 -2005 -1141 -1502 -723 -91 -2551 -1337 -1414 -1038 259 -526 262 -1797 214 -3013 -804 -335 -340 -870 976 -21 -688 -93 -413 -893 -1564 -1198 -3483 -1135 29137 -1379 -1333 -349 441 118 871 918 -236 1087 1181 -775 -26 -2064 -391 -195 -558 -903 1127 -229 -152 1136 -1950 1006 411 290 795 619 -1195 471 679 46 -283 -2 662 -1368 -673 -2163 -1480 196 101 162 -1729 -390 -847 -693 -1952 2086 -1887 1032 -376 -1136 -319 452 1029 867 1734 1118 510 -2976 830 -1154 1277 531 1513 -324 1067 -108 1768 2421 -987 520 72 -830 -1174 -521 -1799 637 -303 -422 -1124 -813 231 1041 655 -984 968 1262 1047 -166 1597 -426 2148 1446 894 532 -314 -27 602 878 235 1545 -699 1371 -1916 1095 -933 857 244 813 1802 -258 -694 -1158 -1366 -799 -1178 -629 -86 -2625 -1419 -1591 -1245 323 -678 337 -2266 247 -3269 -782 -313 -334 -940 1142 -27 -947 -126 -528 -1054 -1758 -1377 -4400 -1489 29958 -1959 -1973 -542 715 194 1378 1355 -325 1384 1491 -1034 -36 -3155 -602 -297 -828 -1295 1514 -297 -188 1372 -2575 1385 596 431 1192 958 -1983 809 1188 83 -514 -4 1128 -2282 -1090 SS 20211125T060837.5Z 7999.255990 241 1 20.25 2 49.77 94.93 74.72 307.62 0.00 1 0.00 1 0 17 1.098e-02 7.531e-03 3.250e-03 1.737e-03 1.959822e-01 8.773123e-04 2.100672e-03 -6.000000e+00 6.242323e-03 228.13 -2.00 3.06 -2.00 315.94 0.00e+00 -2.362238e-05 9.056709e-05 3.253423e-05 -6.000000e+00 2.736239e-04 280.31 -2.00 20.00 -2.00 315.30 0.00e+00 1.545 0.000 302.00 328.00 3 4.3998e+00 2.2752e-03 1.5373e-02 -6.0000e+00 1.5538e-02 4.9051e-02 2.5409e-03 8.8310e-03 -6.0000e+00 1.6883e-02 -6.0791e-03 1.4611e-03 4.3451e-03 -6.0000e+00 1.0039e-02 -1.7092e-03 6.6923e-04 1.2170e-03 -6.0000e+00 4.2529e-03 1.4742e-03 -3.0717e-04 4.8972e-05 1.4967e-05 -6.0000e+00 2.9350e-04 -1.8972e-03 12 9 1 12 1 1 99.98 18.83 0.34 -0.00190 -0.00421 21 12 1 8 0 912.410 15.00 18.83 16.95 21.17 21.17 18.2 876.65 -2896 -1812 -3694 -4491 -1306 996 2387 1108 1638 -1373 78 -66 318 476 -72 -1055 90 -345 412 965 -297 1429 1723 976 648 297 -915 157 1560 2626 1984 2601 1546 -2162 -12 76 -84 808 -111 -1670 -1470 -584 -1312 -986 -1149 -943 -852 -128 -973 599 760 814 1082 833 593 1218 504 271 595 676 1620 1111 1134 371 -1009 262 146 686 1643 212 -424 -260 -372 -103 -419 539 341 973 1468 7 -792 -1213 -2078 -1192 -1162 -1169 -601 -664 -370 -635 580 96 761 1749 1607 480 771 172 -851 -243 -310 -45 983 587 -918 -586 -180 -509 -15 -53 -293 -440 -151 97 524 1298 906 402 352 -630 -716 -199 -225 17 932 390 1126 1750 428 438 -112 124 -148 488 -472 -295 257 -179 -498 -110 -167 -476 -153 -671 -446 -925 -1056 -267 190 474 248 402 -356 19 -17 87 146 -25 -386 34 -131 160 383 -121 568 692 412 286 135 -416 66 614 996 781 1077 681 -995 -5 31 -38 408 -66 -1123 -1051 -428 -986 -741 -862 -704 -621 -91 -672 407 535 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