File name: Pandora132s1_Berlin_20210814_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T154437.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c13p1-8 Local principal investigator: Thomas Ruhtz Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 132 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora132_OF_v1d20200910.txt Instrument calibration file used: Pandora132s1_CF_v13d20210422.txt Level 1 file used: Pandora132s1_Berlin_20210814_L1_smca1c13d20210422p1-8.txt Full location name: Institute of Space Sciences FU Berlin Short location name: Berlin Country of location: Germany Location latitude [deg]: 52.4600 Location longitude [deg]: 13.3100 Location altitude [m]: 100 Local noon date: 20210814 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: Modification of session 11, but different RefDay (April 2021). First and last pixel inside fitting window: 243 385 Nominal wavelengths inside fitting window [nm]: 305.1071 305.2480 305.3889 305.5298 305.6707 305.8116 305.9524 306.0932 306.2341 306.3749 306.5157 306.6565 306.7973 306.9380 307.0788 307.2195 307.3603 307.5010 307.6417 307.7824 307.9231 308.0638 308.2044 308.3451 308.4857 308.6264 308.7670 308.9076 309.0482 309.1888 309.3293 309.4699 309.6104 309.7510 309.8915 310.0320 310.1725 310.3130 310.4534 310.5939 310.7344 310.8748 311.0152 311.1556 311.2960 311.4364 311.5768 311.7172 311.8575 311.9979 312.1382 312.2785 312.4188 312.5591 312.6994 312.8397 312.9800 313.1202 313.2604 313.4007 313.5409 313.6811 313.8213 313.9615 314.1016 314.2418 314.3819 314.5221 314.6622 314.8023 314.9424 315.0825 315.2225 315.3626 315.5026 315.6427 315.7827 315.9227 316.0627 316.2027 316.3427 316.4827 316.6226 316.7626 316.9025 317.0424 317.1823 317.3222 317.4621 317.6020 317.7418 317.8817 318.0215 318.1613 318.3012 318.4410 318.5807 318.7205 318.8603 319.0000 319.1398 319.2795 319.4192 319.5589 319.6986 319.8383 319.9780 320.1177 320.2573 320.3969 320.5366 320.6762 320.8158 320.9554 321.0949 321.2345 321.3741 321.5136 321.6531 321.7927 321.9322 322.0717 322.2111 322.3506 322.4901 322.6295 322.7689 322.9084 323.0478 323.1872 323.3266 323.4659 323.6053 323.7447 323.8840 324.0233 324.1627 324.3020 324.4413 324.5805 324.7198 324.8591 324.9983 --------------------------------------------------------------------------------------- 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 20210814T044559.4Z 7896.198604 88 1 49.24 2 82.52 76.25 136.03 22.82 0.00 1 0.00 1 0 17 4.798e-01 2.177e-02 4.317e-01 1.694e-02 8.019398e-01 9.982281e-03 1.052831e-02 -6.000000e+00 2.841100e-01 232.56 -2.00 3.85 -2.00 322.02 0.00e+00 6.139834e-03 5.542655e-03 8.833404e-03 -6.000000e+00 1.236756e-02 282.77 -2.00 20.00 -2.00 321.54 0.00e+00 7.114 0.008 302.00 328.00 3 1.3920e+00 3.8462e-02 9.6926e-02 -6.0000e+00 7.1552e-01 6.6497e-01 5.2288e-02 7.6426e-02 -6.0000e+00 7.7404e-01 -9.1027e-01 4.7395e-02 3.6223e-02 -6.0000e+00 4.5765e-01 3.7878e-01 2.1849e-02 8.7923e-03 -6.0000e+00 1.9458e-01 5.3134e-05 -1.6366e-03 4.9400e-04 2.0737e-04 -6.0000e+00 1.3220e-02 3.1960e-02 0.0000e+00 12 8 8 10 0 0 89.56 18.23 0.46 0.03196 0.01966 61 13 4 8 0 807.040 15.00 18.23 25.50 22.19 22.61 23.7 984.55 -127663 900000 -68344 -115786 -117326 -171830 -213823 -193391 -92958 -63135 -118414 70451 4624 -104169 -107644 -6449 13133 9465 3229 -13120 -59714 -67220 218 106284 -16077 -29704 -81954 -43247 -5384 -51633 99037 -34411 900000 33249 26984 -26919 16243 -23979 57040 69811 2896 41683 30298 90799 3559 30102 5825 75126 60816 49907 52651 20562 30669 31637 42877 38233 16165 9998 11547 21708 17299 21435 11541 30301 13822 14085 9167 1787 10728 3782 8264 13913 5904 784 -4568 8885 10063 -6980 6295 2120 4619 771 4396 4695 2291 -1579 1895 -3862 -3308 -4081 4180 -5697 -6597 -4879 -4303 -4133 -1007 -1571 -2870 -2265 -2508 -3782 869 -2573 -6260 -229 -1067 -3318 -387 -1380 746 1791 625 -1511 748 -951 1084 1668 110 1752 903 1605 2445 1839 206 630 1175 940 -173 1199 202 183 -317 -225 -391 565 -28 -106 -766 490 -889 -640 900000 -2299 900000 -1128 -1912 -1937 -3869 -7703 -6096 -1535 -1042 -1955 1163 76 -2971 -3878 -106 217 156 53 -256 -1793 -2119 4 1755 -372 -785 -3518 -1214 -107 -1876 1635 -1534 900000 823 668 -1156 510 -1346 1695 2075 182 1858 1551 2549 241 1590 404 2729 2711 2719 3130 1867 2734 2977 3752 3598 1895 1205 1316 2222 1971 2654 1810 4353 2396 2395 1665 378 2374 1012 2251 3607 1579 202 -1109 1716 1894 -1706 1601 675 1678 299 1775 2008 1069 -810 979 -2133 -1777 -2095 2036 -2659 -3149 -2534 -2603 -2953 -815 -1447 -2830 -2155 -2176 -2969 621 -1989 -5384 -196 -987 -3447 -444 -1821 1063 2638 928 -2211 1028 -1318 1527 2474 173 2748 1380 2323 3395 2493 274 808 1519 1356 -292 2264 421 405 -755 -575 -1068 1578 -79 -303 -2155 1282 -2183 -1478 900000 SS 20210814T045407.7Z 7896.204255 92 1 49.34 2 81.32 77.82 135.57 25.49 0.00 1 0.00 1 0 17 5.178e-01 1.975e-02 3.332e-01 9.848e-03 7.208244e-01 5.717269e-03 9.179273e-03 -6.000000e+00 3.091526e-01 232.56 -2.00 3.85 -2.00 321.76 0.00e+00 1.012366e-02 2.993944e-03 3.042940e-03 -6.000000e+00 1.408289e-02 282.77 -2.00 20.00 -2.00 321.25 0.00e+00 6.248 0.005 302.00 328.00 3 1.6231e+00 2.1001e-02 7.6107e-02 -6.0000e+00 7.7624e-01 4.4830e-01 2.7933e-02 4.4743e-02 -6.0000e+00 8.3909e-01 -6.3024e-01 2.6128e-02 2.5688e-02 -6.0000e+00 4.9447e-01 2.6830e-01 1.2303e-02 1.1967e-02 -6.0000e+00 2.0925e-01 1.0407e-04 -8.9418e-04 2.9397e-04 1.9150e-04 -6.0000e+00 1.4547e-02 3.1753e-02 0.0000e+00 12 8 8 10 0 0 53.01 18.23 0.46 0.03175 0.02503 78 17 4 8 0 632.390 15.01 18.23 26.08 22.19 22.61 23.6 987.04 -35314 -184008 7331 -202907 900000 -202273 900000 -100880 -60404 -47697 -116988 900000 -144088 79681 -75018 68372 -27157 54587 -64828 -12949 228822 -80211 188069 -79043 900000 -48287 71900 -17304 -34728 31682 -43390 87943 -9535 54372 -48732 93554 12843 18290 24238 4787 65297 -3626 49536 10885 59834 11915 59694 22337 18125 40952 2368 48021 9289 35833 4692 31025 12082 11382 5165 -958 10340 3050 21937 9944 20071 3339 6820 11045 4897 10563 2841 7676 -1282 7966 328 476 2333 -5100 4377 -5324 1671 -7012 1233 -2134 -125 -2667 -123 1269 -1398 2849 -2836 1381 -3280 -3956 -3280 -2232 -675 -1012 -261 -2300 1750 -3007 -483 -2390 -2677 -618 -2374 182 -1530 732 -677 239 -776 -679 228 117 213 -763 2060 -103 2440 537 1180 1032 1231 223 469 1598 323 1127 -480 970 127 114 -123 -834 596 -208 584 -869 -79 -1405 900000 -339 -5457 70 -6549 900000 -5646 900000 -1144 -580 -458 -1735 900000 -4525 765 -1898 656 -599 576 -2149 -286 2196 -3310 1805 -3413 900000 -1575 690 -398 -1000 547 -1957 1266 -403 1200 -2852 1347 468 755 1116 303 2444 -285 2377 783 2698 892 2864 1629 1461 2869 273 3871 1194 3748 693 3602 1693 1562 733 -146 1518 547 3726 2090 3871 743 1479 2469 1330 2773 857 2223 -388 2224 89 117 555 -1424 1315 -1913 650 -3334 581 -1104 -68 -1568 -73 756 -838 1551 -1527 676 -1688 -2250 -2154 -1706 -590 -999 -269 -2334 1550 -2508 -377 -2000 -2408 -576 -2402 196 -1890 995 -1019 368 -1191 -997 317 161 305 -1168 3227 -166 3733 800 1692 1434 1647 290 616 2295 539 2091 -980 2064 290 279 -320 -2256 1617 -572 1554 -2219 -185 -3182 900000 SS 20210814T050939.1Z 7896.215036 97 1 49.89 2 79.00 80.83 134.57 30.47 0.00 1 0.00 1 0 17 3.781e-01 9.959e-03 2.133e-01 3.710e-03 6.100524e-01 2.062406e-03 7.680485e-03 -6.000000e+00 2.225554e-01 232.56 -2.00 3.85 -2.00 321.25 0.00e+00 4.296981e-03 9.655068e-04 1.979441e-03 -6.000000e+00 9.617332e-03 282.77 -2.00 20.00 -2.00 320.69 0.00e+00 5.048 0.003 302.00 328.00 3 1.4348e+00 6.9951e-03 6.2213e-02 -6.0000e+00 5.5942e-01 8.5664e-02 9.4185e-03 3.7849e-02 -6.0000e+00 6.0393e-01 -9.2827e-02 9.2365e-03 2.1050e-02 -6.0000e+00 3.5812e-01 3.2202e-02 4.4176e-03 7.7807e-03 -6.0000e+00 1.5237e-01 4.5452e-04 -2.5421e-04 1.1135e-04 1.0309e-04 -6.0000e+00 1.0401e-02 3.2260e-02 0.0000e+00 12 8 8 10 0 0 89.02 18.25 0.31 0.03226 0.03035 194 41 4 8 0 254.490 15.01 18.25 27.22 22.29 22.71 23.7 992.38 -173450 1336 -125154 -104141 -31230 -164220 103932 -173599 28506 -129797 968 -118320 -71821 -49469 -69434 21527 -83254 31716 -66828 12989 -31143 4608 -16519 -29723 5221 -44061 28476 -44749 2550 -31067 -9011 3534 4664 15454 -15963 13811 -14296 17576 -2304 7151 -2546 929 7613 -4738 11826 -2381 14142 -3802 11276 3531 6879 3825 2374 8874 -967 9719 -963 4280 2290 5396 1994 3188 6445 3423 6794 -2203 2435 -1525 3911 2367 1400 2651 -1293 2396 -3654 959 -2749 566 -1445 -689 -780 -2234 -822 -2625 -887 -1082 1011 -295 813 1034 286 1023 -2144 828 -2015 472 67 134 -170 -523 -799 -1345 388 -1357 -887 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