File name: Pandora159s1_Wakkerstroom_20210305_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T024508.8Z 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_20210305_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: 20210305 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 20210305T042004.7Z 7734.180610 168 1 49.49 2 85.24 94.28 17.44 292.67 0.00 1 0.00 1 0 25 5.793e-01 3.918e-02 5.178e-01 3.415e-02 9.580812e-01 2.115801e-02 1.061679e-02 -6.000000e+00 3.481651e-01 227.48 -2.00 3.06 -2.00 322.50 0.00e+00 3.416639e-02 1.225473e-02 9.738097e-03 -6.000000e+00 1.822888e-02 282.33 -2.00 20.00 -2.00 322.08 0.00e+00 10.217 0.006 302.00 328.00 3 6.3102e-01 8.6038e-02 1.3327e-01 -6.0000e+00 8.7045e-01 1.6749e+00 9.9802e-02 1.4445e-01 -6.0000e+00 9.5401e-01 -2.1325e+00 6.3812e-02 2.4186e-02 -6.0000e+00 5.5911e-01 8.6051e-01 3.3913e-02 3.5916e-02 -6.0000e+00 2.3347e-01 2.1879e-05 -4.4171e-03 9.5296e-04 3.5049e-04 -6.0000e+00 1.6452e-02 1.4800e-03 12 8 8 10 0 0 -18.20 19.30 0.79 0.00148 -0.03171 34 7 4 8 0 1455.200 14.99 19.30 17.28 21.58 21.58 16.0 892.58 -2584 96623 42748 900000 -96221 900000 900000 222149 900000 -50076 -41418 900000 900000 900000 -35789 -2794 900000 900000 900000 900000 900000 900000 9745 64508 105805 53161 900000 900000 112894 168517 24158 177909 18631 110281 45855 900000 15500 28071 84850 10756 900000 22573 148108 47785 900000 16579 900000 85381 100269 10457 7763 174172 129262 900000 225070 900000 3395 36185 29445 21896 48412 20518 22739 164745 75595 -17147 40604 17772 67663 855 55848 -1211 28955 -8033 33292 -2700 -15344 -10263 -2841 9062 7970 14196 1131 26179 -17443 30092 -10526 26591 -11595 -2197 719 -12136 22228 -7577 471 -12483 10194 -8461 1148 4764 2889 1930 -926 -6769 -9098 2944 -7124 1779 2268 -825 -3322 -679 -6316 -3108 -3428 4150 -2028 1622 3154 1715 1323 -538 4873 3687 6637 -2301 2143 -2102 2675 -535 1294 -722 560 2134 -1762 2269 -242 679 -2823 -421 41 1823 -2127 -158 3204 1854 900000 -11536 900000 900000 7366 900000 -1661 -1373 900000 900000 900000 -2374 -162 900000 900000 900000 900000 900000 900000 377 2139 3508 1763 900000 900000 3744 5588 801 5899 875 3657 1521 900000 600 1008 2814 535 900000 1060 4911 1849 900000 916 900000 2831 3325 751 622 5776 4286 900000 7463 900000 319 2300 1871 1452 2773 1588 2011 5463 5013 -2890 3815 2161 5422 151 6173 -241 4081 -1487 3588 -366 -2205 -1475 -448 1578 1696 3295 331 6294 -6796 7650 -4189 7495 -4774 -795 236 -4259 5405 -2638 177 -6519 5155 -6149 860 3554 2076 1237 -535 -3984 -5808 1774 -5040 1259 1811 -798 -3827 -844 -8656 -4114 -4414 4828 -2549 2080 4236 2422 1832 -715 5830 4340 7373 -2722 2363 -2562 3658 -898 2439 -1526 1255 5065 -4675 6093 -678 1902 -8145 -1134 101 4030 -4597 SS 20210305T043416.6Z 7734.190470 171 1 51.19 2 82.09 92.66 20.32 287.86 0.00 1 0.00 1 0 25 5.369e-01 7.346e-03 2.661e-01 3.089e-03 7.424206e-01 1.703203e-03 7.151844e-03 -6.000000e+00 3.082333e-01 227.48 -2.00 3.06 -2.00 321.68 0.00e+00 5.333501e-03 9.478490e-04 2.256178e-03 -6.000000e+00 1.392467e-02 282.33 -2.00 20.00 -2.00 321.19 0.00e+00 6.800 0.002 302.00 328.00 3 4.8707e-01 6.3487e-03 6.7494e-02 -6.0000e+00 7.6605e-01 7.8549e-02 9.7724e-03 4.3814e-02 -6.0000e+00 8.3342e-01 -8.1352e-02 1.0768e-02 1.9626e-02 -6.0000e+00 4.9294e-01 2.0350e-02 4.9105e-03 9.4717e-03 -6.0000e+00 2.0854e-01 6.1362e-04 -9.7419e-04 8.5623e-05 8.3314e-05 -6.0000e+00 1.4781e-02 1.6570e-03 11 8 0 10 0 0 25.34 19.30 0.27 0.00166 -0.00566 235 51 2 8 0 208.920 15.00 19.30 18.57 21.58 21.58 16.0 899.36 -249741 -188304 -56369 900000 -142872 900000 -231511 900000 -220662 -142618 -177434 -82858 -105280 -93050 32175 -66770 80774 -45067 172833 -78895 26984 -95126 -9039 -80221 -20360 -37073 -30471 7142 -48555 63185 -33822 2047 -29888 35803 -28698 8774 -15473 -8037 -13146 -1924 1151 -3407 4866 -384 11734 -3514 13528 -17 14774 -4105 8297 2633 7289 3580 3065 2246 834 6049 1 4931 -645 4990 2198 4337 1324 3176 1625 1686 4190 143 1240 -388 1849 -196 1324 -521 1203 -1802 708 -323 610 -1429 -1947 -11 -1763 -217 -1814 -226 -964 1131 117 757 -74 1332 648 327 712 348 -321 -572 659 -278 1018 -213 -1247 -1735 -1683 -761 -243 121 -9 -119 86 637 154 1103 618 456 -465 -761 -697 143 78 -281 511 251 1339 1084 538 -250 267 27 211 186 -372 -388 187 -11 -675 -148 -8 254 436 -1777 -876 -170 900000 -430 900000 -1838 900000 -2054 -664 -1263 -272 -576 -611 97 -548 243 -395 520 -1145 140 -1693 -72 -1427 -217 -497 -392 63 -758 400 -639 34 -802 539 -801 168 -419 -244 -522 -82 54 -183 256 -22 614 -222 752 -1 918 -309 681 239 701 392 360 279 108 744 0 588 -85 692 363 803 270 631 328 356 968 40 378 -125 576 -58 353 -127 272 -435 191 -106 235 -647 -977 -6 -1004 -130 -1158 -146 -625 691 68 407 -39 725 405 241 611 345 -352 -631 670 -254 834 -178 -1127 -1669 -1708 -824 -290 164 -14 -192 140 1003 231 1578 897 695 -758 -1289 -1159 226 118 -414 718 342 1744 1488 850 -457 536 55 442 418 -901 -990 484 -30 -1782 -373 -18 556 918 SS 20210305T044035.8Z 7734.194859 174 1 51.63 2 80.69 91.94 21.63 286.07 0.00 1 0.00 1 0 25 3.168e-01 5.778e-03 1.123e-01 1.709e-03 6.594824e-01 9.171785e-04 6.492954e-03 -6.000000e+00 1.796489e-01 227.48 -2.00 3.06 -2.00 321.31 0.00e+00 3.730324e-03 4.501832e-04 1.880489e-03 -6.000000e+00 7.960746e-03 282.33 -2.00 20.00 -2.00 320.74 0.00e+00 5.887 0.001 302.00 328.00 3 3.6643e-01 3.1544e-03 5.8233e-02 -6.0000e+00 4.4619e-01 3.2792e-02 4.4458e-03 3.6347e-02 -6.0000e+00 4.8495e-01 -2.1729e-02 4.6894e-03 1.6328e-02 -6.0000e+00 2.8886e-01 -3.5883e-03 2.2220e-03 7.2668e-03 -6.0000e+00 1.2270e-01 1.5212e-03 -9.1630e-04 4.8148e-05 6.2614e-05 -6.0000e+00 8.4705e-03 1.5382e-03 10 0 0 10 0 0 37.86 19.30 0.25 0.00154 -0.00535 384 83 2 8 0 127.780 15.00 19.30 19.13 21.58 21.58 16.0 902.66 -121198 -123732 -95105 -92975 -152584 -88352 -98870 -94495 -59876 -87782 -107862 -57561 -28804 -53473 -22923 -36498 -40789 -19405 -29064 -27857 -10253 -21445 -22221 -28157 -14968 -13973 -15155 -11050 -19607 -4597 -6961 -4900 -6497 -9993 -10111 -5038 -5115 845 -697 -3493 -3626 709 -1467 -1680 -1821 -1313 -258 1414 2471 2581 3441 3870 2653 1896 462 1612 256 817 -302 565 1102 1492 2392 2618 952 1140 1930 1471 2257 616 9 -100 -717 -60 -584 112 -621 329 815 -187 20 -872 -1658 -1023 -860 -1006 -273 -465 -86 185 554 619 1020 1469 993 676 794 450 -425 -403 -60 154 796 159 -1616 -1132 -1063 -546 -158 -56 -460 -288 118 269 505 1126 777 399 -178 -829 -663 -168 -77 -152 477 273 1208 1413 203 2 117 211 108 302 -503 -492 70 16 -557 -124 163 -2 372 -545 -680 -428 -403 -1119 -339 -461 -488 -249 -527 -845 -317 -154 -481 -195 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