File name: Pandora159s1_Wakkerstroom_20200917_L2Fit_fout2c6d20191220p1-8.txt File generation date: 20240926T164024.5Z 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_20200917_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: 20200917 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 20200917T042346.0Z 7565.183171 19 1 48.01 2 84.34 84.70 86.83 78.51 0.00 1 0.00 1 0 25 8.111e-01 9.662e-02 5.182e-01 5.596e-02 8.013865e-01 3.167297e-02 9.497253e-03 -6.000000e+00 4.701064e-01 227.56 -2.00 3.06 -2.00 321.87 0.00e+00 -1.951151e-03 1.269536e-02 1.375868e-02 -6.000000e+00 2.188246e-02 277.51 -2.00 20.00 -2.00 321.39 0.00e+00 8.977 0.004 302.00 328.00 3 2.5854e+00 1.0623e-01 1.1240e-01 -6.0000e+00 1.1731e+00 1.2310e+00 1.2228e-01 1.0189e-01 -6.0000e+00 1.2803e+00 -1.5423e+00 7.5326e-02 2.2992e-02 -6.0000e+00 7.5318e-01 5.8999e-01 4.1124e-02 1.3874e-02 -6.0000e+00 3.1950e-01 1.1146e-05 2.0797e-03 1.6285e-03 8.2507e-05 -6.0000e+00 2.3161e-02 3.9937e-03 0.0000e+00 12 8 8 10 0 0 54.50 18.55 0.83 0.00399 0.01962 12 3 4 8 0 4000.000 14.99 18.55 8.70 20.96 20.87 11.3 861.53 -22434 92557 -43512 -118182 -40258 244825 900000 -78483 204685 -76180 900000 -67412 -2253 373326 152679 -7042 900000 -35298 513393 85940 8984 779 900000 900000 -2416 52367 -11381 900000 51563 -14554 900000 72940 -20368 460 1201 900000 900000 -70891 900000 219381 59112 30310 900000 85444 46798 64298 -44405 236921 88930 15535 13505 128943 76137 900000 92 4148 65639 22055 59240 28854 97728 -14088 139592 16078 104657 4491 23503 -39695 33330 3155 5568 27977 10756 12095 14766 -15623 18346 -12621 -2372 -3677 20690 1759 32230 33227 -7138 18476 648 -18292 27356 -8980 8902 17751 11520 -7119 3385 -7746 28238 6270 -6426 -1304 2229 2631 929 -3441 1318 6119 -51870 5550 -2710 12488 13670 -211 2682 -581 -2758 2663 -3009 923 4666 2066 -587 1089 11346 9026 3932 2068 4687 7425 9068 1326 -1395 3951 1399 -1318 -7072 2925 -1676 2815 -5251 -976 1396 1034 1316 -1568 5039 -3679 -17769 -2366 13329 900000 -6376 11144 -6263 900000 -5256 -123 20326 8313 -530 900000 -3728 27952 4679 565 50 900000 900000 -170 2851 -819 900000 2807 -928 900000 3971 -1971 37 87 900000 900000 -11720 900000 11944 4087 2840 900000 4652 3494 3962 -7699 12899 4842 1656 1600 7020 5810 900000 16 717 6326 3133 5513 3401 5922 -2704 7600 2895 8362 919 3947 -12683 5834 842 1574 6507 2874 2950 3134 -3945 3133 -2981 -575 -1076 5604 654 9747 10579 -3551 7585 331 -11408 10858 -4856 3779 6548 4422 -3453 1694 -5077 15174 4805 -6107 -1184 1830 1932 633 -2448 963 4540 -71586 4744 -2787 12710 15486 -295 3710 -817 -3793 3370 -4083 1268 6557 3084 -883 1545 14030 11115 4937 2573 5526 9040 12561 2280 -2736 7920 3058 -3166 -19267 7627 -4667 7591 -15257 -2605 3395 2340 2870 SS 20200917T043814.0Z 7565.193218 22 1 50.05 2 81.14 82.99 83.77 76.90 0.00 1 0.00 1 0 25 5.045e-01 1.111e-02 3.014e-01 4.753e-03 7.172937e-01 2.643643e-03 6.992720e-03 -6.000000e+00 2.901954e-01 227.56 -2.00 3.06 -2.00 321.69 0.00e+00 1.089870e-02 1.355413e-03 5.364525e-03 -6.000000e+00 1.259775e-02 277.51 -2.00 20.00 -2.00 321.22 0.00e+00 6.156 0.001 302.00 328.00 3 1.7582e+00 9.3120e-03 7.1415e-02 -6.0000e+00 7.2394e-01 1.1603e-01 1.3629e-02 6.3271e-02 -6.0000e+00 7.8741e-01 -1.6537e-01 1.5064e-02 1.9127e-02 -6.0000e+00 4.6410e-01 6.3514e-02 7.0459e-03 1.4272e-02 -6.0000e+00 1.9564e-01 2.8045e-04 -1.1291e-03 1.3586e-04 8.9858e-05 -6.0000e+00 1.3683e-02 2.9917e-03 0.0000e+00 12 8 8 10 0 0 59.18 18.53 0.37 0.00299 -0.00549 89 19 4 8 0 555.940 14.99 18.53 9.78 20.96 20.87 11.3 868.19 -78133 -173616 -162808 -225433 -72236 -247292 900000 -45888 900000 -233033 -59062 -149594 68694 100938 -103737 83285 -95219 112078 -70036 36997 -74069 -36317 -49028 13082 -29496 -2137 -3471 -41585 27682 -32953 8982 -25530 11661 -32431 14747 -15543 -6695 12459 14450 -1570 -2448 5202 -7731 16676 -2793 15309 -10689 13620 -2752 11758 -1055 3525 5733 5320 6374 -508 5733 -5265 10120 -1741 7840 10 3723 2263 4117 2371 3925 5493 1581 3505 592 3587 -1136 1826 -2244 5213 -256 1465 -303 103 2539 -1650 -1522 -2482 -1080 -1928 -272 -669 855 -832 1855 1668 1737 2062 1039 1402 -1023 841 -1495 762 -299 69 820 1281 -1157 -213 -4451 -1055 -5 -814 -578 -1338 548 -497 685 713 1599 399 -79 -1147 -1162 281 -274 530 428 1912 1055 2386 324 506 70 291 610 432 2 -627 192 -279 -499 -338 117 -363 345 -362 -1170 -1097 -2849 -335 -3438 900000 -213 900000 -3730 -274 -1260 318 468 -1355 386 -1685 519 -1210 234 -1466 -490 -764 116 -422 -24 -41 -718 245 -597 132 -667 251 -1189 329 -458 -195 352 487 -74 -132 283 -511 906 -191 909 -860 906 -229 916 -104 377 664 675 848 -69 748 -764 1339 -256 1087 2 632 448 866 506 814 1156 381 958 185 1144 -377 555 -648 1366 -66 376 -82 33 954 -745 -760 -1331 -608 -1167 -171 -436 550 -528 1072 902 899 1092 625 986 -864 807 -1630 827 -309 64 674 1033 -1023 -199 -4551 -1117 -6 -1070 -850 -2133 870 -776 1003 998 2217 586 -124 -1895 -1906 436 -408 760 591 2510 1344 3093 486 868 134 597 1312 990 6 -1645 512 -758 -1360 -890 286 -835 753 SS 20200917T045105.7Z 7565.202149 27 1 51.41 2 78.31 81.45 81.07 75.42 0.00 1 0.00 1 0 25 1.664e-01 6.119e-03 7.473e-02 1.579e-03 5.777404e-01 8.299326e-04 5.821596e-03 -6.000000e+00 9.468801e-02 227.56 -2.00 3.06 -2.00 320.83 0.00e+00 8.171617e-03 3.385325e-04 2.591260e-03 -6.000000e+00 4.101505e-03 277.51 -2.00 20.00 -2.00 320.32 0.00e+00 4.784 0.001 302.00 328.00 3 1.2825e+00 2.5910e-03 5.0695e-02 -6.0000e+00 2.3562e-01 4.2504e-02 3.3977e-03 3.7727e-02 -6.0000e+00 2.5600e-01 -4.1014e-02 3.4859e-03 1.4414e-02 -6.0000e+00 1.5206e-01 8.2457e-03 1.7305e-03 1.1357e-02 -6.0000e+00 6.4523e-02 1.5039e-03 -1.0442e-03 4.4600e-05 6.6761e-05 -6.0000e+00 4.4455e-03 3.4972e-03 0.0000e+00 10 0 0 10 0 0 58.41 18.53 0.27 0.00350 -0.00435 251 54 2 8 0 196.240 15.00 18.53 11.33 21.06 20.87 11.6 877.06 -33531 -65516 -73579 -66037 -41936 5442 -69261 -40902 -60252 -48948 -59537 15195 -44471 -9391 -20078 -21707 93 -7564 -1367 -3350 5562 -23203 4055 -12312 -3337 -12948 -1713 -3839 -11625 647 -4287 2253 2801 6858 -7099 4605 -8127 -1048 -5150 -433 -3228 -2100 -1221 -1445 47 -631 2048 -221 1033 156 2684 6 2892 1167 1222 1102 -328 -119 204 20 -14 2288 778 1486 -718 1505 247 726 1813 399 527 -39 114 -532 333 18 1434 -658 576 -644 -146 -1087 -2212 -1108 -1337 -578 -589 -266 -342 500 759 1715 916 1869 1573 587 817 360 -114 -384 20 -238 1039 728 -1115 -1180 -429 -761 -329 -69 -375 -357 -211 337 202 1290 623 369 -339 -857 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