File name: Pandora206s1_BuffaloNY_20231114_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T065351.1Z 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_20231114_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: 20231114 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 20231114T163930.1Z 8718.694098 151 1 24.00 2 61.46 174.57 71.75 159.99 0.00 1 0.00 1 0 17 1.204e-01 2.529e-02 1.365e-01 2.043e-02 2.758911e-01 9.892767e-03 3.414819e-03 -6.000000e+00 6.610576e-02 222.79 -2.00 3.55 -2.00 318.26 0.00e+00 6.378349e-03 1.870077e-03 6.386874e-04 -6.000000e+00 2.918362e-03 277.86 -2.00 20.00 -2.00 317.63 0.00e+00 2.083 0.000 302.00 328.00 3 7.9335e+00 2.6466e-02 2.5356e-02 -6.0000e+00 1.6275e-01 7.4149e-02 3.0179e-02 1.7589e-02 -6.0000e+00 1.7777e-01 6.4784e-02 2.0387e-02 7.5052e-03 -6.0000e+00 1.0598e-01 -3.4139e-02 1.0790e-02 5.8889e-03 -6.0000e+00 4.5360e-02 1.6435e-05 -1.2032e-03 5.7128e-04 4.5066e-05 -6.0000e+00 3.0652e-03 -1.2717e-02 5.9171e-05 12 8 8 10 0 0 -61.15 17.98 2.43 -0.01272 -0.02176 6 6 2 8 0 4000.000 14.99 17.98 14.43 21.48 21.38 19.2 948.18 -16765 75440 63030 22185 15632 49151 22200 5950 -3493 17127 13570 30202 24224 18858 4997 -9039 30995 11193 7805 -7554 12991 -11773 -4561 543 5324 -2647 3869 -5556 -406 14290 10756 2004 4366 13583 -944 -9055 665 2107 6599 -7689 -1624 -7294 1695 -1552 4885 -718 -6041 -15965 -635 1499 324 -61 -4617 2732 6161 542 -1152 -2164 -803 -1278 -1752 1226 -1284 4738 -3115 1944 -394 -1039 2735 -2585 731 -1422 1789 23155 3167 -587 24 -49 -3724 -4742 -3287 2765 -1960 -677 469 4996 -985 -11 764 2069 269 -1524 -2815 -1504 -1616 -2146 1438 2123 1559 614 1823 -722 -1103 -1774 330 -2114 -1230 -27 -313 811 949 103 -1860 312 -3356 2164 -1534 -2446 -495 1622 -662 -1275 1744 -2519 2129 2059 -894 3723 2631 -2162 2204 -1751 -554 -773 943 -409 -553 1094 1628 1144 147 -1855 -1251 -1174 2442 2433 1229 808 1769 1050 359 -254 1066 853 1655 1659 1632 588 -1353 3396 1575 1159 -1363 2014 -2217 -804 97 931 -517 718 -1079 -71 2180 1868 415 976 2909 -215 -2153 157 563 2009 -3073 -688 -3303 755 -731 2174 -343 -3024 -8676 -292 676 157 -32 -2662 1546 3460 324 -711 -1338 -479 -765 -1095 807 -952 3572 -2550 1386 -267 -689 1840 -2098 629 -1301 1579 15828 2453 -422 16 -31 -2577 -3666 -2820 2473 -1960 -693 509 5557 -1185 -13 938 2483 301 -1587 -2708 -1419 -1575 -2340 1688 2767 2175 843 2313 -860 -1226 -2047 408 -2815 -1695 -38 -471 1252 1551 171 -3036 478 -4861 2774 -2038 -3426 -730 2502 -1062 -2018 2614 -3760 2955 2731 -1154 4618 3562 -3185 3278 -2787 -884 -1280 1634 -754 -1042 2078 3095 2111 263 -3266 -2131 SS 20231114T172216.4Z 8718.723801 174 1 26.85 2 61.51 186.13 69.86 169.70 0.00 1 0.00 1 0 17 1.062e-02 5.323e-03 9.269e-03 2.294e-03 2.742448e-01 1.114202e-03 3.361669e-03 -6.000000e+00 5.834941e-03 222.79 -2.00 3.55 -2.00 317.83 0.00e+00 4.531017e-04 1.837452e-04 7.304931e-05 -6.000000e+00 2.574990e-04 277.85 -2.00 20.00 -2.00 317.18 0.00e+00 2.086 0.000 302.00 328.00 3 4.7475e+00 2.9473e-03 2.4657e-02 -6.0000e+00 1.4366e-02 -1.9447e-03 3.3448e-03 1.4019e-02 -6.0000e+00 1.5690e-02 8.0202e-03 2.1094e-03 7.0050e-03 -6.0000e+00 9.3533e-03 -5.6982e-03 1.0828e-03 2.0439e-03 -6.0000e+00 4.0046e-03 4.3342e-04 -2.3830e-04 6.3802e-05 2.1574e-05 -6.0000e+00 2.7042e-04 -1.3987e-02 1.0875e-04 10 0 0 10 0 0 99.59 17.99 0.08 -0.01399 -0.01578 41 41 2 8 0 654.740 15.00 17.99 16.37 21.48 21.38 19.4 961.12 -3724 -1561 -2125 -2522 253 876 -4602 2370 379 340 353 -2526 -1497 -787 914 -152 712 112 -949 -524 441 -191 794 899 558 -1216 16 48 -725 1083 550 1757 740 1196 -4364 -2850 -2172 -1393 -922 -700 225 -1632 -568 -673 -39 -562 -858 -937 -146 -463 986 437 1097 733 765 1163 928 596 368 633 1045 1501 1220 1880 628 -36 -403 -296 134 189 638 233 466 322 434 -255 -36 -1105 -327 -908 -536 -652 -1869 -1488 -935 -562 -184 -59 566 228 447 335 17 195 388 -298 385 471 358 -6 -259 -780 -672 -353 -770 -799 -621 -427 -138 202 263 503 117 74 -214 65 -145 243 -210 192 -244 2 38 284 551 310 188 1091 854 482 366 44 -78 10 190 -155 -104 185 -152 -221 -186 -325 -530 -311 -141 -200 -224 19 63 -370 199 37 35 36 -267 -178 -107 141 -26 128 21 -189 -108 92 -39 166 201 131 -304 4 11 -157 228 125 426 199 334 -1183 -737 -616 -454 -349 -313 109 -839 -289 -358 -21 -299 -449 -479 -73 -232 519 249 633 451 486 747 611 392 237 403 683 1054 907 1493 505 -27 -289 -206 99 154 570 211 433 288 360 -196 -26 -765 -236 -726 -464 -628 -1883 -1555 -1012 -652 -223 -72 688 274 510 349 16 186 395 -329 455 603 487 -7 -334 -929 -771 -419 -978 -1033 -838 -605 -199 310 417 804 180 109 -299 87 -196 331 -310 293 -381 2 57 416 762 423 244 1414 1199 705 566 68 -123 16 321 -277 -185 336 -278 -392 -326 -551 -903 SS 20231114T172744.8Z 8718.727602 176 1 2.80 2 61.63 187.60 69.71 170.96 0.00 1 0.00 1 0 17 1.298e-02 5.807e-03 7.743e-03 2.335e-03 2.723871e-01 1.136217e-03 3.343930e-03 -6.000000e+00 7.133343e-03 222.79 -2.00 3.55 -2.00 317.39 0.00e+00 3.550331e-04 1.678228e-04 6.433190e-05 -6.000000e+00 3.147067e-04 277.85 -2.00 20.00 -2.00 316.74 0.00e+00 2.094 0.000 302.00 328.00 3 2.7535e+00 2.9788e-03 2.4649e-02 -6.0000e+00 1.7562e-02 -1.6827e-02 3.3682e-03 1.3891e-02 -6.0000e+00 1.9179e-02 4.5113e-03 2.0613e-03 6.9323e-03 -6.0000e+00 1.1434e-02 -3.3537e-03 1.0378e-03 2.0168e-03 -6.0000e+00 4.8966e-03 3.2003e-03 3.7970e-05 6.4264e-05 2.1637e-05 -6.0000e+00 3.3048e-04 -1.5743e-02 1.1131e-04 12 1 1 12 1 1 -152.60 17.99 0.31 -0.01574 -0.01546 14 145 4 8 0 186.490 15.00 17.99 16.83 21.48 21.38 19.5 964.13 -4238 -2183 -2492 -5523 -2599 -4553 -1881 -3221 1230 -2939 -2434 -4646 -1248 -3008 270 -541 -731 -67 885 1187 600 803 -465 2360 -780 848 111 344 -1228 1143 1153 1244 2357 -132 -1334 -2812 -1694 -1963 570 -1291 8 -657 -310 -937 33 -330 -295 -285 -263 438 513 1420 456 1401 86 1256 906 811 459 30 890 1366 1196 1295 114 -348 129 -414 788 181 225 -1 53 390 410 -289 -183 91 219 -415 -738 -1004 -2363 -1405 -1418 -667 -403 -195 189 336 633 122 505 393 464 -50 613 373 297 -346 -346 -679 -721 242 -971 -584 -712 -324 -321 241 72 12 197 312 -134 370 15 411 56 -112 -307 -206 335 275 802 353 702 1020 742 426 507 149 -192 165 239 -172 -56 42 -308 -224 -331 -412 -577 -427 -238 -281 -624 -248 -424 -182 -353 145 -386 -312 -618 -183 -501 50 -113 -159 -15 206 286 149 195 -117 618 -215 240 32 95 -318 286 310 360 740 -43 -417 -864 -551 -742 246 -654 4 -367 -178 -548 19 -192 -168 -158 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