File name: Pandora75s1_EssexMD_20251206_L2Fit_fout2c3d20230525p1-8.txt File generation date: 20251207T061002.7Z 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 v1.8.75 Instrument operation file used: Pandora75_OF_v3d20220127.txt Instrument calibration file used: Pandora75s1_CF_v3d20230525.txt Level 1 file used: Pandora75s1_EssexMD_20251206_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: 20251206 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 20251206T155714.3Z 9471.664749 394 1 2.76 2 63.45 164.53 103.70 323.17 0.00 1 0.00 1 0 17 2.069e-02 9.313e-03 1.211e-02 4.783e-03 2.722182e-01 2.463278e-03 3.238751e-03 -6.000000e+00 1.215335e-02 223.24 -2.00 3.48 -2.00 316.79 0.00e+00 1.255929e-03 3.182141e-04 2.142073e-04 -6.000000e+00 5.418342e-04 279.48 -2.00 20.00 -2.00 316.13 0.00e+00 2.224 0.000 302.00 328.00 3 3.7124e+00 6.3865e-03 2.5872e-02 -6.0000e+00 2.9875e-02 1.5251e-02 7.1869e-03 1.3500e-02 -6.0000e+00 3.2560e-02 5.4818e-03 4.2044e-03 6.6892e-03 -6.0000e+00 1.9444e-02 -7.3911e-03 1.9838e-03 2.0215e-03 -6.0000e+00 8.1196e-03 1.0206e-03 -1.3175e-04 1.5111e-04 2.5599e-05 -6.0000e+00 6.3980e-04 1.4135e-02 -6.3113e-05 12 9 1 12 1 1 999.00 22.96 0.68 0.01414 0.01315 2 9 1 5 0 917.850 25.90 20.00 22.96 11.69 7.6 911.00 -13733 -5893 5225 -6488 13 -2984 -3594 -2775 -5160 -5342 -4408 -823 -1946 1111 3183 -926 2086 2300 1886 2410 1101 33 988 793 53 1206 -1595 -2097 -265 1130 -792 806 450 -3693 -1485 -3424 -3383 -1883 -562 -582 -868 -95 303 584 972 1332 309 -162 -157 625 1687 1669 1591 1509 1324 1453 313 641 231 1274 -7 1980 2276 1931 -145 -1075 -428 -631 730 407 688 1027 558 696 -18 -1709 -1241 -1898 -1512 -963 -1945 -2085 -2417 -1718 -692 -95 422 173 -156 822 558 -964 -131 -657 31 -337 479 899 -306 -668 -892 -1427 -595 -210 -1456 -1180 -207 -640 632 1809 921 955 42 588 -23 -208 472 139 857 75 -7 800 344 824 356 533 566 302 468 496 -723 -862 -161 -37 -251 -98 719 500 -89 247 -777 -387 -1215 -1963 -857 770 -1029 2 -401 -505 -425 -888 -883 -735 -152 -367 234 749 -251 584 672 577 694 327 10 301 254 18 416 -564 -713 -84 351 -265 287 172 -1512 -576 -1346 -1438 -841 -293 -325 -535 -57 188 366 607 827 191 -99 -101 406 1064 1124 1136 1063 967 1083 239 486 174 949 -5 1625 1894 1698 -130 -914 -362 -529 603 375 647 1004 547 654 -17 -1469 -1034 -1540 -1283 -853 -1838 -2170 -2560 -1911 -773 -113 498 210 -189 997 629 -1067 -142 -701 33 -375 589 1148 -395 -849 -1122 -1765 -702 -254 -1819 -1554 -270 -884 871 2615 1346 1402 62 813 -32 -281 633 186 1218 108 -10 1150 484 1154 476 711 732 398 625 706 -1046 -1286 -245 -57 -404 -157 1181 838 -150 404 -1239 -621 -1948 SS 20251206T160135.7Z 9471.667774 397 1 1.38 2 63.23 165.63 104.18 323.98 0.00 1 0.00 1 0 17 1.461e-02 8.280e-03 7.729e-03 3.285e-03 2.789445e-01 1.696162e-03 3.285711e-03 -6.000000e+00 8.583927e-03 223.24 -2.00 3.48 -2.00 316.57 0.00e+00 1.314351e-03 2.082154e-04 1.295770e-04 -6.000000e+00 3.825593e-04 279.48 -2.00 20.00 -2.00 315.92 0.00e+00 2.208 0.000 302.00 328.00 3 2.5074e+00 4.3844e-03 2.5882e-02 -6.0000e+00 2.1101e-02 3.0617e-02 4.9313e-03 1.3769e-02 -6.0000e+00 2.2994e-02 -9.4454e-03 2.8642e-03 6.8072e-03 -6.0000e+00 1.3731e-02 -2.1997e-03 1.3362e-03 2.0955e-03 -6.0000e+00 5.7371e-03 3.4093e-03 -5.1235e-05 1.0330e-04 2.6094e-05 -6.0000e+00 4.5169e-04 9.9173e-03 -1.1519e-04 12 9 1 12 1 1 91.96 22.97 0.57 0.00992 0.00953 4 30 1 5 0 275.570 25.90 20.00 22.97 12.10 7.6 913.67 -5070 -4270 -1855 -1384 -2908 -1096 235 -1442 896 -5196 -4887 -2603 -3452 -756 -2316 153 2137 -90 3590 22 2706 1166 633 1721 1763 -344 -1062 -171 937 982 164 1233 405 -2792 -3900 -2380 -3306 -983 -1225 531 -184 -638 422 -104 406 685 -128 -568 39 285 770 1414 1668 1411 662 1066 345 89 363 534 1623 2107 1303 1323 647 -729 -848 -249 669 1576 695 487 141 410 -347 -1131 -1296 -1836 -2556 -1507 -1591 -1893 -1648 -1437 -770 -414 608 754 726 580 566 -8 -806 -221 -161 147 319 329 -286 0 -824 -1117 -943 -582 -859 -752 -645 -831 564 1189 891 245 708 -334 -306 -285 92 257 491 643 571 590 732 971 412 -58 -50 306 175 188 -206 -425 -2 37 77 -334 415 480 569 88 -668 -800 -1200 -765 -704 -307 -218 -427 -166 36 -227 151 -982 -936 -508 -757 -186 -605 43 629 -28 1136 8 908 398 222 576 618 -127 -394 -60 336 349 57 461 164 -1198 -1638 -978 -1481 -461 -636 313 -113 -413 279 -70 273 458 -85 -373 25 186 525 962 1200 1071 494 809 267 69 276 406 1263 1748 1116 1195 586 -632 -695 -211 566 1392 672 469 136 397 -315 -987 -1097 -1510 -2224 -1371 -1540 -1926 -1709 -1573 -855 -489 715 910 873 701 635 -9 -858 -231 -169 169 390 424 -371 0 -1041 -1373 -1112 -703 -1067 -947 -852 -1112 787 1686 1326 369 1023 -474 -419 -371 120 348 680 935 814 862 1040 1318 556 -75 -65 405 236 260 -301 -618 -2 58 122 -534 677 797 942 142 -1053 -1267 -1890 SS 20251206T161027.3Z 9471.673927 400 1 51.58 2 62.84 167.89 105.13 325.64 0.00 1 0.00 1 0 17 1.340e-02 7.597e-03 5.780e-04 2.383e-04 2.725306e-01 1.227211e-04 3.224814e-03 -6.000000e+00 7.877281e-03 223.24 -2.00 3.48 -2.00 316.65 0.00e+00 9.722300e-04 1.537540e-05 1.819488e-04 -6.000000e+00 3.509767e-04 279.48 -2.00 20.00 -2.00 315.99 0.00e+00 2.179 0.000 302.00 328.00 3 1.1345e+00 3.1778e-04 2.5474e-02 -6.0000e+00 1.9364e-02 9.5880e-03 3.5767e-04 1.3443e-02 -6.0000e+00 2.1100e-02 -1.5866e-03 2.0868e-04 6.6703e-03 -6.0000e+00 1.2601e-02 -5.1719e-03 9.7789e-05 1.9789e-03 -6.0000e+00 5.2649e-03 1.4120e-02 2.3729e-04 7.5165e-06 2.5253e-05 -6.0000e+00 4.1437e-04 1.3129e-02 5.1813e-05 11 8 0 10 0 0 99.96 22.98 0.46 0.01313 0.01491 1173 191 1 5 0 43.970 25.90 20.00 22.98 13.39 7.7 923.88 -1319 -1284 -2063 -3453 -4411 -4056 -3163 -2434 -2358 -3365 -4401 -3607 -2245 -985 81 240 465 962 1672 1526 1577 1352 1628 1235 999 792 -259 -986 -692 -93 277 1078 221 -1642 -3205 -3139 -2598 -1507 -172 -435 -516 -212 22 63 307 464 146 -172 -153 361 629 1069 1204 1303 943 999 727 225 172 586 1213 1804 2060 1491 674 -161 -453 -131 653 1137 691 701 554 319 -188 -990 -1612 -1766 -1882 -1683 -1824 -1983 -2017 -1731 -841 -474 235 584 509 452 348 -64 -490 -201 -246 129 506 536 87 -360 -1060 -1360 -791 -531 -898 -932 -483 -221 545 830 814 518 341 6 -128 -40 173 427 474 329 390 620 544 659 629 213 243 369 300 62 -193 -419 -177 24 75 118 399 252 48 2 -466 -839 -898 -197 -192 -321 -521 -678 -594 -476 -400 -387 -589 -792 -670 -457 -227 21 63 130 279 503 475 499 431 528 421 358 294 -97 -356 -236 -31 98 407 91 -648 -1245 -1311 -1075 -713 -88 -242 -315 -136 15 42 205 309 97 -112 -98 233 426 721 860 977 692 749 553 172 130 440 936 1482 1722 1321 600 -136 -384 -110 542 1041 654 692 547 303 -176 -849 -1350 -1431 -1601 -1504 -1731 -1969 -2146 -1850 -951 -544 282 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