File name: Pandora206s1_BuffaloNY_20240309_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T074612.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: Kang Sun Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 206 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora206_OF_v3d20211008.txt Instrument calibration file used: Pandora206s1_CF_v4d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20240309_L1_smca1c4d20220512p1-8.txt Full location name: University at Buffalo Short location name: BuffaloNY Country of location: Canada Location latitude [deg]: 43.0015 Location longitude [deg]: -78.7869 Location altitude [m]: 190 Local noon date: 20240309 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are latency correction, matrix method stray light correction (replaced by simple method) Data caveats: None First and last pixel inside fitting window: 223 365 Nominal wavelengths inside fitting window [nm]: 305.0744 305.2154 305.3564 305.4973 305.6383 305.7792 305.9201 306.0611 306.2020 306.3428 306.4837 306.6246 306.7654 306.9063 307.0471 307.1879 307.3287 307.4695 307.6103 307.7511 307.8918 308.0326 308.1733 308.3140 308.4548 308.5955 308.7362 308.8768 309.0175 309.1582 309.2988 309.4394 309.5801 309.7207 309.8613 310.0019 310.1424 310.2830 310.4236 310.5641 310.7046 310.8451 310.9857 311.1261 311.2666 311.4071 311.5476 311.6880 311.8285 311.9689 312.1093 312.2497 312.3901 312.5305 312.6708 312.8112 312.9515 313.0919 313.2322 313.3725 313.5128 313.6531 313.7934 313.9336 314.0739 314.2141 314.3543 314.4946 314.6348 314.7750 314.9151 315.0553 315.1955 315.3356 315.4758 315.6159 315.7560 315.8961 316.0362 316.1763 316.3163 316.4564 316.5964 316.7364 316.8765 317.0165 317.1565 317.2964 317.4364 317.5764 317.7163 317.8563 317.9962 318.1361 318.2760 318.4159 318.5558 318.6956 318.8355 318.9753 319.1152 319.2550 319.3948 319.5346 319.6744 319.8141 319.9539 320.0937 320.2334 320.3731 320.5128 320.6525 320.7922 320.9319 321.0716 321.2112 321.3509 321.4905 321.6301 321.7697 321.9093 322.0489 322.1885 322.3280 322.4676 322.6071 322.7467 322.8862 323.0257 323.1652 323.3046 323.4441 323.5836 323.7230 323.8624 324.0018 324.1413 324.2806 324.4200 324.5594 324.6988 324.8381 324.9774 --------------------------------------------------------------------------------------- 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: L1 based wavelength change coefficient, order 1, -9=no L1 wavelength change determination Column 77: 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 78: 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 79: 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 80: 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 81: 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 82: 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 83: Atmospheric variability [%], 999=no atmospheric variability was determined Column 84: Wavelength effective temperature [°C], 999=no effective temperature given Column 85: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 86: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 87: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 88: Number of bright count cycles Column 89: Number of dark count cycles Column 90: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 91: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 92: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 93: Integration time [ms] Column 94: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Temperature at electronics board 1 [°C], 999=no temperature signal Column 98: Temperature at electronics board 2 [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: 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 20240309T150646.8Z 8834.629708 143 1 25.55 2 56.60 137.16 59.99 149.91 0.00 1 0.00 1 0 17 4.478e-01 3.777e-02 3.277e-01 3.781e-02 3.432553e-01 1.872555e-02 4.296262e-03 -6.000000e+00 2.485827e-01 225.64 -2.00 3.55 -2.00 318.94 0.00e+00 5.498280e-03 4.174596e-03 1.555764e-03 -6.000000e+00 1.177987e-02 274.09 -2.00 20.00 -2.00 318.38 0.00e+00 1.811 0.000 302.00 328.00 3 8.3820e+00 5.1230e-02 2.6879e-02 -6.0000e+00 6.1795e-01 7.9118e-02 5.8789e-02 2.3067e-02 -6.0000e+00 6.7460e-01 5.7216e-02 4.2941e-02 8.9210e-03 -6.0000e+00 3.9925e-01 -4.3649e-02 2.2814e-02 5.9232e-03 -6.0000e+00 1.6990e-01 1.2001e-05 -1.2778e-03 1.0722e-03 4.2666e-05 -6.0000e+00 1.1557e-02 -1.3828e-02 -2.8219e-05 12 8 8 10 0 0 -187.67 17.80 2.43 -0.01383 -0.02343 17 17 1 8 0 1502.870 15.00 17.80 15.38 21.38 21.17 20.7 1014.85 122732 233783 129967 -68793 -535 -15426 263457 52953 112416 900000 900000 28070 84867 237762 14345 -73805 16154 66034 -1939 20423 60216 30499 6870 10686 24419 24625 -14723 51498 -9472 47210 31166 18334 22994 27650 10508 -5585 -15749 22475 14956 7419 -12842 -2105 664 5388 -1106 -3347 -14829 -15142 5146 -3706 -1383 5675 -11091 2985 8530 1455 -13481 912 1085 4040 1708 6756 -851 3222 -3721 869 1603 -6448 1053 -3863 12132 -2367 10709 1004 -1084 -598 -8490 4221 -8550 -4593 -4640 6546 -3528 421 -1715 4622 5707 -387 373 3995 7504 -1868 1919 -4799 967 -1105 2656 -926 2164 -1188 1000 -146 1517 -1498 -2071 -3810 -2128 2288 954 -308 -569 1927 -4558 -79 -2336 3851 -3614 -1248 -2904 1581 212 -2209 3199 -1143 2767 -1331 -1219 408 3565 -1583 2108 4340 -1572 -246 1400 -637 1161 -690 705 681 903 -987 -2790 4524 8617 4791 -5325 -20 -630 9711 1952 4144 900000 900000 1035 3128 8764 1021 -13690 1396 3825 -227 1999 4201 2714 786 1236 2545 2660 -2395 4271 -1324 3978 3446 2470 3303 4006 1669 -1008 -3463 3885 3346 2042 -4749 -732 235 1860 -410 -1291 -6395 -6493 1858 -1430 -559 2315 -5669 1408 3930 727 -7967 463 536 1993 894 3658 -530 2098 -2624 541 962 -4106 661 -2824 8574 -1942 7922 781 -795 -389 -5428 2280 -5586 -3316 -3793 5325 -3395 405 -1803 4882 6253 -449 446 4412 7344 -1835 1668 -4343 887 -1159 3008 -1220 2949 -1635 1257 -170 1597 -1670 -2538 -4979 -2857 3094 1380 -486 -961 3230 -7867 -121 -3376 4905 -4961 -1746 -4426 2446 336 -3498 4677 -1724 3796 -1819 -1576 525 4843 -2443 3327 6931 -2715 -435 2600 -1224 2233 -1384 1399 1349 1709 -1826 -5104 SS 20240309T160748.6Z 8834.672090 178 1 25.23 2 50.29 154.46 55.66 166.39 0.00 1 0.00 1 0 17 2.251e-02 7.567e-03 2.127e-02 5.551e-03 2.862366e-01 2.720169e-03 3.488276e-03 -6.000000e+00 1.248696e-02 225.64 -2.00 3.55 -2.00 317.65 0.00e+00 1.265501e-03 4.196740e-04 1.641271e-04 -6.000000e+00 5.373883e-04 274.10 -2.00 20.00 -2.00 317.07 0.00e+00 1.562 0.000 302.00 328.00 3 6.8522e+00 7.1912e-03 2.1351e-02 -6.0000e+00 3.0977e-02 4.3930e-02 8.1199e-03 1.4838e-02 -6.0000e+00 3.3796e-02 -5.0338e-03 5.0775e-03 7.3321e-03 -6.0000e+00 2.0061e-02 -3.4915e-03 2.5811e-03 2.3180e-03 -6.0000e+00 8.5011e-03 8.1905e-05 -5.8027e-04 1.5276e-04 2.3383e-05 -6.0000e+00 5.7375e-04 -8.9997e-03 3.6937e-05 11 8 0 10 0 0 99.86 17.80 0.28 -0.00900 -0.01336 7 7 1 8 0 3603.960 15.00 17.80 15.85 21.38 21.17 20.9 1018.45 2179 4350 -5636 7112 -4939 12633 -7519 -2440 -6736 2255 4410 -825 -3676 163 2787 1007 3918 2845 969 -331 4869 -3438 2836 1641 2822 -1299 -467 -175 -4298 897 3129 2926 1506 903 -3252 -2339 -3349 -1547 -561 -386 -1997 -926 -62 19 1841 -1858 -845 -2937 677 -1407 1282 -3785 -247 -264 1569 229 193 539 198 363 719 2104 983 2182 157 -131 1183 -1095 120 174 1121 570 499 769 563 -200 378 -1202 -2496 -2062 -134 -907 -2168 -1338 39 243 387 90 500 569 315 -45 773 142 276 -387 971 1088 477 549 280 -1410 -390 -455 423 -868 -872 -323 194 14 -760 460 -793 -181 374 -91 -537 71 -315 552 -594 -65 -54 148 504 293 284 537 938 225 467 -227 -429 -182 404 125 184 254 203 5 -221 -668 -345 187 403 -596 620 -422 868 -672 -231 -743 241 450 -91 -478 24 456 187 737 565 204 -73 1043 -784 621 386 685 -342 -123 -43 -1013 200 739 748 429 269 -923 -640 -1022 -536 -225 -182 -1014 -483 -33 10 971 -1020 -451 -1611 352 -750 710 -2300 -153 -173 1039 156 134 370 133 241 492 1532 768 1811 132 -101 865 -799 92 149 1009 536 467 687 480 -158 268 -849 -1831 -1717 -119 -878 -2264 -1403 43 281 470 112 626 681 355 -48 768 138 278 -424 1171 1425 648 724 354 -1711 -450 -532 536 -1138 -1195 -451 282 21 -1207 728 -1250 -270 521 -119 -710 97 -456 843 -907 -99 -81 215 691 394 361 690 1266 327 695 -350 -674 -288 679 216 323 457 367 9 -382 -1114 -560 SS 20240309T161254.2Z 8834.675627 180 1 27.11 2 49.90 156.03 55.43 167.84 0.00 1 0.00 1 0 17 4.273e-02 1.042e-02 3.100e-02 7.403e-03 2.846760e-01 3.632361e-03 3.419029e-03 -6.000000e+00 2.373217e-02 225.64 -2.00 3.55 -2.00 317.82 0.00e+00 -4.627579e-04 5.836983e-04 7.998467e-05 -6.000000e+00 1.019899e-03 274.10 -2.00 20.00 -2.00 317.22 0.00e+00 1.549 0.000 302.00 328.00 3 7.3233e+00 9.6372e-03 2.1119e-02 -6.0000e+00 5.8876e-02 2.2733e-02 1.0907e-02 1.4527e-02 -6.0000e+00 6.4207e-02 7.5692e-03 6.9191e-03 7.2585e-03 -6.0000e+00 3.8113e-02 -5.1130e-03 3.5357e-03 2.0991e-03 -6.0000e+00 1.6168e-02 5.2423e-05 1.6127e-04 2.0607e-04 2.1277e-05 -6.0000e+00 1.0882e-03 -1.2200e-02 2.6526e-04 12 8 8 10 0 0 99.94 17.80 0.83 -0.01220 -0.01099 7 7 1 8 0 3872.260 15.00 17.80 16.08 21.38 21.17 20.9 1020.11 -8135 7693 51 10243 -592 2520 3576 19285 -5443 15460 -30578 3754 -2612 -454 -3911 -2924 3914 -2566 -2739 -17 11898 -510 10149 1716 6652 -1943 4912 1932 -5380 1705 -1373 -1276 -3893 1082 -3321 -1675 -3735 1836 3623 1096 -2776 247 -281 -2342 2379 -2899 -2870 -4312 536 -1192 2903 3074 313 1369 2635 343 949 356 -717 -1383 1380 2676 -34 2039 -664 78 -1710 -1056 -654 -463 1761 1059 4 1692 867 -2002 -584 -2010 -2443 -2185 -405 209 -1440 -2012 -1165 543 209 97 592 819 624 1067 -484 -959 442 812 1439 687 95 330 374 -991 -360 -990 108 -1731 -82 -849 -44 196 625 44 166 446 -392 164 -709 -127 -605 164 -95 407 304 -885 1525 191 -201 675 1096 -53 315 -350 -417 -1201 260 -130 391 -18 513 -177 636 -369 -670 -686 611 5 799 -45 176 265 1374 -561 1384 -4123 377 -317 -62 -614 -507 661 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