File name: Pandora75s1_EssexMD_20240623_L2Fit_fout2c3d20230525p1-8.txt File generation date: 20250117T115543.3Z 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_20240623_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: 20240623 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 20240623T105242.7Z 8940.453272 207 1 19.39 2 78.26 69.25 91.14 234.55 0.00 1 0.00 1 0 17 2.737e-01 1.052e-02 1.593e-01 3.961e-03 5.683361e-01 2.161485e-03 6.857389e-03 -6.000000e+00 1.670248e-01 232.85 -2.00 3.48 -2.00 320.58 0.00e+00 4.606066e-03 8.842508e-04 3.774378e-03 -6.000000e+00 7.560941e-03 288.46 -2.00 20.00 -2.00 319.86 0.00e+00 4.755 0.002 302.00 328.00 3 2.5130e+00 6.8712e-03 5.8044e-02 -6.0000e+00 4.1877e-01 9.2432e-03 8.7437e-03 3.5710e-02 -6.0000e+00 4.5208e-01 -9.3852e-02 7.6885e-03 1.8763e-02 -6.0000e+00 2.6949e-01 3.1937e-02 3.7851e-03 5.6908e-03 -6.0000e+00 1.1192e-01 2.1244e-04 8.3557e-04 1.2299e-04 1.0549e-04 -6.0000e+00 8.5632e-03 -2.0471e-04 1.1804e-04 12 9 9 12 1 1 57.79 23.63 0.74 -0.00020 0.00607 23 10 1 5 0 807.800 26.32 19.99 23.63 36.55 4.1 1071.57 -113525 -1686 15585 900000 -134996 -41491 -73359 -124414 -130831 -82254 -58644 -18582 -59260 -48620 -13906 -54494 -32210 -20615 -17756 -52852 19142 24371 -11922 -4288 -22766 -4396 -40208 -9684 -32655 5355 1970 -8423 15404 -18673 5701 -7083 -5909 -8371 10391 -6839 -1305 5693 4429 6555 -3482 6956 -3143 3984 -2143 789 -3743 2962 2116 7508 2911 4022 1198 132 1962 -1222 -1139 2472 2393 3029 3861 1983 2574 1515 1856 4111 766 3456 625 105 -1469 -72 -2317 -959 -2778 -3196 -2518 -2577 -1479 -1576 -251 416 1180 1110 1140 1259 194 34 -1369 -669 -1224 -742 556 76 368 -774 -602 -1997 -1324 -1236 -974 -2099 -704 -30 738 544 1979 297 424 -278 -680 -38 -733 80 537 335 690 753 1004 103 248 -41 113 317 446 -10 -127 -826 -265 -557 -23 385 593 590 162 602 -684 -569 -759 -1236 -7 60 900000 -2228 -262 -670 -2097 -2880 -1207 -725 -172 -1007 -939 -236 -1663 -896 -565 -514 -2307 421 518 -378 -134 -915 -155 -2066 -363 -1539 184 81 -449 738 -1349 322 -457 -411 -698 867 -803 -164 721 600 901 -542 1000 -511 620 -369 141 -765 627 494 1798 774 1100 346 39 556 -358 -347 795 785 1088 1437 743 946 579 771 1887 400 1841 341 55 -723 -32 -984 -405 -1314 -1764 -1599 -1699 -1056 -1205 -203 357 1057 1025 1053 1123 164 27 -1063 -529 -1071 -739 579 90 465 -988 -726 -2246 -1393 -1312 -1096 -2537 -890 -38 1000 813 2957 470 668 -425 -1061 -56 -1115 126 833 542 1112 1185 1526 164 376 -61 163 478 691 -18 -238 -1549 -519 -1161 -48 835 1320 1335 367 1307 -1433 -1212 -1597 SS 20240623T110253.0Z 8940.460335 210 1 51.77 2 76.41 70.71 92.68 236.09 0.00 1 0.00 1 0 17 2.433e-01 1.042e-02 1.220e-01 3.325e-03 5.145224e-01 1.809626e-03 6.060316e-03 -6.000000e+00 1.483549e-01 232.85 -2.00 3.48 -2.00 320.46 0.00e+00 1.582211e-03 7.010565e-04 2.793353e-03 -6.000000e+00 6.701642e-03 288.46 -2.00 20.00 -2.00 319.72 0.00e+00 4.153 0.001 302.00 328.00 3 3.5231e+00 5.7127e-03 5.1231e-02 -6.0000e+00 3.7196e-01 -3.8682e-03 7.1296e-03 3.2082e-02 -6.0000e+00 4.0166e-01 -3.2407e-02 6.0843e-03 1.4744e-02 -6.0000e+00 2.3945e-01 1.1265e-03 3.0164e-03 3.6003e-03 -6.0000e+00 9.9472e-02 1.4342e-04 9.6261e-05 1.0616e-04 6.6859e-05 -6.0000e+00 7.5489e-03 1.8946e-03 -2.5831e-05 12 9 8 11 8 0 99.97 23.63 0.90 0.00189 0.00262 90 15 1 5 0 575.130 26.32 20.00 23.63 37.00 4.1 1075.42 -112764 -67957 900000 -22934 -66517 -83056 -28059 -81868 -107841 29475 -67586 110400 -38211 -34732 -16456 -37947 -17133 -14262 13470 -57340 56174 -185 7062 -339 -4258 8362 -19215 -3827 -13706 24493 -10542 -11067 3969 -6912 -7585 15698 -4661 -527 11489 -4154 1295 -527 -647 3404 -3413 5280 4863 3161 -2971 4665 -514 693 1512 8433 -245 8705 -2830 -1062 -1531 51 564 1600 3328 962 1856 -1101 2274 -544 2838 2126 1717 3897 167 -462 -1211 -283 -2238 -28 -3073 -2284 -2963 -2033 -2206 -985 -879 94 1300 1113 1415 284 1418 -547 -222 -915 -1377 635 1019 -81 346 -334 -1205 -1669 -1721 -747 -1667 -2019 -685 -215 613 439 2079 838 527 -338 -404 56 -602 336 -318 926 244 424 591 324 252 -375 19 -3 525 -160 221 -763 -581 -873 80 -83 612 858 195 455 -521 35 -836 -1695 -761 900000 -176 -745 -1077 -223 -1255 -2416 201 -1293 394 -719 -777 -373 -1255 -517 -458 354 -3235 1056 -6 231 -13 -181 331 -1022 -171 -667 850 -584 -710 247 -511 -561 926 -369 -47 1099 -551 183 -82 -106 551 -601 866 812 546 -563 864 -109 160 378 2122 -71 2408 -902 -334 -477 16 178 544 1234 399 789 -472 923 -232 1271 1081 875 2037 90 -265 -648 -137 -1028 -13 -1544 -1311 -1790 -1370 -1625 -765 -731 82 1188 1048 1328 260 1203 -442 -171 -721 -1190 609 1110 -92 415 -402 -1385 -1939 -1891 -825 -1974 -2332 -827 -275 844 663 3325 1298 877 -544 -615 82 -889 514 -518 1550 414 701 946 500 373 -537 27 -4 833 -281 384 -1414 -1126 -1792 173 -175 1317 1873 428 960 -1142 72 -1742 SS 20240623T112146.6Z 8940.473455 216 1 40.31 2 72.93 73.39 95.62 238.89 0.00 1 0.00 1 0 17 8.672e-02 9.143e-03 2.912e-02 2.533e-03 4.223296e-01 1.346999e-03 4.928557e-03 -6.000000e+00 5.289310e-02 232.85 -2.00 3.48 -2.00 319.18 0.00e+00 2.035449e-03 3.457329e-04 1.272091e-03 -6.000000e+00 2.357630e-03 288.46 -2.00 20.00 -2.00 318.36 0.00e+00 3.355 0.001 302.00 328.00 3 3.9029e+00 3.8028e-03 4.0425e-02 -6.0000e+00 1.3262e-01 1.0114e-02 4.4145e-03 2.2684e-02 -6.0000e+00 1.4319e-01 -1.6319e-02 3.1641e-03 1.1132e-02 -6.0000e+00 8.5326e-02 5.5146e-04 1.6367e-03 3.1690e-03 -6.0000e+00 3.5355e-02 2.2787e-04 1.3784e-04 7.9956e-05 4.3336e-05 -6.0000e+00 2.6880e-03 4.2055e-04 3.4199e-05 12 9 1 12 9 1 99.86 23.63 0.51 0.00042 0.00146 22 5 1 5 0 1752.540 26.32 19.99 23.63 37.55 4.1 1078.84 -28220 -26830 34863 -3687 -31131 -39267 -6193 -29601 -37470 -9821 -15305 -21206 -21238 9583 3555 -12003 -5879 -3473 -9253 -15293 7352 5464 -5192 -4707 -4573 5829 2761 -6016 -10378 10356 -1085 -7722 6228 -1682 -5602 1048 -8435 -606 3235 1537 -1625 2553 268 1740 -1049 138 752 140 -282 364 929 546 1805 3964 277 3476 -480 -570 -1064 -212 345 3111 2000 1965 1345 341 971 533 760 698 849 2568 699 334 -840 -666 -1938 -2028 -2607 -2132 -1583 -2484 -1561 -1185 -1046 -242 816 1361 820 1246 691 -291 -1147 -996 -943 635 413 146 380 -296 -1287 -1934 -881 -614 -1451 -1312 -853 40 328 853 1307 748 294 -606 -53 629 -7 212 381 289 357 492 587 584 447 -67 -157 459 487 -5 -378 -709 -137 -104 -119 -324 438 555 151 353 -242 -617 -765 -739 -795 594 -91 -946 -1251 -148 -994 -1518 -325 -559 -885 -1028 409 192 -875 -444 -276 -832 -1534 606 466 -508 -486 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