File name: Pandora159s1_Wakkerstroom_20210408_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T025753.8Z 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_20210408_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: 20210408 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 20210408T043740.5Z 7768.192830 117 1 49.08 2 85.36 79.33 41.45 80.60 0.00 1 0.00 1 0 25 6.312e-01 5.940e-02 4.971e-01 5.170e-02 9.177092e-01 3.088014e-02 9.759761e-03 -6.000000e+00 3.790045e-01 226.39 -2.00 3.06 -2.00 322.24 0.00e+00 -6.095951e-03 1.392210e-02 1.878413e-02 -6.000000e+00 1.979194e-02 280.96 -2.00 20.00 -2.00 321.74 0.00e+00 10.414 0.007 302.00 328.00 3 1.1901e+00 1.1285e-01 1.5057e-01 -6.0000e+00 9.4537e-01 1.6345e+00 1.3545e-01 1.5882e-01 -6.0000e+00 1.0404e+00 -2.0489e+00 8.2685e-02 4.3387e-02 -6.0000e+00 6.1511e-01 7.9047e-01 4.4275e-02 1.4353e-02 -6.0000e+00 2.5968e-01 1.2726e-05 1.8778e-04 1.4688e-03 1.8390e-04 -6.0000e+00 1.8304e-02 1.3680e-02 12 8 8 10 0 0 -11.48 19.13 1.25 0.01368 0.01509 19 4 4 8 0 2582.820 14.99 19.13 12.21 21.48 21.38 15.9 862.11 29886 900000 10456 900000 -59021 14767 -30149 39797 900000 -34070 900000 96568 128822 -46527 900000 62142 900000 900000 232934 900000 900000 900000 900000 900000 -39723 900000 -27763 213606 -80954 900000 -27400 102862 -26963 900000 900000 -8475 -64441 179331 900000 112750 900000 14277 175661 13182 81999 136186 900000 900000 39986 900000 18233 81634 94236 92669 26216 304971 13310 900000 26776 900000 76265 53202 10516 26187 56480 75141 110845 -17972 62440 2908 68534 -19369 13294 36359 33531 84859 7522 -40827 -20511 67496 28339 13979 -4740 39145 5120 13823 -2869 -5067 22827 -3578 -12439 -18565 -3223 -30350 -7602 9315 6358 -10805 -742 -4363 -3944 -11078 -6952 7077 -15782 9504 2667 -5511 -8051 10918 5972 3608 -991 1133 -1444 2957 3420 8957 -1095 367 7954 -3548 5233 -5987 6116 -5019 3755 -4046 2571 2017 -714 -2147 127 2533 -3303 1888 -2706 1458 -3735 623 4180 358 -182 2277 900000 855 900000 -6305 741 -2197 1996 900000 -2677 900000 4844 6462 -5549 900000 3117 900000 900000 11685 900000 900000 900000 900000 900000 -4407 900000 -2410 10715 -9450 900000 -2264 5160 -2732 900000 900000 -584 -8177 8996 900000 5656 900000 1376 8812 1204 4113 6832 900000 900000 2568 900000 1701 4513 4920 5218 2920 15299 1723 900000 2633 900000 4294 4085 1372 3324 5493 5923 6256 -3733 6648 624 8349 -5635 2654 5323 4428 6031 1078 -9831 -4788 8042 5774 3778 -1660 9538 1819 4826 -1203 -2196 7478 -1447 -5119 -7735 -1155 -15256 -3634 4473 3629 -8477 -574 -3484 -2900 -7882 -4313 3869 -11682 5780 1849 -4536 -7739 10115 6507 4358 -1285 1419 -1789 3497 4117 10765 -1539 519 10073 -4769 6210 -7753 6831 -6078 4105 -5227 3670 3372 -1376 -4552 283 5940 -8670 5023 -7501 3990 -10395 1597 9509 780 -386 SS 20210408T045141.2Z 7768.202560 120 1 50.36 2 82.31 77.65 38.47 78.30 0.00 1 0.00 1 0 25 4.837e-01 8.180e-03 3.014e-01 4.415e-03 7.452195e-01 2.446333e-03 7.234870e-03 -6.000000e+00 2.750353e-01 226.39 -2.00 3.06 -2.00 321.80 0.00e+00 3.641500e-03 1.361643e-03 4.300619e-03 -6.000000e+00 1.245081e-02 280.96 -2.00 20.00 -2.00 321.29 0.00e+00 6.969 0.002 302.00 328.00 3 9.2570e-01 9.1016e-03 7.1921e-02 -6.0000e+00 6.8168e-01 1.1184e-01 1.3829e-02 5.2908e-02 -6.0000e+00 7.4230e-01 -1.4509e-01 1.5180e-02 2.1315e-02 -6.0000e+00 4.4053e-01 4.8614e-02 6.9483e-03 7.7916e-03 -6.0000e+00 1.8671e-01 3.5139e-04 -1.0029e-03 1.2312e-04 7.5598e-05 -6.0000e+00 1.3315e-02 1.3511e-02 11 8 0 10 0 0 22.93 19.13 0.25 0.01351 0.00598 144 31 4 8 0 342.550 14.99 19.13 13.61 21.48 21.38 16.1 871.40 -197322 14344 -202909 -224577 81904 -181860 900000 -32298 9119 -172188 -84577 -176776 900000 -139839 -68837 -77510 -29573 62253 -30869 -32519 -37145 900000 -101243 68106 -76973 -11995 -62077 900000 -16542 -26328 -26483 -13042 12701 -6955 26462 -25515 -6126 -21409 6508 -18348 22053 -9241 9691 1824 6582 4752 -3261 4520 -5033 16441 -2618 8416 1867 5797 -1572 11262 1703 449 3187 -458 4584 -561 9606 1404 3727 -1444 6128 -1825 3249 854 1019 930 -814 1992 325 1704 48 3446 186 2334 -1752 -70 -2305 -197 -2267 -1013 -38 -1079 1302 -1317 1877 -86 1363 560 1118 325 1127 24 -451 132 -708 1036 488 382 -1721 -1000 -1391 -612 -954 379 -1044 -333 -34 219 771 648 1120 254 -311 -1105 -450 -181 150 -334 753 773 1705 1324 -45 298 -13 422 201 508 -589 -320 153 -151 -564 -206 299 -138 259 -990 62 -1382 -1852 352 -913 900000 -139 39 -1235 -364 -1711 900000 -1654 -518 -778 -231 268 -277 -315 -386 900000 -2141 320 -1545 -145 -1157 900000 -213 -387 -484 -257 228 -162 427 -695 -154 -760 217 -941 854 -530 486 102 359 273 -210 285 -373 1079 -236 769 202 661 -206 1361 233 62 414 -61 603 -87 1440 260 715 -289 1138 -387 739 230 301 286 -250 555 83 387 11 825 49 726 -671 -30 -1120 -100 -1251 -587 -23 -674 789 -785 1011 -45 679 298 677 233 936 23 -477 138 -696 889 385 305 -1512 -922 -1361 -641 -1115 497 -1553 -523 -53 333 1109 901 1570 377 -492 -1819 -720 -275 220 -475 1022 1010 2146 1777 -70 531 -26 886 448 1205 -1517 -801 389 -391 -1453 -544 732 -317 576 SS 20210408T045801.6Z 7768.206963 123 1 51.22 2 80.94 76.87 37.12 77.19 0.00 1 0.00 1 0 25 3.296e-01 6.056e-03 1.500e-01 2.196e-03 6.604361e-01 1.176330e-03 6.467973e-03 -6.000000e+00 1.859232e-01 226.39 -2.00 3.06 -2.00 321.37 0.00e+00 3.901380e-03 5.788091e-04 1.685116e-03 -6.000000e+00 8.230138e-03 280.96 -2.00 20.00 -2.00 320.81 0.00e+00 6.032 0.001 302.00 328.00 3 6.4531e-01 4.0379e-03 5.8895e-02 -6.0000e+00 4.6080e-01 4.9340e-02 5.6925e-03 3.5674e-02 -6.0000e+00 5.0164e-01 -4.0625e-02 6.0516e-03 1.6368e-02 -6.0000e+00 2.9882e-01 3.4119e-03 2.8691e-03 7.2160e-03 -6.0000e+00 1.2681e-01 1.0326e-03 -8.8741e-04 6.1315e-05 6.4044e-05 -6.0000e+00 8.8161e-03 1.3374e-02 10 0 0 10 0 0 9.93 19.13 0.27 0.01337 0.00671 280 60 2 8 0 175.990 15.00 19.13 14.55 21.48 21.38 16.3 876.59 -124622 -65342 -148016 -60338 -183722 -73882 -76071 -81724 -89672 -69961 -82162 -84906 -98300 -46961 -46234 -49631 -33224 -31049 -14741 -24430 -956 -28383 -9573 -22761 -27850 -19160 -19562 -29937 -7740 7181 -13340 6094 -4819 1844 -2343 -1301 -7500 -922 -4407 -2094 1890 -4267 -740 -119 3951 -4432 4329 -446 3365 836 4216 2621 3383 1334 1691 3102 308 2437 -562 -46 1347 2746 1397 2513 170 1556 1823 1145 2619 585 396 -551 59 -385 -278 56 -374 -293 316 -891 -411 -817 -2072 -842 -1024 -484 -1024 -284 -132 134 455 943 1006 1398 1033 150 887 244 -430 -182 273 -152 882 -79 -1879 -928 -653 -842 -41 -119 -317 -321 -21 431 370 1284 780 570 -274 -872 -702 -39 -4 -185 701 -84 1296 1152 268 97 266 133 45 180 -373 -403 -64 -35 -591 55 -24 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