File name: Pandora132s1_Berlin_20231002_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T204658.7Z 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_20231002_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: 20231002 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 20231002T055519.9Z 8675.246758 222 1 50.01 2 83.88 103.89 63.44 265.28 0.00 1 0.00 1 0 17 5.244e-01 4.037e-02 4.116e-01 2.904e-02 7.765856e-01 1.664607e-02 9.551104e-03 -6.000000e+00 3.084766e-01 226.26 -2.00 3.85 -2.00 322.12 0.00e+00 1.082739e-02 8.315201e-03 1.854261e-03 -6.000000e+00 1.560154e-02 277.33 -2.00 20.00 -2.00 321.64 0.00e+00 8.402 0.013 302.00 328.00 3 9.7933e-01 6.0504e-02 9.4483e-02 -6.0000e+00 7.6828e-01 1.1755e+00 7.1438e-02 4.5648e-02 -6.0000e+00 8.4338e-01 -1.5956e+00 5.0687e-02 2.2255e-02 -6.0000e+00 4.9444e-01 6.5704e-01 2.5822e-02 9.8462e-03 -6.0000e+00 2.0402e-01 2.4287e-05 -1.6209e-03 8.7200e-04 1.7135e-04 -6.0000e+00 1.5181e-02 -9.0364e-03 0.0000e+00 12 9 8 11 4 0 -17.20 9.13 0.51 -0.00904 -0.02122 45 10 4 8 0 1111.030 14.99 9.13 22.60 21.48 21.88 28.9 978.87 173576 137198 -35732 900000 -104084 900000 -29580 900000 -77159 900000 19052 227 900000 -47638 149103 50376 900000 72831 900000 61016 137990 900000 19350 900000 -6526 900000 900000 100560 21430 15719 234581 -2458 120532 5236 900000 -31771 52593 -17421 123365 97003 -25747 84766 -3207 900000 -7758 112601 62189 54934 72958 26598 77401 9774 83317 -7901 139588 -356 38694 84542 74766 72032 -1781 90135 -17769 55823 1651 22149 11213 -1507 43716 21618 24588 3339 25498 -8613 27336 -9659 773 7972 -510 4732 -5435 31364 -5717 18202 -5020 -5557 1128 -1339 15859 -7755 14029 -19498 2530 613 -733 1980 -3072 5211 -9340 4104 -3420 -335 -8449 -2843 -7890 -7541 -3168 -5432 6851 -4346 -1146 -1727 1269 -4422 -1114 581 -3156 2821 -1461 5776 -1359 6622 3623 3219 2500 1320 2560 370 4144 -476 882 616 -511 386 -865 160 -1147 2075 -291 1516 -762 -1510 -2892 4903 3875 -2692 900000 -10780 900000 -1291 900000 -5152 900000 538 7 900000 -3670 4212 1940 900000 2431 900000 2194 3898 900000 845 900000 -352 900000 900000 2841 715 605 6626 -158 3405 336 900000 -2529 2080 -1432 3485 3562 -3107 3831 -321 900000 -797 3817 3513 3414 3916 2404 4591 1242 5413 -1217 5520 -52 4153 5493 5069 4883 -262 5856 -3513 6465 341 3629 2027 -324 6668 4641 5487 849 5474 -2384 4710 -2155 149 1509 -123 1297 -1759 8771 -2290 6076 -2243 -2640 524 -650 6394 -3784 5667 -9463 1072 286 -365 1139 -2185 3920 -8803 3362 -2793 -237 -6010 -1957 -6139 -6216 -2669 -5105 6439 -5234 -1494 -2409 1733 -6222 -1457 733 -4247 3789 -2172 8188 -2024 8707 4745 4125 3133 1620 3083 496 6194 -853 1720 1292 -1154 926 -2247 429 -3179 5610 -794 3865 -1845 -3439 -6564 SS 20231002T060120.7Z 8675.250934 225 1 49.37 2 82.99 105.11 64.31 266.48 0.00 1 0.00 1 0 17 4.315e-01 1.751e-02 4.365e-01 1.714e-02 7.368322e-01 9.497419e-03 8.834826e-03 -6.000000e+00 2.470322e-01 226.26 -2.00 3.85 -2.00 322.00 0.00e+00 1.413702e-02 5.152109e-03 3.056159e-03 -6.000000e+00 1.068608e-02 277.33 -2.00 20.00 -2.00 321.51 0.00e+00 7.520 0.009 302.00 328.00 3 1.1016e+00 3.4877e-02 9.1248e-02 -6.0000e+00 6.1289e-01 5.7472e-01 4.6118e-02 6.3811e-02 -6.0000e+00 6.6882e-01 -7.6119e-01 4.4527e-02 2.2473e-02 -6.0000e+00 3.9610e-01 3.1312e-01 2.1035e-02 1.5563e-02 -6.0000e+00 1.6539e-01 5.4738e-05 -1.3001e-03 5.0454e-04 1.5778e-04 -6.0000e+00 1.2002e-02 -9.0597e-03 0.0000e+00 12 9 8 11 4 0 12.13 9.20 0.45 -0.00906 -0.01883 70 15 4 8 0 705.120 15.00 9.20 22.95 21.48 21.88 28.7 980.09 -149133 -59340 -107888 -174973 -193488 -155674 900000 -98821 -40711 -132953 30315 6670 -49152 -114159 900000 -32099 -36182 -12114 -84279 -5187 -48164 -63299 27073 41511 127032 -3145 -48397 13622 57892 -53774 111455 43429 40859 -2082 6335 -18981 -22538 28132 39511 -14318 -522 16841 21488 40674 7449 36211 -15700 -5236 43795 20519 38003 6314 14513 20760 12316 4820 14060 18694 2816 29607 5798 15414 7360 14111 10315 4349 3939 -2098 6069 8647 11823 6140 8087 -812 8661 3676 4471 -8594 4465 -560 -132 2547 -4148 -4541 1728 -4406 -1262 -1861 -431 -191 4993 -2820 -1374 -1540 -290 -999 -2850 1378 -1141 1169 -1386 1620 -716 -3896 -2463 -1389 -2843 -1286 493 54 565 -619 -977 -302 -2075 -1406 196 -876 777 -678 789 2145 1824 1158 2578 -208 -290 1385 1639 789 26 113 -327 488 -226 79 485 295 -41 -80 991 -1653 -1648 -2945 -991 -1803 -4784 -5584 -2837 900000 -1651 -680 -2221 507 111 -821 -3121 900000 -585 -769 -221 -3328 -104 -1449 -2115 452 694 2122 -58 -1375 228 967 -1887 1862 871 956 -77 201 -761 -1017 893 1320 -933 -32 929 1185 1903 498 1876 -1417 -446 2415 1543 2667 675 1552 2220 1482 636 1691 2093 358 2869 756 2060 1230 2476 1965 865 783 -466 1399 2210 3160 1775 2216 -225 1968 792 919 -2139 1141 -182 -50 1068 -2024 -2145 816 -2349 -684 -1038 -235 -99 2536 -1460 -691 -834 -179 -669 -2281 1212 -1111 1103 -1238 1253 -527 -3036 -2031 -1202 -2660 -1288 545 69 789 -922 -1465 -436 -2906 -1913 269 -1288 1190 -1080 1212 3111 2562 1592 3383 -271 -375 1911 2597 1435 53 242 -749 1185 -592 214 1341 824 -115 -211 2418 -3886 -3824 SS 20231002T061400.3Z 8675.259726 228 1 49.66 2 81.14 107.70 66.15 268.97 0.00 1 0.00 1 0 17 4.616e-01 1.304e-02 2.500e-01 6.837e-03 6.329838e-01 3.736392e-03 7.771798e-03 -6.000000e+00 2.627581e-01 226.25 -2.00 3.85 -2.00 321.64 0.00e+00 6.404745e-03 1.887897e-03 2.150487e-03 -6.000000e+00 1.216639e-02 277.33 -2.00 20.00 -2.00 321.12 0.00e+00 6.144 0.005 302.00 328.00 3 1.3496e+00 1.3064e-02 7.0808e-02 -6.0000e+00 6.5080e-01 1.3926e-01 1.7906e-02 3.7790e-02 -6.0000e+00 7.0981e-01 -2.2164e-01 1.8298e-02 2.1726e-02 -6.0000e+00 4.2160e-01 9.4593e-02 8.6618e-03 9.3574e-03 -6.0000e+00 1.7800e-01 1.8582e-04 -3.4755e-04 2.0836e-04 1.3048e-04 -6.0000e+00 1.2757e-02 -9.1876e-03 0.0000e+00 12 9 8 11 4 0 33.07 9.22 0.31 -0.00919 -0.01180 130 28 4 8 0 381.650 15.00 9.22 23.44 21.48 21.88 28.7 982.29 -81507 -189463 900000 -193853 900000 -196523 -119649 -128838 -156100 -108582 -145961 900000 -153541 6672 -95853 20021 -75566 34069 -28098 -45742 -22347 -72258 43833 -79097 9989 -42456 60471 -31685 -29505 2689 -38706 47072 -43537 30249 -36667 10550 -7777 6263 10096 4181 24446 -7303 31529 -1291 6786 3305 6285 17618 -1711 11575 1371 19291 6152 18381 8135 9162 8303 -2035 1002 -6527 9444 3151 11760 7338 7192 5119 3330 1771 783 8403 -288 5403 1467 1993 1529 1634 376 -3407 2357 -2111 1334 -3466 -2371 -1811 -2327 -239 -442 2263 -476 2175 -703 2213 -2639 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