File name: Pandora159s1_Wakkerstroom_20200718_L2Fit_fout2c6d20191220p1-8.txt File generation date: 20240926T160827.3Z 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_20200718_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: 20200718 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 20200718T051419.8Z 7504.218285 7 1 49.65 2 85.39 63.55 63.96 40.98 0.00 1 0.00 1 0 25 6.177e-01 3.344e-02 5.351e-01 3.589e-02 9.770395e-01 2.159110e-02 9.469335e-03 -6.000000e+00 3.613730e-01 225.60 -2.00 3.06 -2.00 322.46 0.00e+00 7.197206e-03 1.135755e-02 3.047048e-03 -6.000000e+00 1.739092e-02 276.76 -2.00 20.00 -2.00 322.04 0.00e+00 10.468 0.007 302.00 328.00 3 6.0017e-01 8.2099e-02 9.8524e-02 -6.0000e+00 8.9590e-01 1.4551e+00 1.0035e-01 5.4350e-02 -6.0000e+00 9.7838e-01 -1.8798e+00 7.5088e-02 2.4897e-02 -6.0000e+00 5.8100e-01 7.4939e-01 3.8495e-02 8.4975e-03 -6.0000e+00 2.4942e-01 2.1031e-05 -3.5970e-03 1.0017e-03 1.1728e-04 -6.0000e+00 1.8273e-02 -1.6460e-03 0.0000e+00 12 8 8 10 0 0 57.04 13.25 0.20 -0.00165 -0.02868 31 7 4 8 0 1601.270 15.09 13.25 -5.46 16.78 16.89 12.0 792.88 7694 -68600 24796 900000 900000 -118634 -67988 -103226 -62293 84154 900000 -109476 -23804 -42299 214988 -15102 900000 -20988 5700 146639 -30725 900000 -56989 184737 -62806 125919 -33187 900000 -7380 900000 17961 900000 104796 43700 900000 900000 160921 -37132 900000 -53132 141273 35658 101788 50409 212464 192386 900000 900000 6182 59516 7896 17556 9144 53226 -1678 234348 -9867 63626 44620 23424 107154 42245 80035 56764 129598 16763 53144 7605 43218 29500 8607 44538 30653 43879 16420 13882 -9257 36276 -13708 -2328 8802 1848 7698 3884 4766 7745 -4434 -8728 -2079 3950 -1178 -6516 2531 3438 -9387 5205 -4403 -1349 -9230 2359 -4298 -5614 4247 -1764 -8160 -6322 -2329 -4503 1776 -486 809 -1076 1494 -3059 -1271 -356 -24 -299 -1144 919 3097 4336 1127 3017 2001 1446 -1128 2090 -18 -1708 275 1309 1971 -206 1937 -670 84 -1227 -211 -559 923 -970 -1181 269 -4029 866 900000 900000 -6886 -2374 -4701 -2175 2938 900000 -5108 -831 -1595 7506 -628 900000 -1051 226 5120 -1566 900000 -3164 6450 -3671 4396 -1363 900000 -258 900000 627 900000 3659 1526 900000 900000 5619 -2320 900000 -5063 4933 1679 3554 2078 7418 6717 900000 900000 401 2484 587 1320 807 3325 -183 8182 -1190 3726 2937 1770 3741 2794 4205 4273 5387 2046 4592 1043 4629 4097 1601 6117 4728 5517 2398 1832 -1402 3649 -2516 -465 1895 496 2187 1228 1569 2622 -1757 -3712 -829 1438 -423 -2333 814 1154 -4097 2366 -2613 -916 -7692 1832 -3426 -4070 2467 -1033 -5370 -4367 -1634 -3486 1450 -473 904 -1368 1952 -4216 -1678 -453 -31 -400 -1633 1339 4360 5697 1453 3713 2434 1725 -1346 2506 -25 -2926 528 2744 4426 -507 5049 -1896 241 -3624 -616 -1573 2374 -2332 -2663 SS 20200718T053040.6Z 7504.229637 10 1 51.23 2 82.16 61.50 61.74 37.72 0.00 1 0.00 1 0 25 5.175e-01 7.574e-03 2.411e-01 3.130e-03 7.384065e-01 1.706168e-03 7.182004e-03 -6.000000e+00 2.924245e-01 225.60 -2.00 3.06 -2.00 321.63 0.00e+00 2.398716e-03 8.891687e-04 3.143673e-03 -6.000000e+00 1.326223e-02 276.76 -2.00 20.00 -2.00 321.18 0.00e+00 6.859 0.002 302.00 328.00 3 4.2398e-01 6.0523e-03 6.7942e-02 -6.0000e+00 7.2446e-01 8.0087e-02 9.3122e-03 4.3891e-02 -6.0000e+00 7.8862e-01 -7.1198e-02 1.0613e-02 2.0703e-02 -6.0000e+00 4.6885e-01 1.7150e-02 4.9060e-03 6.8362e-03 -6.0000e+00 2.0156e-01 6.2737e-04 -9.0599e-04 8.7193e-05 8.1667e-05 -6.0000e+00 1.3924e-02 8.3396e-04 0.0000e+00 11 8 0 10 0 0 0.30 16.00 0.23 0.00083 -0.00597 224 48 2 8 0 220.800 14.92 16.00 -1.95 19.04 19.04 11.3 810.34 900000 -201795 39043 -155014 102326 -208321 -233933 -158683 -224439 39879 -203710 900000 -151670 7401 -95710 -76884 -45320 -36138 687 -39856 -475 -76133 -5166 -75386 -77 -46083 -12965 -47483 15308 -43791 -12363 7792 -24507 -2167 -37183 17771 -15019 21789 -4705 10151 3971 5863 -3252 5026 6049 -1741 5692 1342 7772 -3640 11295 1316 9094 2752 3814 3426 661 578 365 2440 1705 4986 -1448 6335 -479 5758 2276 3441 1150 2519 852 474 766 -989 1647 -511 1110 -72 384 -1175 -390 -429 -1777 -1436 -1214 -660 -1273 -348 -483 645 137 1499 -683 1073 1369 245 902 849 -323 -501 206 -564 973 666 -1356 -1483 -869 -1030 -377 20 -535 -258 -26 651 47 1154 653 413 -253 -600 -857 -192 52 -153 768 319 891 1575 380 -229 561 9 104 291 -310 -562 85 187 -636 89 -176 63 308 900000 -1120 119 -602 312 -1271 -2012 -748 -2366 122 -2091 900000 -1388 23 -876 -725 -365 -301 4 -409 -3 -1183 -42 -1359 -1 -741 -155 -790 149 -765 -192 123 -639 -50 -1196 325 -417 502 -176 400 192 304 -197 290 352 -113 355 92 532 -304 915 123 879 312 461 438 90 79 49 313 225 702 -251 1166 -102 1155 469 728 276 693 266 157 251 -312 462 -131 261 -17 104 -386 -151 -193 -901 -775 -697 -402 -822 -230 -320 408 82 825 -370 589 844 179 765 833 -356 -562 217 -535 817 552 -1228 -1430 -877 -1115 -446 26 -809 -420 -43 1043 73 1672 949 627 -410 -1018 -1444 -308 79 -227 1089 438 1172 2124 589 -410 1109 18 217 644 -740 -1424 219 489 -1680 224 -419 140 703 SS 20200718T053701.9Z 7504.234050 13 1 51.83 2 80.93 60.67 60.92 36.39 0.00 1 0.00 1 0 25 3.408e-01 6.988e-03 1.501e-01 1.920e-03 6.608039e-01 1.024505e-03 6.535033e-03 -6.000000e+00 1.925075e-01 225.60 -2.00 3.06 -2.00 321.29 0.00e+00 3.227250e-03 4.756988e-04 2.145509e-03 -6.000000e+00 8.371464e-03 276.76 -2.00 20.00 -2.00 320.79 0.00e+00 6.028 0.001 302.00 328.00 3 3.9227e-01 3.3916e-03 5.9106e-02 -6.0000e+00 4.7699e-01 6.7173e-02 4.7771e-03 3.6354e-02 -6.0000e+00 5.1900e-01 -5.3935e-02 5.2110e-03 1.6939e-02 -6.0000e+00 3.0862e-01 1.0735e-02 2.5005e-03 6.4267e-03 -6.0000e+00 1.3146e-01 1.3142e-03 -9.8083e-04 5.4046e-05 6.5904e-05 -6.0000e+00 9.0973e-03 1.2268e-03 0.0000e+00 11 8 0 10 0 0 32.66 16.50 0.25 0.00123 -0.00614 329 71 2 8 0 149.760 15.09 16.50 -0.75 19.44 19.44 11.3 817.01 -177999 -38000 -135794 -47952 -118509 -124159 -6893 -121976 -43898 -149193 -28610 -129016 -1096 -69587 -11053 -51581 -29439 -37895 -23870 -19669 -27751 -6812 -29854 5165 -45151 -2977 -32387 3094 -31927 -5688 -18220 -3210 -608 -14537 3092 -16009 974 -6031 5316 -8052 965 -6988 1079 -1420 450 2242 1358 5236 -1890 7586 1231 5854 2758 4173 1875 2178 1320 -563 927 -1385 3087 589 3871 525 2200 901 3758 851 2593 824 -233 317 -683 378 -1360 985 -600 1065 -677 324 -392 -462 -1987 -1409 -945 -1180 -204 -562 412 -340 983 223 1509 726 1329 527 591 485 -867 -335 -220 203 530 1119 -1455 -996 -1161 -757 -241 -282 -315 -538 129 97 749 1104 1141 376 177 -886 -713 -299 -180 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