File name: Pandora206s1_BuffaloNY_20250218_L2Fit_fout2c6d20240814p1-8.txt File generation date: 20250219T053956.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 Local principal investigator: Kang Sun Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 206 Spectrometer number: 1 Processing software version used: BlickP v1.8.70 Instrument operation file used: Pandora206_OF_v3d20211008.txt Instrument calibration file used: Pandora206s1_CF_v6d20240814.txt Level 1 file used: Pandora206s1_BuffaloNY_20250218_L1_smca1c6d20240814p1-8.txt Full location name: University at Buffalo Short location name: BuffaloNY Country of location: United States Location latitude [deg]: 43.0015 Location longitude [deg]: -78.7869 Location altitude [m]: 190 Local noon date: 20250218 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]: 305.0348 305.1758 305.3167 305.4577 305.5987 305.7396 305.8805 306.0215 306.1624 306.3033 306.4442 306.5850 306.7259 306.8668 307.0076 307.1484 307.2893 307.4301 307.5709 307.7117 307.8524 307.9932 308.1340 308.2747 308.4154 308.5561 308.6968 308.8375 308.9782 309.1189 309.2596 309.4002 309.5408 309.6815 309.8221 309.9627 310.1033 310.2438 310.3844 310.5250 310.6655 310.8060 310.9466 311.0871 311.2276 311.3681 311.5085 311.6490 311.7894 311.9299 312.0703 312.2107 312.3511 312.4915 312.6319 312.7723 312.9126 313.0530 313.1933 313.3336 313.4740 313.6143 313.7545 313.8948 314.0351 314.1753 314.3156 314.4558 314.5960 314.7362 314.8764 315.0166 315.1568 315.2970 315.4371 315.5772 315.7174 315.8575 315.9976 316.1377 316.2777 316.4178 316.5579 316.6979 316.8379 316.9780 317.1180 317.2580 317.3980 317.5379 317.6779 317.8178 317.9578 318.0977 318.2376 318.3775 318.5174 318.6573 318.7972 318.9370 319.0769 319.2167 319.3565 319.4963 319.6361 319.7759 319.9157 320.0554 320.1952 320.3349 320.4747 320.6144 320.7541 320.8938 321.0335 321.1731 321.3128 321.4524 321.5921 321.7317 321.8713 322.0109 322.1505 322.2900 322.4296 322.5692 322.7087 322.8482 322.9877 323.1272 323.2667 323.4062 323.5457 323.6851 323.8246 323.9640 324.1034 324.2428 324.3822 324.5216 324.6610 324.8003 324.9397 --------------------------------------------------------------------------------------- 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 20250218T133556.7Z 9180.566629 244 1 27.21 2 76.00 120.77 82.64 237.70 0.00 1 0.00 1 0 17 3.940e-01 1.212e-02 3.198e-01 9.282e-03 6.732056e-01 5.063119e-03 7.693014e-03 -6.000000e+00 2.249003e-01 224.81 -2.00 3.55 -2.00 321.02 0.00e+00 2.357460e-04 2.155496e-03 2.163178e-03 -6.000000e+00 1.196042e-02 272.68 -2.00 20.00 -2.00 320.56 0.00e+00 4.042 0.001 302.00 328.00 3 4.3969e+00 1.5846e-02 5.4187e-02 -6.0000e+00 5.5872e-01 8.9491e-03 2.2513e-02 3.9010e-02 -6.0000e+00 6.1214e-01 -2.6368e-02 2.5748e-02 2.0075e-02 -6.0000e+00 3.6157e-01 2.4336e-03 1.2543e-02 6.2061e-03 -6.0000e+00 1.5702e-01 5.9332e-05 -7.7800e-04 2.6126e-04 7.2289e-05 -6.0000e+00 1.0583e-02 1.2833e-03 0.0000e+00 12 8 8 10 0 0 42.56 17.73 0.39 0.00128 -0.00456 8 8 4 8 0 3400.700 15.00 17.73 -5.50 21.38 21.17 22.7 889.59 -225928 900000 900000 900000 900000 900000 900000 -166148 -148038 900000 123860 900000 -20767 -10076 79032 900000 900000 56267 900000 -69477 900000 -56076 900000 -1522 38793 -16692 51093 37146 65491 43213 8377 26976 178512 50001 9586 34730 -46364 40148 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-656 1967 -1107 26 -203 -409 1592 -94 2084 -2662 -290 -66 940 -640 8 -656 -647 -946 1734 188 913 944 363 295 -1620 -1107 1310 258 -2702 889 -958 3041 -284 -86 648 428 -80 -1583 -755 -1323 1388 90 1886 -482 320 -640 -312 SS 20250218T134430.8Z 9180.572579 247 1 28.42 2 74.66 122.44 83.97 239.20 0.00 1 0.00 1 0 17 3.856e-01 1.086e-02 2.668e-01 7.361e-03 6.268795e-01 3.864666e-03 7.121828e-03 -6.000000e+00 2.163088e-01 224.81 -2.00 3.55 -2.00 320.74 0.00e+00 4.686117e-03 1.522641e-03 1.107271e-03 -6.000000e+00 1.016219e-02 272.68 -2.00 20.00 -2.00 320.28 0.00e+00 3.711 0.001 302.00 328.00 3 4.3433e+00 1.1712e-02 4.9677e-02 -6.0000e+00 5.3616e-01 5.6074e-02 1.5492e-02 3.5414e-02 -6.0000e+00 5.8580e-01 -6.7845e-02 1.6604e-02 1.8043e-02 -6.0000e+00 3.4727e-01 1.8362e-02 8.3151e-03 8.7087e-03 -6.0000e+00 1.4890e-01 8.6786e-05 -5.6794e-04 2.0160e-04 6.9413e-05 -6.0000e+00 1.0096e-02 8.8463e-04 0.0000e+00 12 8 8 10 0 0 28.53 17.73 0.56 0.00088 -0.00338 10 10 4 8 0 2841.350 15.00 17.73 -4.63 21.38 21.17 22.6 894.28 -198394 900000 -46118 900000 -15870 900000 -109733 -130946 -120239 40694 900000 -3485 265313 -70194 -16177 -21544 900000 -43793 131538 -37647 900000 -26897 67335 573 -8477 -14759 -13176 17493 5595 -2854 -29149 10187 22452 9959 -6058 -2811 -23652 14285 -2559 1877 8651 3519 12120 -6204 12834 -4965 4199 -2956 11878 -6875 8998 -3411 2680 51 3249 1940 2646 3749 -3575 -1038 -2503 7580 -2108 6112 -3571 1595 -1028 170 699 -878 2945 -2150 1312 -61 6810 -3067 1533 -2641 469 61 794 -827 -2889 -1364 -2470 1287 -110 370 -636 2249 -1307 2353 -229 -2015 -784 1671 107 655 291 451 178 -1243 706 -656 1368 -1940 232 -1176 -248 -1047 -11 -315 -1092 -260 -88 1115 77 1704 -564 1319 -140 13 624 375 -1560 763 583 332 680 -219 762 508 -53 -749 -485 -473 335 116 40 -396 257 -336 251 -3645 900000 -331 900000 -114 900000 -1066 -1757 -1641 292 900000 -25 1902 -1218 -217 -364 900000 -1175 943 -1106 900000 -728 756 14 -237 -466 -425 406 142 -84 -1301 380 869 486 -321 -143 -1576 785 -197 168 826 380 1276 -812 1407 -670 529 -413 1497 -1105 1372 -662 534 11 749 469 656 918 -912 -253 -635 1906 -644 1961 -1347 553 -359 60 264 -392 1411 -1102 666 -30 2829 -1252 569 -1018 194 29 441 -520 -2043 -998 -1895 1018 -93 319 -557 1848 -1062 1712 -162 -1472 -628 1468 110 752 358 555 211 -1354 695 -651 1445 -2167 267 -1465 -323 -1493 -17 -513 -1790 -417 -133 1615 113 2561 -896 2153 -230 21 945 563 -2278 1051 793 465 1041 -370 1361 969 -103 -1550 -1046 -1050 752 264 93 -895 542 -688 491 SS 20250218T135458.6Z 9180.579845 250 1 46.57 2 73.06 124.53 85.60 241.01 0.00 1 0.00 1 0 17 3.100e-01 7.701e-03 2.319e-01 4.547e-03 5.812095e-01 2.320300e-03 6.704068e-03 -6.000000e+00 1.719326e-01 224.81 -2.00 3.55 -2.00 320.41 0.00e+00 2.480943e-03 8.344235e-04 8.201753e-04 -6.000000e+00 7.445423e-03 272.68 -2.00 20.00 -2.00 319.93 0.00e+00 3.382 0.001 302.00 328.00 3 4.2943e+00 6.8264e-03 4.5141e-02 -6.0000e+00 4.2597e-01 2.5275e-02 8.7249e-03 3.1403e-02 -6.0000e+00 4.6454e-01 -1.8535e-02 8.9835e-03 1.5985e-02 -6.0000e+00 2.7590e-01 -3.8641e-03 4.5884e-03 5.9027e-03 -6.0000e+00 1.1796e-01 1.3102e-04 -5.7960e-04 1.2355e-04 5.3885e-05 -6.0000e+00 7.8900e-03 1.7277e-03 0.0000e+00 11 8 0 10 0 0 61.93 17.73 0.34 0.00173 -0.00263 20 6 1 8 0 2328.230 15.00 17.73 -3.80 21.38 21.17 22.7 899.91 -63008 126267 900000 -55503 1587 -49804 239205 -126067 3638 -5861 111524 21064 -28129 19398 -8138 10779 111880 4719 19974 2178 23692 25024 -33894 912 -15060 -8411 2924 19731 -3112 -11637 -2532 1652 3063 -7924 -4014 -11293 1718 -1195 -4400 -8356 7472 -3018 2889 -3389 3839 -1183 815 8794 2938 1987 74 1831 -6241 7354 1987 -145 -630 122 -903 -2879 825 1632 1595 2557 -44 -1017 738 -57 -374 -1256 2840 -184 156 1821 896 955 -640 -432 -4668 373 -772 83 -2776 -2015 -1318 458 682 -488 -142 507 879 935 1282 1246 1067 -214 925 471 732 -473 227 -574 -330 106 -214 -785 -1092 -562 -1059 547 -26 419 -1079 -405 413 1130 -7 753 214 -159 -132 -430 776 -377 -671 629 532 888 462 -85 246 17 -495 -24 -365 -140 -76 334 -63 89 -62 -30 -61 -466 560 900000 -500 8 -381 1061 -2441 23 -45 494 138 -378 208 -140 186 850 108 428 59 539 578 -1413 30 -617 -343 111 633 -116 -497 -117 86 183 -586 -272 -793 117 -98 -456 -1064 924 -445 424 -546 580 -193 132 1393 496 355 15 406 -1635 1834 557 -43 -194 37 -270 -861 243 521 577 1004 -19 -422 302 -24 -164 -644 1558 -106 92 1000 456 446 -279 -186 -2291 199 -486 57 -2173 -1644 -1107 405 631 -471 -138 470 752 763 987 963 911 -207 984 562 953 -621 278 -659 -350 111 -239 -930 -1361 -723 -1480 812 -42 706 -1792 -657 640 1639 -10 1142 337 -265 -218 -687 1221 -578 -1008 898 727 1237 706 -142 434 32 -949 -49 -768 -310 -167 745 -142 197 -129 -60 -121 SS 20250218T142445.7Z 9180.600528 260 1 46.52 2 68.74 130.76 90.41 246.00 0.00 1 0.00 1 0 17 8.197e-02 5.580e-03 4.595e-02 2.826e-03 4.683874e-01 1.407601e-03 5.544604e-03 -6.000000e+00 4.547003e-02 224.81 -2.00 3.55 -2.00 319.56 0.00e+00 1.651730e-03 3.857099e-04 5.000004e-04 -6.000000e+00 1.945214e-03 272.68 -2.00 20.00 -2.00 319.05 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