File name: Pandora206s1_BuffaloNY_20231124_L2Fit_fout2c1d20220512p1-8.txt File generation date: 20231125T062255.3Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Kang Sun Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 206 Spectrometer number: 1 Processing software version used: BlickP v1.8.49 Instrument operation file used: Pandora206_OF_v3d20211008.txt Instrument calibration file used: Pandora206s1_CF_v1d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20231124_L1_smca1c1d20220512p1-8.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: 20231124 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]: 305.0398 305.1808 305.3218 305.4628 305.6038 305.7447 305.8857 306.0266 306.1675 306.3084 306.4493 306.5902 306.7311 306.8720 307.0128 307.1537 307.2945 307.4353 307.5761 307.7169 307.8577 307.9985 308.1393 308.2800 308.4207 308.5615 308.7022 308.8429 308.9836 309.1243 309.2649 309.4056 309.5462 309.6869 309.8275 309.9681 310.1087 310.2493 310.3899 310.5305 310.6710 310.8116 310.9521 311.0926 311.2331 311.3736 311.5141 311.6546 311.7950 311.9355 312.0759 312.2164 312.3568 312.4972 312.6376 312.7779 312.9183 313.0587 313.1990 313.3394 313.4797 313.6200 313.7603 313.9006 314.0408 314.1811 314.3214 314.4616 314.6018 314.7421 314.8823 315.0225 315.1626 315.3028 315.4430 315.5831 315.7232 315.8634 316.0035 316.1436 316.2837 316.4238 316.5638 316.7039 316.8439 316.9839 317.1240 317.2640 317.4040 317.5439 317.6839 317.8239 317.9638 318.1038 318.2437 318.3836 318.5235 318.6634 318.8033 318.9431 319.0830 319.2228 319.3627 319.5025 319.6423 319.7821 319.9219 320.0616 320.2014 320.3412 320.4809 320.6206 320.7603 320.9000 321.0397 321.1794 321.3191 321.4587 321.5984 321.7380 321.8776 322.0172 322.1568 322.2964 322.4360 322.5755 322.7151 322.8546 322.9941 323.1336 323.2731 323.4126 323.5521 323.6916 323.8310 323.9705 324.1099 324.2493 324.3887 324.5281 324.6675 324.8069 324.9462 --------------------------------------------------------------------------------------- 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 20231124T154402.6Z 8728.655586 266 1 24.00 2 66.06 160.06 125.29 18.43 0.00 1 0.00 1 0 17 3.319e-01 3.059e-02 2.254e-01 2.569e-02 3.179926e-01 1.271863e-02 4.178659e-03 -6.000000e+00 1.847688e-01 222.60 -2.00 3.55 -2.00 318.78 0.00e+00 3.526669e-03 2.804210e-03 1.660146e-03 -6.000000e+00 8.636833e-03 276.73 -2.00 20.00 -2.00 318.18 0.00e+00 2.446 0.000 302.00 328.00 3 7.5548e+00 3.4642e-02 3.0138e-02 -6.0000e+00 4.5599e-01 7.0806e-02 3.9966e-02 2.1223e-02 -6.0000e+00 4.9906e-01 5.6637e-02 2.9416e-02 8.2761e-03 -6.0000e+00 2.9438e-01 -2.2037e-02 1.5712e-02 4.2924e-03 -6.0000e+00 1.2664e-01 1.6071e-05 -3.8759e-04 7.3913e-04 3.4287e-05 -6.0000e+00 8.7134e-03 6.7806e-03 -2.3885e-04 12 8 8 10 0 0 -66.67 17.88 2.53 0.00678 0.00387 6 6 2 8 0 4000.000 15.00 17.88 6.71 21.38 21.27 18.5 905.55 -6245 900000 91656 900000 77724 900000 -59645 900000 -50840 900000 169663 261048 47118 33931 70078 -14670 89135 13653 33404 -9652 42795 1085 45896 13367 3821 7929 3666 4467 -10178 35558 -9566 12672 5199 20857 9720 1854 3591 13009 6007 -7301 10832 -201 1814 -4673 16070 -7815 -9029 -23647 13163 -4912 4581 -2219 38 2608 4920 776 -7318 3496 -6645 -1945 -3041 11324 -8205 5434 -4650 3520 -2602 739 2257 -4806 1704 -4577 4110 2288 5886 -2013 1595 -1531 -4377 -1282 -544 3372 1564 -1977 1330 4906 325 -1275 1910 4913 -310 2010 -3543 -146 -1534 -2567 2638 1135 1074 612 3559 -2036 232 -3102 3328 -4374 726 818 732 -18 2248 647 -2734 -914 -577 1949 -4962 -224 -1535 -4062 -942 -1910 1697 2986 249 -1012 -70 2225 3959 -3755 2516 -678 1568 -747 412 -715 709 2470 1075 846 -714 -2227 -742 -272 900000 2294 900000 1945 900000 -4430 900000 -4269 900000 4246 6534 1966 1925 3274 -1765 4164 1389 2940 -1364 3663 138 3944 1630 534 1108 542 620 -1537 3560 -1606 1872 919 3317 1593 319 670 2552 1523 -2499 3393 -74 678 -1898 5320 -3325 -3856 -11532 4411 -1991 1809 -1014 18 1278 2435 406 -4236 1804 -3702 -1027 -1682 5888 -5704 3576 -3405 2186 -1612 433 1387 -3636 1325 -3943 3229 1751 4020 -1372 951 -901 -2815 -917 -422 2799 1413 -1925 1344 5130 373 -1534 2236 5351 -327 1955 -3346 -130 -1480 -2705 2952 1445 1456 813 4290 -2372 254 -3613 3979 -5732 944 1119 1056 -28 3657 1086 -4574 -1400 -807 2572 -7021 -316 -2274 -6562 -1492 -2987 2579 4274 347 -1362 -88 2773 5265 -5799 3862 -1109 2551 -1290 725 -1335 1331 4661 2065 1569 -1331 -4046 -1292 SS 20231124T161309.8Z 8728.675808 285 1 27.96 2 64.57 167.38 123.23 26.34 0.00 1 0.00 1 0 17 3.287e-02 8.124e-03 2.748e-02 5.138e-03 3.107474e-01 2.491036e-03 3.726937e-03 -6.000000e+00 1.804205e-02 222.60 -2.00 3.55 -2.00 318.27 0.00e+00 8.905516e-04 4.667142e-04 9.566729e-05 -6.000000e+00 7.930634e-04 276.72 -2.00 20.00 -2.00 317.64 0.00e+00 2.314 0.000 302.00 328.00 3 5.7207e+00 6.6484e-03 2.7467e-02 -6.0000e+00 4.4418e-02 3.9797e-02 7.5861e-03 1.5788e-02 -6.0000e+00 4.8527e-02 5.5201e-03 5.0613e-03 7.9112e-03 -6.0000e+00 2.8914e-02 -8.3414e-03 2.6556e-03 2.4576e-03 -6.0000e+00 1.2372e-02 1.2209e-04 3.1116e-04 1.4271e-04 2.4342e-05 -6.0000e+00 8.3668e-04 1.3907e-02 -2.0251e-05 11 8 0 10 0 0 99.93 17.88 0.45 0.01391 0.01625 11 11 1 8 0 2541.730 15.01 17.88 8.15 21.38 21.27 18.9 916.91 -2030 14367 7175 -6893 -10524 2664 1668 691 -184 3959 6022 -26971 5449 -3486 -1601 1097 2487 3029 1369 3860 2085 1853 274 99 -2317 -907 -2096 -851 -2013 648 1473 1857 2714 510 -3171 -3272 88 -1678 -3014 -1453 1548 -2906 728 -696 -532 -469 -197 -3260 14 377 -171 719 764 1706 859 774 791 2258 625 301 55 1390 1468 1525 -146 -2721 18 -1237 1248 -262 1693 387 1269 1791 1584 -766 -4017 -377 -1462 -866 -1818 -211 -1666 -882 -1074 185 260 31 559 778 996 382 -516 -18 1209 -591 469 495 659 -235 300 -661 -591 -1415 -407 -1550 -935 -333 -47 696 162 -24 -456 492 -822 -230 -672 67 -22 346 -120 320 792 79 1275 737 -238 753 963 -47 -234 -209 -258 374 25 219 -85 445 18 -77 -319 -477 -599 -118 789 441 -459 -659 141 95 45 -13 297 435 -2693 473 -372 -195 147 344 438 211 603 338 296 46 18 -447 -180 -426 -166 -368 116 285 389 623 125 -743 -747 21 -466 -1027 -577 654 -1292 324 -317 -250 -222 -91 -1533 6 171 -83 362 407 958 503 462 483 1349 370 177 34 904 1046 1133 -110 -2005 12 -827 869 -205 1426 344 1110 1492 1267 -559 -2750 -247 -992 -669 -1543 -196 -1622 -888 -1165 213 303 38 672 924 1083 396 -496 -17 1198 -642 565 645 881 -318 379 -795 -663 -1663 -519 -2028 -1273 -475 -69 1078 261 -40 -720 739 -1184 -309 -912 94 -32 538 -189 494 1187 118 1774 1018 -315 1002 1344 -72 -364 -335 -422 633 44 402 -155 829 33 -144 -574 -825 -1044 SS 20231124T173850.7Z 8728.735309 332 1 24.01 2 64.17 189.62 113.92 46.78 0.00 1 0.00 1 0 17 2.217e-01 2.320e-02 1.900e-01 1.796e-02 3.066680e-01 8.746055e-03 3.691559e-03 -6.000000e+00 1.217962e-01 222.60 -2.00 3.55 -2.00 318.49 0.00e+00 3.854961e-03 1.764326e-03 8.625387e-04 -6.000000e+00 5.348170e-03 276.72 -2.00 20.00 -2.00 317.89 0.00e+00 2.281 0.000 302.00 328.00 3 7.2925e+00 2.3552e-02 2.7567e-02 -6.0000e+00 2.9986e-01 9.1896e-02 2.6915e-02 1.7990e-02 -6.0000e+00 3.2751e-01 5.1346e-02 1.8783e-02 7.8227e-03 -6.0000e+00 1.9514e-01 -2.9820e-02 1.0022e-02 4.5229e-03 -6.0000e+00 8.3585e-02 2.4789e-05 8.7152e-04 5.0255e-04 3.6352e-05 -6.0000e+00 5.6416e-03 5.2735e-03 -9.7048e-05 12 8 8 10 0 0 -125.34 17.90 1.53 0.00527 0.01182 6 6 2 8 0 4000.000 15.00 17.90 8.82 21.38 21.27 18.5 917.32 -37606 37253 99141 50796 37459 112847 52692 51671 40626 27424 150270 6744 40992 4451 2320 13015 23473 -1907 11558 -8576 5191 223 35947 14772 -6916 7484 -4025 11028 -6923 21445 1785 15910 6628 624 -9773 -14450 -15043 -2860 10755 -5125 14114 -5102 5731 -4601 -1820 -6088 -4656 -15339 1951 3668 4975 3339 -1790 3358 -2135 2114 -3010 -1527 -4745 2083 -3915 6198 2168 1265 -769 -3972 -413 -2303 6405 -2219 2188 -255 3734 922 3257 -3556 -3567 521 -4588 -3675 -1218 1971 -4467 2091 -644 2454 686 1940 1468 1752 1882 -2039 489 -2374 976 -2770 2832 294 2509 1477 4114 -1108 -1527 -286 1093 -2407 -911 294 430 862 -1028 735 -3983 2013 -2488 2282 -2167 -1243 -2200 -269 591 -1191 1865 560 1322 -540 -949 -37 2089 -2973 2303 -1302 -304 -1500 -524 1619 971 850 212 1194 -712 281 -1176 -2675 1452 2257 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