File name: Pandora159s1_Wakkerstroom_20200719_L2Fit_fout2c6d20191220p1-8.txt File generation date: 20240926T160817.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 Local principal investigator: B. Scholes Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 159 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora159_OF_v5d20191004.txt Instrument calibration file used: Pandora159s1_CF_v6d20191220.txt Level 1 file used: Pandora159s1_Wakkerstroom_20200719_L1_smca1c6d20191220p1-8.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: 20200719 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: Update session 4 based on session2 for SO2 First and last pixel inside fitting window: 222 364 Nominal wavelengths inside fitting window [nm]: 305.0490 305.1898 305.3306 305.4713 305.6121 305.7529 305.8936 306.0343 306.1750 306.3157 306.4564 306.5971 306.7378 306.8785 307.0191 307.1597 307.3004 307.4410 307.5816 307.7222 307.8628 308.0033 308.1439 308.2845 308.4250 308.5655 308.7060 308.8465 308.9870 309.1275 309.2680 309.4084 309.5489 309.6893 309.8297 309.9701 310.1105 310.2509 310.3913 310.5317 310.6720 310.8124 310.9527 311.0930 311.2333 311.3736 311.5139 311.6542 311.7944 311.9347 312.0749 312.2152 312.3554 312.4956 312.6358 312.7760 312.9161 313.0563 313.1964 313.3366 313.4767 313.6168 313.7569 313.8970 314.0371 314.1771 314.3172 314.4572 314.5973 314.7373 314.8773 315.0173 315.1573 315.2973 315.4372 315.5772 315.7171 315.8570 315.9969 316.1369 316.2767 316.4166 316.5565 316.6964 316.8362 316.9760 317.1159 317.2557 317.3955 317.5352 317.6750 317.8148 317.9545 318.0943 318.2340 318.3737 318.5134 318.6531 318.7928 318.9325 319.0721 319.2118 319.3514 319.4910 319.6307 319.7703 319.9098 320.0494 320.1890 320.3285 320.4681 320.6076 320.7471 320.8866 321.0261 321.1656 321.3051 321.4445 321.5840 321.7234 321.8628 322.0023 322.1417 322.2810 322.4204 322.5598 322.6991 322.8385 322.9778 323.1171 323.2564 323.3957 323.5350 323.6743 323.8135 323.9528 324.0920 324.2312 324.3704 324.5096 324.6488 324.7880 324.9272 --------------------------------------------------------------------------------------- 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 20200719T051354.6Z 7505.217993 7 1 49.22 2 85.39 63.77 73.22 49.76 0.00 1 0.00 1 0 25 7.362e-01 7.315e-02 5.765e-01 7.022e-02 1.015762e+00 4.226015e-02 9.890840e-03 -6.000000e+00 4.239868e-01 225.62 -2.00 3.06 -2.00 322.15 0.00e+00 1.190252e-02 1.838348e-02 8.525857e-03 -6.000000e+00 2.453358e-02 276.75 -2.00 20.00 -2.00 321.70 0.00e+00 10.471 0.007 302.00 328.00 3 1.0270e+00 1.4541e-01 1.1317e-01 -6.0000e+00 1.0512e+00 1.9513e+00 1.6591e-01 9.1185e-02 -6.0000e+00 1.1459e+00 -2.0485e+00 1.0827e-01 2.5270e-02 -6.0000e+00 6.7567e-01 7.3714e-01 6.0918e-02 1.5953e-02 -6.0000e+00 2.8996e-01 9.9660e-06 -1.7198e-03 1.8517e-03 1.1430e-04 -6.0000e+00 2.0491e-02 -2.8833e-04 0.0000e+00 12 8 8 10 0 0 90.16 13.66 0.31 -0.00029 -0.01321 16 3 4 8 0 3075.220 14.73 13.66 -4.43 17.10 17.20 12.1 799.10 62954 -8267 900000 -36247 900000 -26104 -91094 239492 900000 900000 -44316 900000 900000 900000 900000 209953 7135 -30051 4742 145457 9492 900000 4354 900000 -23324 900000 900000 -79367 -40578 -76838 -73707 146932 109088 -48574 -87022 -25991 -76781 -86954 337802 900000 151334 89976 -67635 183158 151868 32760 49100 382863 8868 -24135 12388 130055 10820 65069 114074 53564 900000 65332 900000 4068 22901 -46675 -32308 4441 90916 23799 -24606 61863 10519 49173 11244 900000 19549 33008 -14258 37233 56737 -3690 -16712 -7519 43798 17999 35872 3498 32697 -1656 13142 -2176 28047 1616 -4715 138 -33320 -6659 6963 9384 3645 -4241 -5161 -1109 4438 -2714 3850 -7827 6052 -3398 -9851 -3851 8730 -9026 6929 -1458 8345 -3327 1226 -5110 892 1265 -5942 4208 -11707 4982 -1453 7680 10112 7276 1203 5662 -3826 1170 -429 -3148 3062 3854 -956 -3710 2705 890 410 468 -2 -451 -3206 4297 -571 900000 -2802 900000 -1782 -7250 16348 900000 900000 -3025 900000 900000 900000 900000 14332 487 -3027 345 9929 648 900000 297 900000 -1592 900000 900000 -7178 -2770 -6979 -7903 10030 7447 -5837 -13820 -2090 -9898 -13428 23059 900000 10330 6142 -12261 12503 10367 2236 3352 26135 803 -3164 1254 8878 1308 4985 7787 4701 900000 4831 900000 466 2168 -9172 -6302 700 6865 3409 -5573 6399 1929 7045 2506 900000 3964 5367 -3195 4492 5267 -628 -3718 -1856 7951 4816 8975 1264 9344 -685 4876 -954 9118 649 -1874 49 -16092 -2653 2816 4454 2180 -3212 -4432 -942 3394 -1974 2301 -4988 3550 -2322 -7534 -3011 6792 -9756 7438 -1887 10303 -4606 1582 -6812 1131 1674 -8885 5884 -18562 6315 -1856 8732 10954 7921 1348 6425 -5572 1927 -824 -6832 6735 9085 -2540 -10708 7457 2527 1163 1266 -6 -1038 -7115 SS 20200719T052812.3Z 7505.227920 10 1 50.52 2 82.56 61.98 70.92 47.49 0.00 1 0.00 1 0 25 6.036e-01 7.109e-03 2.651e-01 3.803e-03 7.580135e-01 2.118714e-03 7.328265e-03 -6.000000e+00 3.422043e-01 225.62 -2.00 3.06 -2.00 321.84 0.00e+00 5.767782e-03 1.131586e-03 4.109926e-03 -6.000000e+00 1.498380e-02 276.75 -2.00 20.00 -2.00 321.39 0.00e+00 7.174 0.002 302.00 328.00 3 4.5824e-01 7.6792e-03 7.3320e-02 -6.0000e+00 8.4992e-01 9.8376e-02 1.1943e-02 5.2688e-02 -6.0000e+00 9.2534e-01 -1.0318e-01 1.3749e-02 2.1955e-02 -6.0000e+00 5.4809e-01 3.2984e-02 6.3333e-03 9.0318e-03 -6.0000e+00 2.3289e-01 4.6469e-04 -1.2575e-03 1.0786e-04 8.4558e-05 -6.0000e+00 1.6201e-02 9.2054e-04 0.0000e+00 11 8 0 10 0 0 54.80 16.00 0.23 0.00092 -0.00853 189 41 4 8 0 261.720 14.91 16.00 -1.44 19.04 19.04 11.4 812.89 -219585 -205758 -224924 -206685 -115209 -209328 -139604 -232055 900000 -225811 -128848 -178317 -123239 -136508 -99596 -33751 -75909 -73191 -62504 -70804 -48031 -57288 -20179 -44271 -14496 -11739 -40053 -28968 4145 -11316 -25172 12636 9754 -18322 -633 -21502 9393 2808 267 -1505 6256 -8039 706 942 360 -2148 -4363 698 -1524 156 6593 12030 4428 4763 8190 3818 2268 4962 1418 -907 2162 1042 1670 3402 2742 2687 932 2277 4682 980 -345 -184 1272 1176 -180 1717 1064 -83 2269 664 119 -258 -2687 -1570 -1045 -1555 -506 -1142 -387 -254 1256 1106 -84 1867 554 525 502 553 -658 -130 -54 -297 1320 566 -1461 -856 -1334 -1171 -46 -370 -511 -438 96 122 571 1460 695 275 86 -685 -874 27 198 -120 227 53 614 1612 422 182 246 49 334 581 -488 -394 -51 -137 -444 -189 155 -20 515 -962 -971 -1440 -1115 -427 -1164 -518 -1799 900000 -2055 -525 -1262 -731 -1150 -849 -188 -691 -740 -632 -835 -516 -680 -172 -525 -140 -118 -549 -354 37 -130 -411 178 155 -426 -12 -500 174 66 8 -56 247 -401 35 48 19 -120 -260 42 -100 11 491 969 430 507 906 463 290 619 178 -114 272 146 270 625 507 544 191 479 976 247 -98 -55 374 327 -46 422 245 -20 595 196 42 -106 -1264 -780 -550 -877 -298 -700 -236 -150 683 565 -42 942 320 356 400 512 -686 -138 -54 -266 1044 442 -1244 -771 -1272 -1196 -51 -470 -734 -680 152 188 835 2027 971 403 133 -1119 -1416 42 291 -171 311 70 780 2094 631 314 474 103 734 1359 -1239 -1057 -140 -382 -1241 -508 389 -46 1144 SS 20200719T053433.8Z 7505.232336 13 1 51.68 2 81.32 61.15 69.93 46.44 0.00 1 0.00 1 0 25 3.773e-01 6.864e-03 1.812e-01 2.032e-03 6.824329e-01 1.101487e-03 6.748875e-03 -6.000000e+00 2.131240e-01 225.62 -2.00 3.06 -2.00 321.39 0.00e+00 3.570896e-03 5.329430e-04 2.859227e-03 -6.000000e+00 9.267005e-03 276.75 -2.00 20.00 -2.00 320.91 0.00e+00 6.269 0.001 302.00 328.00 3 2.7527e-01 3.7267e-03 6.2262e-02 -6.0000e+00 5.2811e-01 6.4079e-02 5.3733e-03 4.0203e-02 -6.0000e+00 5.7461e-01 -4.6870e-02 5.9549e-03 1.7950e-02 -6.0000e+00 3.4168e-01 7.4473e-03 2.8241e-03 7.1188e-03 -6.0000e+00 1.4553e-01 1.2014e-03 -9.8670e-04 5.7440e-05 6.6711e-05 -6.0000e+00 1.0071e-02 1.3562e-03 0.0000e+00 11 8 0 10 0 0 47.91 16.60 0.31 0.00136 -0.00606 327 70 2 8 0 151.090 15.01 16.60 -0.05 19.44 19.54 11.4 821.06 -159621 -115002 -89445 -166572 -15141 -200695 -32152 -148860 -73579 -138325 -14549 -100255 -49337 -41110 -50478 -18259 -53059 -30485 -49855 -1938 -48322 1005 -19781 -3314 -20005 2925 -23280 -24566 -27848 -34563 -4494 -15985 13392 -7387 1022 -10495 9630 -6750 -3888 -6112 -4038 -2844 -2286 -347 -885 4702 -2158 5448 974 5411 1855 3684 2128 4143 3015 1026 2116 -169 1948 -298 4426 627 3110 887 2298 2931 2677 1913 1534 964 -885 321 -860 1437 -1302 1081 49 1068 833 -122 -632 -627 -1384 -1655 -1103 -1646 14 -879 153 -433 952 511 985 1426 869 1089 358 752 -651 -32 -410 289 870 993 -1699 -1089 -941 -915 -216 -269 -221 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