File name: Pandora132s1_Berlin_20231008_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T204529.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c13p1-8 Local principal investigator: Thomas Ruhtz Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 132 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora132_OF_v1d20200910.txt Instrument calibration file used: Pandora132s1_CF_v13d20210422.txt Level 1 file used: Pandora132s1_Berlin_20231008_L1_smca1c13d20210422p1-8.txt Full location name: Institute of Space Sciences FU Berlin Short location name: Berlin Country of location: Germany Location latitude [deg]: 52.4600 Location longitude [deg]: 13.3100 Location altitude [m]: 100 Local noon date: 20231008 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: Modification of session 11, but different RefDay (April 2021). First and last pixel inside fitting window: 243 385 Nominal wavelengths inside fitting window [nm]: 305.1071 305.2480 305.3889 305.5298 305.6707 305.8116 305.9524 306.0932 306.2341 306.3749 306.5157 306.6565 306.7973 306.9380 307.0788 307.2195 307.3603 307.5010 307.6417 307.7824 307.9231 308.0638 308.2044 308.3451 308.4857 308.6264 308.7670 308.9076 309.0482 309.1888 309.3293 309.4699 309.6104 309.7510 309.8915 310.0320 310.1725 310.3130 310.4534 310.5939 310.7344 310.8748 311.0152 311.1556 311.2960 311.4364 311.5768 311.7172 311.8575 311.9979 312.1382 312.2785 312.4188 312.5591 312.6994 312.8397 312.9800 313.1202 313.2604 313.4007 313.5409 313.6811 313.8213 313.9615 314.1016 314.2418 314.3819 314.5221 314.6622 314.8023 314.9424 315.0825 315.2225 315.3626 315.5026 315.6427 315.7827 315.9227 316.0627 316.2027 316.3427 316.4827 316.6226 316.7626 316.9025 317.0424 317.1823 317.3222 317.4621 317.6020 317.7418 317.8817 318.0215 318.1613 318.3012 318.4410 318.5807 318.7205 318.8603 319.0000 319.1398 319.2795 319.4192 319.5589 319.6986 319.8383 319.9780 320.1177 320.2573 320.3969 320.5366 320.6762 320.8158 320.9554 321.0949 321.2345 321.3741 321.5136 321.6531 321.7927 321.9322 322.0717 322.2111 322.3506 322.4901 322.6295 322.7689 322.9084 323.0478 323.1872 323.3266 323.4659 323.6053 323.7447 323.8840 324.0233 324.1627 324.3020 324.4413 324.5805 324.7198 324.8591 324.9983 --------------------------------------------------------------------------------------- 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 20231008T061942.8Z 8681.263690 245 1 49.78 2 81.94 110.60 28.49 175.72 0.00 1 0.00 1 0 17 4.721e-01 2.764e-02 3.125e-01 1.473e-02 7.133280e-01 8.266852e-03 8.924476e-03 -6.000000e+00 2.697519e-01 225.38 -2.00 3.85 -2.00 321.87 0.00e+00 1.398813e-02 4.274717e-03 1.241164e-03 -6.000000e+00 1.287461e-02 276.49 -2.00 20.00 -2.00 321.38 0.00e+00 6.679 0.007 302.00 328.00 3 1.7019e+00 2.9365e-02 7.8363e-02 -6.0000e+00 6.7165e-01 6.1643e-01 3.7964e-02 4.6871e-02 -6.0000e+00 7.3560e-01 -8.8681e-01 3.4421e-02 2.2346e-02 -6.0000e+00 4.3550e-01 3.8329e-01 1.6446e-02 1.5182e-02 -6.0000e+00 1.8471e-01 6.5879e-05 -8.1609e-04 4.4311e-04 2.0309e-04 -6.0000e+00 1.3139e-02 -2.3867e-03 0.0000e+00 12 9 9 12 4 4 99.32 7.06 0.30 -0.00239 -0.00852 85 18 4 8 0 585.550 15.00 7.06 18.29 22.09 22.50 28.5 960.22 900000 -120557 900000 -144347 51922 -158873 -28495 -136311 900000 900000 -123605 -11063 -142120 900000 -44351 900000 27233 5427 900000 -13147 900000 -69733 900000 -43316 32488 17755 3101 59241 -1921 900000 -65494 233562 14526 98527 34173 56509 89676 7415 106745 29433 103665 5724 68652 18867 54703 49473 20476 75451 7844 107297 4878 52024 20641 50204 31054 21793 31517 -4531 42156 -9155 27002 14105 29579 11919 14461 30398 2579 25750 -905 17885 -6542 16254 2262 13315 2585 -5958 10835 -12508 14565 -5039 5496 -3273 -1885 -353 -2313 4016 -4847 3151 -5243 1203 -3094 -638 -3377 -4487 1220 -4360 2674 -5094 2231 -3723 -1070 -1850 537 -74 -4360 1435 -4269 -1606 -3106 852 -1185 -1514 80 -2469 508 -1098 1676 -841 1336 -783 2643 3089 1721 3735 53 2614 -696 3180 1086 304 877 -166 1057 -565 1157 -1097 764 -651 859 -472 -656 -320 -2251 900000 -4557 900000 -6209 744 -6213 -409 -4264 900000 900000 -3383 -159 -7225 900000 -1387 900000 532 141 900000 -428 900000 -3636 900000 -1694 652 407 80 849 -52 900000 -4269 3349 625 1837 1127 1458 1800 393 2449 1646 2973 460 3051 1407 2902 2837 1615 3570 765 4154 581 4252 2486 4751 3651 2844 3706 -741 4171 -1510 3291 2204 4538 2206 2965 5187 524 4800 -225 4173 -2089 4195 646 3141 671 -1521 2253 -3497 3634 -1668 1913 -1404 -863 -168 -1197 2068 -2856 1746 -3116 640 -1605 -304 -1633 -2363 701 -3126 2088 -4900 2137 -3727 -958 -1490 396 -56 -3740 1231 -4129 -1643 -3623 1083 -1697 -2277 118 -3599 685 -1474 2250 -1225 2016 -1233 3931 4377 2387 4927 70 3251 -890 4249 1702 543 1701 -346 2301 -1336 2862 -2884 2005 -1745 2233 -1183 -1532 -699 -4964 SS 20231008T062647.4Z 8681.268604 249 1 44.78 2 80.94 112.06 28.46 179.04 0.00 1 0.00 1 0 17 4.182e-01 1.550e-02 3.368e-01 1.337e-02 6.561396e-01 7.320966e-03 7.918909e-03 -6.000000e+00 2.375592e-01 225.38 -2.00 3.85 -2.00 321.57 0.00e+00 7.697423e-03 3.584823e-03 7.564276e-04 -6.000000e+00 1.138314e-02 276.49 -2.00 20.00 -2.00 321.06 0.00e+00 6.024 0.005 302.00 328.00 3 2.2653e+00 2.4900e-02 7.0800e-02 -6.0000e+00 5.8858e-01 2.5520e-01 3.3222e-02 4.1015e-02 -6.0000e+00 6.4344e-01 -3.3748e-01 3.3633e-02 2.0457e-02 -6.0000e+00 3.8166e-01 1.4607e-01 1.6159e-02 1.0648e-02 -6.0000e+00 1.6233e-01 7.7150e-05 -6.0853e-04 4.0160e-04 1.1986e-04 -6.0000e+00 1.1598e-02 -2.4508e-03 0.0000e+00 12 9 9 12 4 4 99.94 7.12 0.49 -0.00245 -0.00702 65 14 4 8 0 688.870 15.01 7.12 18.82 22.09 22.50 28.4 961.14 900000 -172770 900000 -216440 -69177 -188147 -43412 35755 900000 6095 -109358 900000 -118820 900000 -85619 69448 -47389 31191 -42321 -43481 191638 -49359 32536 -53299 900000 -49764 -19071 -52473 -13123 23978 -32586 16561 -46737 11062 -22557 -19080 17973 -23483 34711 -13808 17270 12325 26221 -89 28970 685 5100 37013 -2669 12715 10213 29135 9893 9545 3150 20483 5752 5544 11788 -8219 8038 1497 11674 4830 6250 -1400 854 4057 -2582 2796 -4422 5373 3051 6487 -1548 -1314 -2768 2946 576 -48 6420 -1783 -468 -2176 -404 -1315 -1163 -188 -2250 4048 -1834 -841 -22 -1351 -1973 -828 2127 -1035 62 -1496 693 -1590 -213 84 -1251 -1531 -3660 -89 -1054 1192 -428 662 -276 -561 -453 -1399 918 -715 1164 -636 1625 273 1272 -55 838 1204 199 2733 105 353 193 128 -297 -249 18 -774 655 160 799 -212 260 -890 -1263 900000 -3273 900000 -6150 -901 -3564 -565 466 900000 79 -1424 900000 -2391 900000 -2230 904 -1111 406 -1102 -1189 2496 -1414 424 -1735 900000 -1685 -472 -1777 -308 437 -1273 474 -2861 389 -1058 -870 632 -1499 1492 -1115 1125 899 1741 -8 1962 63 465 2555 -288 1275 1170 3073 1379 1430 525 2961 974 924 1796 -1531 1350 302 2432 1195 1571 -370 219 1062 -817 867 -1591 1794 1012 2129 -498 -382 -782 829 192 -19 2546 -865 -243 -1219 -237 -828 -767 -125 -1508 2430 -1090 -465 -12 -785 -1320 -639 1846 -1049 66 -1593 663 -1395 -174 71 -1148 -1490 -3861 -98 -1301 1616 -646 1026 -428 -834 -637 -1938 1272 -1064 1800 -1024 2511 411 1826 -78 1129 1553 256 3702 166 626 372 260 -641 -573 43 -1979 1684 416 2042 -521 597 -1947 -2757 SS 20231008T064005.5Z 8681.277841 254 1 47.12 2 79.09 114.84 28.56 185.26 0.00 1 0.00 1 0 17 3.667e-01 1.466e-02 3.134e-01 1.184e-02 5.650335e-01 6.327293e-03 6.945969e-03 -6.000000e+00 2.100685e-01 225.38 -2.00 3.85 -2.00 321.03 0.00e+00 4.594064e-03 2.707861e-03 5.447453e-04 -6.000000e+00 9.972957e-03 276.49 -2.00 20.00 -2.00 320.49 0.00e+00 5.090 0.003 302.00 328.00 3 3.4271e+00 2.0095e-02 5.9510e-02 -6.0000e+00 5.2184e-01 1.8511e-01 2.5945e-02 3.3012e-02 -6.0000e+00 5.7080e-01 -1.3048e-01 2.5318e-02 1.7201e-02 -6.0000e+00 3.3556e-01 4.5511e-02 1.2483e-02 7.2216e-03 -6.0000e+00 1.4122e-01 6.1508e-05 -6.5777e-04 3.5977e-04 7.9295e-05 -6.0000e+00 1.0219e-02 -2.0887e-03 0.0000e+00 12 9 9 12 13 5 99.96 7.09 0.27 -0.00209 -0.00703 22 5 1 8 0 2048.020 15.01 7.09 19.15 22.09 22.50 28.1 961.43 -90714 900000 -105649 49360 -89050 900000 -130662 900000 -149264 900000 -18246 900000 158820 -65352 163320 -64381 78795 -71111 74063 -11243 55541 89174 -50032 26591 -43227 77002 -23410 32993 4911 21526 -26939 -8517 -657 -21084 31896 -1727 -14258 1472 12133 -1391 -6140 33685 -2694 11783 -9894 16620 -1313 -5359 5331 12948 16183 5145 5353 4076 7909 -1992 4889 3487 7239 8261 -727 3021 -1948 5068 2874 5278 489 2986 2439 -1846 5584 -793 1403 -2514 -711 -170 2520 -2565 -1855 -2640 -3327 -1101 -7023 785 -1525 -967 -1042 -922 -155 -203 1984 -199 584 286 -782 -884 1900 930 -1534 1096 -130 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