File name: Pandora85s1_NewOrleansLA-XULA_20240620_L2Fit_fout2c2d20230315p1-8.txt File generation date: 20250813T140501.1Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Morewell Gasseller Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 85 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora85_OF_v3d20231120.txt Instrument calibration file used: Pandora85s1_CF_v2d20240315.txt Level 1 file used: Pandora85s1_NewOrleansLA-XULA_20240620_L1_smca1c2d20230315p1-8.txt Full location name: Xavier University of Louisiana Short location name: NewOrleansLA-XULA Country of location: United States Location latitude [deg]: 29.9643 Location longitude [deg]: -90.1074 Location altitude [m]: 10 Local noon date: 20240620 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: OOB session based on clearance session 1 First and last pixel inside fitting window: 196 339 Nominal wavelengths inside fitting window [nm]: 305.0087 305.1493 305.2899 305.4305 305.5710 305.7116 305.8522 305.9927 306.1332 306.2737 306.4143 306.5547 306.6952 306.8357 306.9762 307.1166 307.2571 307.3975 307.5379 307.6783 307.8187 307.9591 308.0994 308.2398 308.3801 308.5205 308.6608 308.8011 308.9414 309.0817 309.2220 309.3623 309.5025 309.6428 309.7830 309.9232 310.0634 310.2036 310.3438 310.4840 310.6242 310.7643 310.9045 311.0446 311.1847 311.3248 311.4649 311.6050 311.7451 311.8851 312.0252 312.1652 312.3053 312.4453 312.5853 312.7253 312.8653 313.0052 313.1452 313.2851 313.4251 313.5650 313.7049 313.8448 313.9847 314.1246 314.2644 314.4043 314.5442 314.6840 314.8238 314.9636 315.1034 315.2432 315.3830 315.5227 315.6625 315.8022 315.9420 316.0817 316.2214 316.3611 316.5008 316.6404 316.7801 316.9198 317.0594 317.1990 317.3386 317.4782 317.6178 317.7574 317.8970 318.0365 318.1761 318.3156 318.4551 318.5947 318.7342 318.8736 319.0131 319.1526 319.2920 319.4315 319.5709 319.7103 319.8497 319.9891 320.1285 320.2679 320.4073 320.5466 320.6859 320.8253 320.9646 321.1039 321.2432 321.3825 321.5217 321.6610 321.8002 321.9395 322.0787 322.2179 322.3571 322.4963 322.6355 322.7746 322.9138 323.0529 323.1921 323.3312 323.4703 323.6094 323.7485 323.8875 324.0266 324.1656 324.3047 324.4437 324.5827 324.7217 324.8607 324.9997 --------------------------------------------------------------------------------------- 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: Temperature at electronics board [°C], 999=no temperature signal 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: Humidity in head sensor [%], -9=no humidity signal Column 98: Pressure in head sensor [hPa], -9=no pressure signal Columns 99-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-386: 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 20240620T120011.6Z 8937.500134 187 1 23.93 2 78.94 69.20 120.71 255.10 0.00 1 0.00 1 0 17 2.991e-01 1.587e-02 9.221e-02 3.315e-03 5.878410e-01 1.785587e-03 7.273759e-03 -6.000000e+00 1.755184e-01 230.85 -2.00 3.24 -2.00 320.26 0.00e+00 8.728702e-04 6.732693e-04 5.020304e-03 -6.000000e+00 8.544164e-03 292.92 -2.00 20.00 -2.00 319.49 0.00e+00 5.025 0.001 302.00 328.00 3 1.9889e+00 5.5107e-03 6.2497e-02 -6.0000e+00 4.3775e-01 -1.5353e-02 6.9622e-03 4.3512e-02 -6.0000e+00 4.7234e-01 -3.9869e-02 6.2067e-03 1.5487e-02 -6.0000e+00 2.8174e-01 7.7560e-03 3.1689e-03 5.7183e-03 -6.0000e+00 1.2310e-01 2.7210e-04 1.5262e-04 9.2069e-05 6.1529e-05 -6.0000e+00 8.2056e-03 7.7074e-03 12 9 9 12 1 1 99.88 26.96 0.63 0.00771 0.00885 32 8 1 5 0 725.110 34.25 20.00 26.96 32.19 13.7 1017.63 900000 -76428 900000 -68753 -117155 900000 -86277 -176187 -64320 -130904 900000 -16011 -71017 -28022 -11596 900000 -47038 -67012 88657 560 32381 -24501 40528 -12382 -31303 32429 19179 37763 -23647 20947 -19212 8279 -17238 -21676 -10963 -20219 -13309 -21419 -1243 10653 13085 10537 20751 1693 9489 -7153 12591 8138 -6577 2985 -2726 6401 1565 3127 7132 5329 2194 499 729 -1761 -980 3606 3039 -441 2981 4484 -3621 -192 727 2596 3379 3706 2483 -1146 1459 -4143 -3291 -4535 -3964 -394 -2658 -1890 -2431 -3306 -1213 1164 282 869 2392 582 1363 -2062 -2211 -2476 -673 -2881 -1231 316 549 771 -566 -1648 -2257 -1546 -815 -1810 -531 -81 501 2660 2155 2987 2381 1321 105 -856 -1289 -587 39 62 519 1021 1001 373 128 -500 -2296 -454 -742 -61 41 -800 -674 -594 -673 -450 -283 618 880 908 666 -676 -376 900000 900000 -606 900000 -622 -1589 900000 -892 -5122 -706 -3129 900000 -140 -1308 -425 -187 900000 -1504 -2901 888 14 638 -863 772 -440 -1476 869 613 988 -1100 643 -1012 393 -1231 -1806 -814 -1594 -1053 -2152 -125 1170 1627 1467 2768 284 1493 -1233 2001 1383 -1221 530 -562 1353 383 824 1948 1556 689 162 232 -563 -315 1190 1134 -177 1250 1839 -1560 -81 322 1294 1897 2223 1416 -655 821 -2229 -1599 -2161 -1993 -222 -1664 -1352 -1817 -2669 -1023 1032 268 798 2201 536 1260 -1833 -1856 -2051 -586 -2732 -1324 361 700 958 -686 -1977 -2469 -1722 -897 -2163 -658 -100 663 3805 3252 4573 3748 2054 165 -1286 -1903 -887 62 99 848 1626 1544 593 196 -740 -3326 -639 -1136 -99 69 -1481 -1247 -1154 -1332 -949 -593 1311 1893 1921 1405 -1369 -760 900000 SS 20240620T120505.3Z 8937.503534 190 1 3.19 2 77.95 69.74 121.69 255.53 0.00 1 0.00 1 0 17 2.371e-01 1.604e-02 1.977e-01 8.630e-03 5.575927e-01 4.572740e-03 6.213950e-03 -6.000000e+00 1.380511e-01 230.85 -2.00 3.24 -2.00 319.87 0.00e+00 -1.506673e-03 1.499504e-03 2.080469e-03 -6.000000e+00 6.368366e-03 292.92 -2.00 20.00 -2.00 319.06 0.00e+00 4.643 0.001 302.00 328.00 3 2.0721e+00 1.3518e-02 5.4765e-02 -6.0000e+00 3.4438e-01 -6.8592e-03 1.6450e-02 3.1285e-02 -6.0000e+00 3.7143e-01 -3.3303e-02 1.3773e-02 1.3328e-02 -6.0000e+00 2.2216e-01 1.0415e-03 7.2025e-03 5.4627e-03 -6.0000e+00 9.6792e-02 3.6929e-04 -1.5412e-03 2.3898e-04 3.9587e-05 -6.0000e+00 6.4640e-03 2.2168e-02 12 9 9 12 1 1 -31.16 26.97 0.43 0.02217 0.01059 3 8 1 5 0 795.690 34.25 20.00 26.97 32.44 13.6 1017.60 900000 -74856 900000 -76431 -89831 -50139 75718 -123789 -92544 -80935 4990 -44589 3576 37698 -42048 17747 -11838 -33696 37322 25416 -2874 -36719 10677 -22736 -5368 2253 19405 44851 -2220 5430 -28625 -3513 9679 -11379 -18707 -23565 -6867 -21321 4896 63 11436 634 18520 7715 1474 -295 13216 12373 -3135 199 773 318 5077 -349 5333 4320 5626 -1617 -715 -2695 -5784 5393 4924 3196 2721 4148 -5364 150 -471 2868 1917 1666 1933 -1323 2039 -586 -5282 -4111 -4176 -1680 -3210 -1677 -2034 -3140 -513 1048 -1337 -111 3231 898 1358 982 -3935 -992 -1545 -725 -1443 389 -35 508 1074 -1274 -2188 -1438 -542 -367 38 -514 572 2509 1429 2212 2222 1347 -899 -1340 -1190 -47 -601 350 1030 1209 -262 1188 -551 -940 -1816 -255 -1046 418 -753 -301 -681 -307 -803 285 351 850 259 329 593 79 -1010 900000 900000 -1071 900000 -1222 -1512 -548 637 -3541 -2258 -1975 55 -863 51 476 -1450 403 -408 -1588 942 770 -121 -2193 413 -1358 -298 125 947 1660 -125 288 -2408 -269 749 -1206 -2109 -2696 -716 -3014 655 10 1854 125 3215 1540 316 -65 2588 2479 -755 48 205 95 1584 -115 1787 1536 2059 -647 -279 -1047 -2340 2087 2140 1466 1349 2000 -2739 73 -245 1646 1169 1091 1285 -880 1317 -351 -3015 -2235 -2395 -1084 -2286 -1259 -1710 -2853 -453 983 -1363 -110 3331 931 1321 889 -3520 -901 -1411 -744 -1611 461 -45 657 1326 -1567 -2468 -1646 -618 -448 49 -665 787 3528 2140 3532 3613 2152 -1389 -1958 -1783 -72 -930 569 1632 1967 -419 1818 -822 -1420 -2660 -364 -1623 682 -1305 -534 -1272 -573 -1543 579 711 1752 546 681 1215 155 -1988 900000 SS 20240620T120941.3Z 8937.506728 193 1 4.26 2 77.01 70.23 122.62 255.93 0.00 1 0.00 1 0 17 2.626e-01 1.657e-02 2.029e-01 7.870e-03 5.158068e-01 4.127315e-03 6.224878e-03 -6.000000e+00 1.529084e-01 230.85 -2.00 3.24 -2.00 319.66 0.00e+00 1.561248e-03 1.246544e-03 3.160316e-03 -6.000000e+00 6.956920e-03 292.92 -2.00 20.00 -2.00 318.83 0.00e+00 4.332 0.001 302.00 328.00 3 2.5046e+00 1.1968e-02 5.1960e-02 -6.0000e+00 3.8145e-01 -1.8712e-02 1.4342e-02 3.1983e-02 -6.0000e+00 4.1141e-01 -1.6858e-02 1.1604e-02 1.2942e-02 -6.0000e+00 2.4591e-01 8.4951e-04 6.1279e-03 4.0670e-03 -6.0000e+00 1.0667e-01 3.3279e-04 -1.9044e-03 2.1802e-04 4.2678e-05 -6.0000e+00 7.1587e-03 2.1878e-02 12 9 9 12 1 1 86.00 26.99 0.74 0.02188 0.00757 3 6 1 5 0 1063.920 34.25 20.01 26.99 32.68 13.7 1017.59 900000 14183 124690 -102616 -97401 42728 -7175 -106966 -63792 -40197 -20254 -48610 -69471 44138 51230 134358 -11113 -20864 -3519 2666 46846 -22787 357 17329 -9137 -2659 19031 10905 -24725 15744 -12079 9647 -10530 -13536 -11875 -10813 -21525 -27578 3111 8085 9005 1605 13589 3500 10782 -2335 11671 9697 -4731 1400 -2084 189 3234 380 1916 3167 3323 563 -2391 -2061 610 5299 3408 44 2877 4425 0 3131 -1059 1501 3364 4273 -1928 -65 286 -3165 -1896 -5167 -2203 -3082 -3002 -49 -1125 -3051 95 1172 -1841 -732 1876 1648 621 -416 -959 -1503 -1613 -2918 -265 696 918 732 -996 -2597 -2689 -1077 -1226 -2062 -875 260 977 1279 2513 2036 2902 1342 -779 262 -740 -473 300 -688 851 388 1196 647 171 -13 -1219 -580 -241 -77 -280 -1392 -565 -502 -483 -585 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