File name: Pandora75s1_EssexMD_20250117_L2Fit_fout2c3d20230525p1-8.txt File generation date: 20250118T052336.3Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 75 Spectrometer number: 1 Processing software version used: BlickP v1.8.70 Instrument operation file used: Pandora75_OF_v3d20220127.txt Instrument calibration file used: Pandora75s1_CF_v3d20230525.txt Level 1 file used: Pandora75s1_EssexMD_20250117_L1_smca1c3d20230525p1-8.txt Full location name: MDE Essex Monitoring Site Short location name: EssexMD Country of location: United States Location latitude [deg]: 39.3109 Location longitude [deg]: -76.4745 Location altitude [m]: 12 Local noon date: 20250117 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 session 2 First and last pixel inside fitting window: 196 338 Nominal wavelengths inside fitting window [nm]: 305.0305 305.1717 305.3128 305.4540 305.5951 305.7363 305.8774 306.0185 306.1596 306.3007 306.4418 306.5828 306.7239 306.8649 307.0060 307.1470 307.2880 307.4290 307.5700 307.7110 307.8519 307.9929 308.1338 308.2747 308.4157 308.5566 308.6975 308.8384 308.9792 309.1201 309.2610 309.4018 309.5426 309.6834 309.8243 309.9651 310.1058 310.2466 310.3874 310.5281 310.6689 310.8096 310.9503 311.0910 311.2317 311.3724 311.5131 311.6537 311.7944 311.9350 312.0757 312.2163 312.3569 312.4975 312.6381 312.7786 312.9192 313.0598 313.2003 313.3408 313.4813 313.6218 313.7623 313.9028 314.0433 314.1838 314.3242 314.4646 314.6051 314.7455 314.8859 315.0263 315.1667 315.3070 315.4474 315.5877 315.7281 315.8684 316.0087 316.1490 316.2893 316.4296 316.5699 316.7101 316.8504 316.9906 317.1308 317.2710 317.4112 317.5514 317.6916 317.8318 317.9719 318.1121 318.2522 318.3923 318.5324 318.6725 318.8126 318.9527 319.0927 319.2328 319.3728 319.5129 319.6529 319.7929 319.9329 320.0729 320.2128 320.3528 320.4927 320.6327 320.7726 320.9125 321.0524 321.1923 321.3322 321.4721 321.6119 321.7518 321.8916 322.0314 322.1712 322.3110 322.4508 322.5906 322.7304 322.8701 323.0099 323.1496 323.2893 323.4290 323.5687 323.7084 323.8481 323.9877 324.1274 324.2670 324.4067 324.5463 324.6859 324.8255 324.9650 --------------------------------------------------------------------------------------- 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: Temperature at electronics board [°C], 999=no temperature signal Column 95: Spectrometer control temperature [°C], 999=no temperature signal Column 96: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 97: Temperature in head sensor [°C], 999=no temperature signal Column 98: Humidity in head sensor [%], -9=no humidity signal Column 99: Pressure in head sensor [hPa], -9=no pressure signal Columns 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: 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 20250117T182247.8Z 9148.765831 483 1 50.88 2 61.88 197.71 126.71 324.30 0.00 1 0.00 1 0 17 2.779e-02 8.850e-03 5.748e-03 1.595e-03 3.090112e-01 8.219188e-04 3.646416e-03 -6.000000e+00 1.638127e-02 223.98 -2.00 3.48 -2.00 317.49 0.00e+00 1.317105e-03 1.257403e-04 3.780990e-04 -6.000000e+00 7.192707e-04 276.65 -2.00 20.00 -2.00 316.86 0.00e+00 2.112 0.000 302.00 328.00 3 4.7952e+00 2.1623e-03 2.6016e-02 -6.0000e+00 4.0375e-02 2.9355e-03 2.4400e-03 1.5292e-02 -6.0000e+00 4.3988e-02 -3.8332e-03 1.4915e-03 7.6731e-03 -6.0000e+00 2.6210e-02 -3.7557e-03 7.3417e-04 2.3496e-03 -6.0000e+00 1.0910e-02 3.6420e-04 4.4508e-05 5.0336e-05 2.8004e-05 -6.0000e+00 8.5910e-04 9.5778e-03 2.7559e-05 11 8 0 10 0 0 99.72 23.05 0.40 0.00958 0.00991 24 4 1 5 0 2119.800 25.90 20.00 23.05 13.32 5.8 919.66 -22024 -5329 3039 -1258 -9455 -6497 -3532 -3524 -8192 -2822 -7872 -5974 -301 2518 1457 -3112 -1027 2210 1331 -638 2825 3505 125 -112 -748 707 -361 -2298 -1929 2064 -844 -416 -238 -2600 -1633 -2720 -3528 -2653 670 143 -979 1247 563 376 701 897 363 274 -78 1047 456 247 1589 2412 1079 1247 602 -614 -17 -409 1174 2275 2716 1695 1246 -173 -45 -901 827 1433 576 1175 240 61 -445 -836 -2040 -2025 -1867 -2278 -1999 -2246 -2027 -1546 -914 -241 320 721 566 890 350 -134 -900 -836 -703 210 375 450 632 -165 -1186 -1794 -1035 -606 -1038 -1246 -452 111 565 880 1248 716 440 -183 -295 142 90 230 459 482 369 752 824 692 392 179 118 -94 393 46 -136 -530 -99 -47 -44 55 354 517 -49 118 -615 -762 -793 -2282 -520 283 -118 -885 -565 -309 -339 -911 -316 -948 -740 -40 373 252 -629 -198 434 276 -140 611 757 28 -27 -190 183 -95 -591 -472 484 -216 -116 -71 -827 -500 -836 -1179 -1015 269 67 -513 676 319 216 404 516 208 155 -44 594 253 147 994 1580 743 878 433 -446 -12 -292 852 1627 2097 1402 1039 -139 -34 -682 654 1252 516 1092 225 55 -401 -686 -1556 -1611 -1450 -1986 -1823 -2266 -2054 -1650 -1035 -272 377 870 683 1030 402 -143 -959 -878 -733 239 448 591 821 -213 -1546 -2184 -1197 -716 -1314 -1672 -598 154 825 1294 1919 1119 668 -262 -414 190 120 320 677 707 550 1103 1175 1000 541 235 160 -130 544 68 -203 -820 -157 -73 -73 95 598 888 -84 207 -1050 -1259 -1296 SS 20250117T183305.8Z 9148.772984 486 1 52.20 2 62.53 200.34 127.83 327.05 0.00 1 0.00 1 0 17 2.786e-02 8.327e-03 4.925e-03 1.360e-03 3.145138e-01 7.014929e-04 3.718479e-03 -6.000000e+00 1.641974e-02 223.98 -2.00 3.48 -2.00 317.52 0.00e+00 1.095091e-03 1.081964e-04 3.663939e-04 -6.000000e+00 7.210828e-04 276.65 -2.00 20.00 -2.00 316.90 0.00e+00 2.157 0.000 302.00 328.00 3 4.4715e+00 1.8421e-03 2.6552e-02 -6.0000e+00 4.0470e-02 2.9469e-03 2.0771e-03 1.5591e-02 -6.0000e+00 4.4094e-02 9.7721e-04 1.2729e-03 7.7991e-03 -6.0000e+00 2.6273e-02 -5.8114e-03 6.2778e-04 2.3284e-03 -6.0000e+00 1.0935e-02 4.7750e-04 -4.6861e-06 4.2799e-05 2.8523e-05 -6.0000e+00 8.6128e-04 9.6977e-03 -9.9814e-06 11 8 0 10 0 0 43.74 23.06 0.51 0.00970 0.00966 34 6 1 5 0 1535.010 25.90 20.00 23.06 13.91 5.9 925.29 -21439 -4940 1989 -4590 -9011 -9390 -2523 -4459 -7073 -4940 -9452 -5200 308 3203 75 -547 -887 -5 953 644 2349 3095 376 92 -605 682 -1466 -2055 -1666 1972 129 1242 1628 -1566 -2114 -2584 -3130 -2320 1176 -82 -486 792 565 416 406 1197 -363 -605 -117 855 329 617 1259 2110 841 1564 446 -422 -322 173 1249 1830 2570 1774 738 -257 -226 50 979 1204 473 1201 437 229 -467 -947 -1578 -1760 -2063 -2152 -1801 -2050 -1983 -1698 -1028 -301 274 554 547 747 372 -108 -681 -544 -719 313 554 643 434 -287 -1087 -1516 -928 -695 -992 -1196 -502 28 787 864 994 542 233 46 -256 121 34 179 516 408 384 599 827 574 744 43 207 101 195 56 -144 -541 -199 61 -39 24 328 400 -85 204 -466 -729 -852 -2166 -471 184 -437 -826 -828 -216 -429 -772 -561 -1150 -637 40 471 13 -98 -171 -1 199 140 513 675 86 22 -155 179 -394 -534 -412 470 33 346 489 -502 -663 -809 -1064 -905 482 -40 -260 409 303 227 222 649 -198 -327 -63 462 188 378 816 1432 557 1054 309 -294 -221 118 870 1360 2058 1417 598 -214 -179 39 805 1024 441 1088 398 214 -408 -809 -1246 -1350 -1673 -1825 -1711 -2021 -2097 -1784 -1146 -355 319 660 651 902 419 -120 -709 -559 -785 351 655 834 560 -368 -1399 -1820 -1122 -860 -1240 -1585 -658 39 1139 1265 1527 846 352 66 -358 161 45 248 756 597 571 876 1236 823 1014 60 277 138 270 84 -214 -836 -316 95 -65 42 557 690 -148 359 -794 -1204 -1395 SS 20250117T184253.5Z 9148.779786 489 1 51.36 2 63.23 202.79 128.82 329.75 0.00 1 0.00 1 0 17 2.845e-02 8.090e-03 5.257e-03 1.392e-03 3.188794e-01 7.152510e-04 3.755816e-03 -6.000000e+00 1.676653e-02 223.98 -2.00 3.48 -2.00 317.60 0.00e+00 1.480149e-03 1.135495e-04 3.365638e-04 -6.000000e+00 7.362410e-04 276.65 -2.00 20.00 -2.00 316.98 0.00e+00 2.208 0.000 302.00 328.00 3 4.4439e+00 1.8809e-03 2.7080e-02 -6.0000e+00 4.1325e-02 4.3838e-03 2.1242e-03 1.5806e-02 -6.0000e+00 4.5024e-02 -8.8955e-04 1.3082e-03 7.9282e-03 -6.0000e+00 2.6827e-02 -4.5105e-03 6.4875e-04 2.4826e-03 -6.0000e+00 1.1167e-02 4.6369e-04 -2.1302e-05 4.3638e-05 2.9523e-05 -6.0000e+00 8.7938e-04 9.2811e-03 -1.0697e-07 11 9 0 11 8 0 -19.30 23.07 0.44 0.00928 0.00912 33 5 1 5 0 1556.080 25.90 20.00 23.07 14.68 5.8 931.15 -22821 -7477 3930 -3853 -8398 -10506 -3654 -3371 -7287 -3219 -6811 -4397 -3034 3331 -120 -1957 1120 1192 862 190 2117 2190 -3 443 -801 -434 -1519 -1947 -1463 1602 829 1521 745 -1912 -2784 -2444 -2447 -1403 160 431 -680 285 506 349 379 975 699 26 76 786 -143 292 1398 2236 1405 1187 532 -235 -183 -217 983 2206 2366 1937 509 -403 -251 -376 815 1358 529 839 477 -26 -193 -756 -1707 -1592 -2162 -2006 -1454 -1932 -1977 -1847 -1173 -297 184 609 547 699 385 -80 -629 -383 -541 294 587 514 408 -302 -1132 -1493 -783 -735 -863 -1213 -464 124 304 916 1234 516 303 -138 -129 431 -161 229 541 203 472 717 617 605 476 51 199 66 461 -25 -262 -447 -203 -183 -16 14 277 610 -49 178 -476 -694 -826 -2221 -696 340 -348 -731 -894 -301 -305 -757 -341 -766 -508 -390 467 -20 -376 204 229 174 40 447 465 -1 103 -198 -111 -393 -487 -348 370 206 410 219 -598 -855 -743 -803 -526 64 201 -354 144 264 185 202 517 369 14 40 416 -81 176 886 1485 977 787 360 -160 -123 -145 674 1603 1865 1520 407 -331 -195 -291 661 1138 487 802 457 -24 -166 -635 -1332 -1204 -1735 -1680 -1362 -1883 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