File name: Pandora75s1_EssexMD_20250109_L2Fit_fout2c3d20230525p1-8.txt File generation date: 20250116T092537.0Z 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_20250109_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: 20250109 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 20250109T141750.9Z 9140.595728 199 1 50.57 2 73.74 138.02 116.93 17.72 0.00 1 0.00 1 0 17 2.816e-01 1.803e-02 9.762e-02 3.833e-03 5.511413e-01 2.019968e-03 6.732532e-03 -6.000000e+00 1.657852e-01 223.75 -2.00 3.48 -2.00 320.09 0.00e+00 2.948585e-03 6.811860e-04 3.213978e-03 -6.000000e+00 7.417290e-03 277.03 -2.00 20.00 -2.00 319.52 0.00e+00 3.513 0.001 302.00 328.00 3 4.5738e+00 5.8666e-03 4.6240e-02 -6.0000e+00 4.0827e-01 7.9333e-02 7.1189e-03 3.1786e-02 -6.0000e+00 4.4495e-01 -1.2401e-01 6.1451e-03 1.6746e-02 -6.0000e+00 2.6547e-01 5.3628e-02 3.1309e-03 5.1647e-03 -6.0000e+00 1.1097e-01 8.5011e-05 -9.5319e-05 1.1753e-04 9.5420e-05 -6.0000e+00 8.7385e-03 1.3094e-02 8.6263e-06 12 8 8 10 0 0 53.80 22.70 0.31 0.01309 0.01238 14 2 1 5 0 3611.910 25.58 20.00 22.70 3.04 5.7 847.45 -209115 -43785 900000 -25334 -105718 -43404 39222 -28447 -103607 727 -105418 -52140 86141 900000 40608 -34789 -13725 -16203 11594 -9519 42399 -5445 -19997 -6170 -23217 -13537 -4348 -27363 -10807 43414 -5599 -18404 14064 -1270 24042 12722 -229 4638 14606 19365 468 21259 11258 6705 -840 8285 3236 1427 6012 8451 6661 -2309 6318 8811 3642 5991 3571 -3905 -3317 -2281 3302 6874 4877 2326 3028 -552 2448 -256 3803 3588 -482 3331 -1718 -372 -1101 -1748 -3214 -1038 -1229 -3908 -2381 -3908 -1798 -1195 -2386 -732 -17 371 112 2430 105 -792 -849 -2367 -2893 215 -127 -169 736 -15 -1731 -1941 -1457 -1706 -1586 -2075 -448 1022 446 1025 2218 990 -125 -767 -453 1013 571 157 425 448 1581 572 1315 573 842 -385 -45 -887 888 193 285 -201 -267 29 -484 -342 16 749 -708 319 51 -381 -1026 -12503 -580 900000 -293 -2550 -546 249 -393 -3062 9 -3979 -1286 644 900000 728 -1560 -559 -739 429 -455 1236 -258 -1136 -325 -1544 -855 -253 -1963 -650 1606 -385 -1664 1035 -115 1671 994 -22 499 1708 2540 83 3289 2015 1288 -176 1613 672 308 1283 1863 1630 -680 1856 2713 1244 2068 1288 -1373 -1251 -846 1202 2633 1930 1033 1381 -256 1084 -119 1854 1970 -300 2080 -1116 -226 -619 -896 -1570 -501 -652 -2465 -1703 -2926 -1433 -1008 -2173 -696 -17 374 113 2290 95 -673 -696 -2022 -2732 224 -140 -209 956 -19 -2145 -2208 -1681 -1997 -1813 -2521 -566 1363 650 1515 3497 1637 -206 -1221 -679 1441 822 237 672 732 2540 903 1990 840 1267 -565 -65 -1347 1353 325 519 -361 -504 58 -957 -704 33 1577 -1495 640 103 -744 -1990 SS 20250109T142329.9Z 9140.599651 202 1 53.17 2 73.01 139.16 116.58 19.06 0.00 1 0.00 1 0 17 3.206e-01 1.582e-02 1.237e-01 3.373e-03 5.326552e-01 1.762952e-03 6.355085e-03 -6.000000e+00 1.887253e-01 223.75 -2.00 3.48 -2.00 319.93 0.00e+00 3.437108e-03 5.676237e-04 2.467255e-03 -6.000000e+00 8.310720e-03 277.03 -2.00 20.00 -2.00 319.36 0.00e+00 3.372 0.001 302.00 328.00 3 4.5630e+00 5.0675e-03 4.3718e-02 -6.0000e+00 4.6485e-01 7.2142e-02 6.0829e-03 2.8610e-02 -6.0000e+00 5.0658e-01 -1.0605e-01 5.1393e-03 1.5676e-02 -6.0000e+00 3.0196e-01 4.4137e-02 2.6398e-03 5.4694e-03 -6.0000e+00 1.2573e-01 1.0004e-04 -5.5681e-05 1.0292e-04 8.3965e-05 -6.0000e+00 9.9110e-03 1.2856e-02 1.5670e-05 12 9 8 11 40 0 74.93 22.71 0.19 0.01286 0.01244 16 3 1 5 0 3322.960 25.68 20.00 22.71 3.23 5.7 849.21 -190854 -75587 69550 -28186 -80379 -55555 47089 -49742 -58975 -27466 -56660 -37309 79875 226787 50517 -35982 -9055 -5405 12528 -6450 13439 12809 -21113 -21902 -17792 1874 -18970 -24980 -5991 52888 2935 -2344 6740 -7120 18441 8477 -5883 -1675 8307 11294 1282 10286 10848 1197 1346 6570 7351 50 1028 11067 3159 -631 6129 8401 2151 5084 1941 -2010 -741 -1427 -1864 6684 4155 2366 3257 -1382 829 -303 2710 1398 -1394 3241 -748 -384 -1026 -1426 -2923 -739 -1412 -3141 -1605 -2333 -2204 -820 -2200 -1974 1026 551 -224 2145 56 15 -697 -1942 -1790 -73 -353 641 802 -40 -1170 -2057 -888 -1530 -1718 -1933 -263 1046 595 1377 1764 362 753 -752 -1084 779 52 417 106 609 1362 554 1425 618 995 -554 -378 -863 332 -123 -30 -420 -67 121 -136 -107 309 632 -360 -157 -48 -579 -746 -11245 -1628 374 -396 -1779 -930 325 -998 -1436 -524 -1528 -921 736 746 947 -1882 -405 -254 528 -344 601 582 -1389 -1542 -1276 115 -1454 -1989 -390 2018 210 -204 601 -771 1523 775 -676 -215 1156 1791 251 1976 2170 270 308 1450 1632 12 256 2629 883 -183 1802 2590 742 1761 706 -757 -270 -522 -712 2553 1810 1145 1614 -702 404 -153 1439 845 -944 2180 -518 -251 -622 -786 -1533 -382 -805 -2101 -1114 -1831 -1876 -733 -2126 -1865 985 545 -221 2157 54 14 -605 -1744 -1761 -74 -410 822 1012 -51 -1509 -2454 -986 -1731 -2065 -2462 -349 1358 842 2116 2715 584 1194 -1157 -1691 1148 78 647 173 958 2121 906 2235 938 1440 -783 -524 -1257 524 -199 -53 -776 -130 230 -273 -225 663 1365 -776 -325 -94 -1091 -1391 SS 20250109T142858.8Z 9140.603458 205 1 52.32 2 72.33 140.28 116.22 20.34 0.00 1 0.00 1 0 17 3.025e-01 1.078e-02 1.202e-01 3.103e-03 5.244428e-01 1.626659e-03 6.092560e-03 -6.000000e+00 1.782003e-01 223.75 -2.00 3.48 -2.00 319.79 0.00e+00 9.445708e-04 5.046488e-04 1.719609e-03 -6.000000e+00 7.997132e-03 277.03 -2.00 20.00 -2.00 319.22 0.00e+00 3.249 0.001 302.00 328.00 3 4.5528e+00 4.6285e-03 4.2208e-02 -6.0000e+00 4.3888e-01 3.5375e-02 5.5494e-03 2.7663e-02 -6.0000e+00 4.7847e-01 -3.1616e-02 4.7362e-03 1.4137e-02 -6.0000e+00 2.8521e-01 6.4027e-03 2.4506e-03 4.1453e-03 -6.0000e+00 1.2010e-01 1.1525e-04 -1.2451e-05 9.5725e-05 6.0162e-05 -6.0000e+00 9.4132e-03 1.1648e-02 2.6652e-05 12 9 8 11 40 0 18.87 22.72 0.63 0.01165 0.01155 17 3 1 5 0 3077.580 25.68 20.00 22.72 3.36 5.7 849.95 900000 -58565 900000 -19089 -62514 -90290 96401 -51282 -77880 2134 -60943 -11117 6753 279273 -16509 -43212 -29727 -10785 13521 -15572 11484 1570 -23334 -7415 -31491 -13138 -10731 -17930 -8415 17129 -2382 -4175 1267 -8824 11136 2787 -4196 -1230 -243 7289 32 7370 6393 2600 -1654 1977 2844 -2477 -157 3556 2608 -3255 3830 7292 1249 3575 195 -1618 -955 -544 2932 3275 3005 2766 2699 -2877 -305 -660 2274 1931 299 -171 -780 1086 -511 -489 -1300 -786 -1515 -1285 -1042 -2547 -1661 -784 -1329 -330 731 1220 61 2003 819 -587 -1432 -1465 -1881 795 41 -98 1291 148 -1282 -1418 -1273 -916 -1454 -2125 -636 741 655 664 1815 691 403 -427 -428 723 163 -256 292 184 894 196 625 395 234 -561 -380 1123 -83 -312 -297 -239 -483 -217 -11 -314 334 571 -281 546 -136 -180 -652 900000 -950 900000 -243 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