File name: Pandora159s1_Wakkerstroom_20210702_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T031152.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: B. Scholes Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 159 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora159_OF_v5d20191004.txt Instrument calibration file used: Pandora159s1_CF_v3d20201207.txt Level 1 file used: Pandora159s1_Wakkerstroom_20210702_L1_smca1c3d20201207p1-8.txt Full location name: Global Change Institute, University of Witwatersrand field site in Wakkerstroom Short location name: Wakkerstroom Country of location: South Africa Location latitude [deg]: -27.3493 Location longitude [deg]: 30.1438 Location altitude [m]: 1760 Local noon date: 20210702 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: None First and last pixel inside fitting window: 222 364 Nominal wavelengths inside fitting window [nm]: 305.0731 305.2139 305.3547 305.4955 305.6363 305.7770 305.9178 306.0585 306.1992 306.3399 306.4806 306.6213 306.7620 306.9026 307.0433 307.1839 307.3246 307.4652 307.6058 307.7464 307.8869 308.0275 308.1681 308.3086 308.4492 308.5897 308.7302 308.8707 309.0112 309.1517 309.2921 309.4326 309.5730 309.7135 309.8539 309.9943 310.1347 310.2751 310.4155 310.5558 310.6962 310.8365 310.9769 311.1172 311.2575 311.3978 311.5381 311.6784 311.8186 311.9589 312.0991 312.2393 312.3795 312.5198 312.6599 312.8001 312.9403 313.0805 313.2206 313.3607 313.5009 313.6410 313.7811 313.9212 314.0612 314.2013 314.3414 314.4814 314.6214 314.7615 314.9015 315.0415 315.1814 315.3214 315.4614 315.6013 315.7413 315.8812 316.0211 316.1610 316.3009 316.4408 316.5807 316.7205 316.8604 317.0002 317.1400 317.2798 317.4196 317.5594 317.6992 317.8389 317.9787 318.1184 318.2582 318.3979 318.5376 318.6773 318.8170 318.9566 319.0963 319.2359 319.3756 319.5152 319.6548 319.7944 319.9340 320.0736 320.2131 320.3527 320.4922 320.6318 320.7713 320.9108 321.0503 321.1898 321.3292 321.4687 321.6081 321.7476 321.8870 322.0264 322.1658 322.3052 322.4446 322.5839 322.7233 322.8626 323.0019 323.1413 323.2806 323.4199 323.5591 323.6984 323.8377 323.9769 324.1162 324.2554 324.3946 324.5338 324.6730 324.8121 324.9513 --------------------------------------------------------------------------------------- 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: 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 77: 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 78: 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 79: 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 80: 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 81: 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 82: Atmospheric variability [%], 999=no atmospheric variability was determined Column 83: Wavelength effective temperature [°C], 999=no effective temperature given Column 84: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 85: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 86: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 87: Number of bright count cycles Column 88: Number of dark count cycles Column 89: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 90: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 91: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 92: Integration time [ms] Column 93: Spectrometer control temperature [°C], 999=no temperature signal Column 94: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 95: Temperature in head sensor [°C], 999=no temperature signal Column 96: Temperature at electronics board 1 [°C], 999=no temperature signal Column 97: Temperature at electronics board 2 [°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 20210702T051656.0Z 7853.220093 201 1 49.19 2 85.54 61.19 32.89 331.24 0.00 1 0.00 1 0 25 5.529e-01 3.356e-02 5.045e-01 3.083e-02 1.044628e+00 1.972338e-02 1.120287e-02 -6.000000e+00 3.364292e-01 225.11 -2.00 3.06 -2.00 322.61 0.00e+00 -6.675072e-03 1.168696e-02 1.401013e-02 -6.000000e+00 1.824072e-02 277.01 -2.00 20.00 -2.00 322.20 0.00e+00 10.724 0.007 302.00 328.00 3 1.3468e-01 8.1116e-02 1.2315e-01 -6.0000e+00 8.3578e-01 1.3411e+00 1.0862e-01 1.0303e-01 -6.0000e+00 9.2066e-01 -1.6977e+00 9.6065e-02 5.1458e-02 -6.0000e+00 5.3778e-01 6.6034e-01 4.5660e-02 1.3621e-02 -6.0000e+00 2.3378e-01 2.7179e-05 -3.2869e-03 8.9359e-04 3.7138e-04 -6.0000e+00 1.6652e-02 4.4454e-03 12 8 8 10 0 0 49.89 18.32 0.86 0.00445 -0.02025 44 9 4 8 0 1117.680 14.99 18.32 1.36 20.87 20.87 15.9 803.31 900000 900000 -26010 900000 900000 900000 900000 900000 20232 900000 25503 900000 -117158 142779 -18317 -130041 900000 76772 900000 -71660 900000 10933 11994 -88918 900000 12115 186430 900000 98509 33862 900000 900000 900000 -72821 900000 900000 38022 900000 -37161 -86566 118794 35895 54428 120322 900000 900000 900000 -289 900000 -30281 63575 85231 325136 503 56866 104952 83024 3926 52988 900000 76 139 -8179 35984 11759 114528 43143 21020 61799 12503 56614 13807 41062 25050 5727 -13557 -17640 20463 -2649 21642 31032 4220 13577 -1008 -1549 3596 1723 4399 -8619 65 -7525 5783 3173 -5011 -2295 -5085 888 -5856 1214 -1808 3215 -6746 -341 -6913 -5638 -4112 34438 -3047 -1209 -3602 -4074 2405 -1624 -266 -710 959 -384 -531 -1794 -2110 -229 3264 4486 3523 519 -861 2094 -1012 663 -1183 569 -229 1517 796 1939 719 -898 -1132 -1065 798 -585 327 -1047 900000 900000 -778 900000 900000 900000 900000 900000 605 900000 763 900000 -3503 4269 -548 -7423 900000 2296 900000 -2532 900000 327 359 -3626 900000 362 5574 900000 2946 1013 900000 900000 900000 -3959 900000 900000 1137 900000 -1818 -8236 3552 1171 1627 3598 900000 900000 900000 -13 900000 -2058 2091 2549 9722 38 2891 3452 3476 320 2693 900000 6 12 -778 2797 1266 4452 3483 2263 4989 1733 6094 2139 5157 3371 822 -2067 -2637 2203 -420 3300 5196 987 3248 -299 -488 1134 576 1459 -3210 21 -2475 1588 897 -1676 -880 -2419 476 -3948 855 -1342 2133 -4364 -183 -3852 -3311 -2526 16785 -2145 -953 -3437 -4562 2811 -2074 -336 -880 1140 -468 -680 -2453 -2966 -305 3930 5073 3927 581 -953 2197 -1174 899 -1949 1055 -473 3327 1909 4971 1971 -2544 -3237 -3014 2101 -1430 722 -2213 SS 20210702T053111.4Z 7853.229994 204 1 50.90 2 82.79 59.39 34.57 325.68 0.00 1 0.00 1 0 25 6.216e-01 9.255e-03 2.843e-01 3.361e-03 7.914811e-01 1.826678e-03 7.550775e-03 -6.000000e+00 3.491889e-01 225.11 -2.00 3.06 -2.00 321.83 0.00e+00 3.534286e-03 1.007387e-03 3.515949e-03 -6.000000e+00 1.527491e-02 277.01 -2.00 20.00 -2.00 321.38 0.00e+00 7.368 0.002 302.00 328.00 3 2.2454e-02 6.6890e-03 7.3456e-02 -6.0000e+00 8.6409e-01 1.1542e-01 1.0815e-02 4.8997e-02 -6.0000e+00 9.4177e-01 -1.2338e-01 1.2509e-02 2.2841e-02 -6.0000e+00 5.6024e-01 4.0273e-02 5.6757e-03 7.7003e-03 -6.0000e+00 2.3792e-01 6.0442e-04 -1.0943e-03 9.1294e-05 8.3544e-05 -6.0000e+00 1.6610e-02 4.2574e-03 11 8 0 10 0 0 47.96 18.31 0.31 0.00426 -0.00397 256 55 2 8 0 192.780 14.99 18.31 3.24 20.87 20.87 15.9 813.26 -281282 -63205 -151903 -258734 -90342 -222375 -120808 -279271 -107681 -192556 -125114 -202421 -67148 -156803 -98357 -67045 -95180 -16029 -92588 -40116 -104237 -22604 -58454 -22972 -55070 -6633 -46094 -57193 -45197 -45151 -33330 -39565 -8667 -15483 457 -26877 -16160 -23790 1665 -8049 -8786 -12376 -10083 5044 -3813 15943 -3638 5501 -3867 9454 4105 11974 5429 10126 4916 5380 6299 1932 7597 2083 6626 1370 8777 4418 6189 4022 3556 1952 3113 3064 1028 743 754 28 -408 3019 -2081 2273 1451 1240 -232 -1422 -2146 -1874 -1394 -761 890 -590 -50 -72 1442 575 1202 933 1304 -256 184 562 -1090 395 -293 132 552 1028 -1803 -862 -5001 -475 -580 39 -6 -385 150 159 695 958 900 353 -263 -900 -832 344 -62 278 374 611 1501 1492 290 453 -40 374 44 185 -307 -573 238 -177 -545 -185 161 85 289 -2028 -207 -498 -1951 -296 -1093 -396 -3112 -353 -1136 -410 -1725 -220 -1542 -709 -440 -967 -84 -1153 -316 -1606 -156 -613 -188 -686 -54 -574 -787 -563 -636 -524 -830 -159 -330 8 -626 -376 -725 49 -317 -361 -575 -487 216 -183 716 -189 277 -230 544 284 874 472 926 508 584 700 223 804 228 721 176 1219 737 1090 723 646 381 678 776 293 221 221 8 -102 655 -451 492 366 381 -86 -616 -1036 -961 -759 -438 529 -366 -30 -42 781 296 603 496 794 -187 157 553 -1196 430 -299 119 448 831 -1611 -808 -5159 -505 -689 53 -9 -578 228 235 1061 1406 1334 552 -437 -1425 -1403 546 -94 409 532 837 1977 2082 473 848 -77 768 96 432 -773 -1522 639 -483 -1487 -480 389 191 623 SS 20210702T053725.8Z 7853.234327 207 1 51.05 2 81.60 58.58 35.38 323.41 0.00 1 0.00 1 0 25 4.782e-01 6.915e-03 1.481e-01 1.966e-03 7.124593e-01 1.055133e-03 6.904957e-03 -6.000000e+00 2.694242e-01 225.11 -2.00 3.06 -2.00 321.52 0.00e+00 3.972820e-03 5.335406e-04 2.667197e-03 -6.000000e+00 1.191474e-02 277.01 -2.00 20.00 -2.00 321.05 0.00e+00 6.456 0.002 302.00 328.00 3 -5.9377e-04 3.6569e-03 6.4100e-02 -6.0000e+00 6.6827e-01 7.5896e-02 5.4411e-03 4.1422e-02 -6.0000e+00 7.2884e-01 -5.9830e-02 6.1010e-03 1.8653e-02 -6.0000e+00 4.3192e-01 1.2838e-02 2.8573e-03 7.2230e-03 -6.0000e+00 1.8306e-01 1.3322e-03 -9.8491e-04 5.4679e-05 7.2647e-05 -6.0000e+00 1.2822e-02 4.0423e-03 11 8 0 10 0 0 42.10 18.31 0.28 0.00404 -0.00336 388 83 2 8 0 126.960 14.99 18.31 4.07 20.87 20.87 16.1 818.35 -215632 -130697 -210594 -152208 -134949 -184575 -183266 -128216 900000 -156691 32247 -135064 -78905 -66474 -54781 -48769 -66785 -39718 -33440 -6278 -32882 5762 -29192 -16544 -23306 -18342 -35797 -30002 -39812 -23104 -13756 187 -297 -11578 4134 -11727 -2433 -6900 990 -3399 -3423 -3539 -3150 -1617 -2301 -873 193 4410 1269 5751 2972 4081 3183 4031 2875 2022 749 635 938 1309 4394 1728 5551 1401 2525 2026 2812 2071 3135 807 -2 228 -770 -111 -803 859 91 1327 272 -32 -745 -771 -2187 -1055 -1143 -1190 -419 -494 -167 -128 765 669 1115 1013 957 684 796 208 -552 -197 -232 266 941 439 -1663 -994 -1341 -611 -249 -215 -406 -336 262 272 723 1197 896 350 -54 -911 -716 -252 -45 -313 448 309 1317 1751 -30 190 64 232 225 419 -397 -576 -14 -220 -546 -106 209 76 475 -1541 -478 -1872 -743 -517 -1158 -1245 -581 900000 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