File name: Pandora21s1_Bremen_20220217_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T100239.8Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Tom Hanisco Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 21 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora21_OF_v4d20190904.txt Instrument calibration file used: Pandora21s1_CF_v1d20201116.txt Level 1 file used: Pandora21s1_Bremen_20220217_L1_smca1c1d20201116p1-8.txt Full location name: Bremen University Short location name: Bremen Country of location: Germany Location latitude [deg]: 53.0813 Location longitude [deg]: 8.8126 Location altitude [m]: 50 Local noon date: 20220217 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: 286 428 Nominal wavelengths inside fitting window [nm]: 305.0633 305.2039 305.3445 305.4851 305.6257 305.7662 305.9068 306.0473 306.1878 306.3283 306.4688 306.6093 306.7497 306.8902 307.0306 307.1711 307.3115 307.4519 307.5923 307.7326 307.8730 308.0134 308.1537 308.2940 308.4343 308.5747 308.7149 308.8552 308.9955 309.1357 309.2760 309.4162 309.5564 309.6966 309.8368 309.9770 310.1172 310.2573 310.3975 310.5376 310.6777 310.8178 310.9579 311.0980 311.2380 311.3781 311.5181 311.6582 311.7982 311.9382 312.0782 312.2182 312.3581 312.4981 312.6380 312.7779 312.9179 313.0578 313.1976 313.3375 313.4774 313.6172 313.7571 313.8969 314.0367 314.1765 314.3163 314.4561 314.5959 314.7356 314.8754 315.0151 315.1548 315.2945 315.4342 315.5739 315.7135 315.8532 315.9928 316.1325 316.2721 316.4117 316.5513 316.6908 316.8304 316.9700 317.1095 317.2490 317.3885 317.5280 317.6675 317.8070 317.9465 318.0859 318.2254 318.3648 318.5042 318.6436 318.7830 318.9224 319.0617 319.2011 319.3404 319.4798 319.6191 319.7584 319.8977 320.0369 320.1762 320.3155 320.4547 320.5939 320.7331 320.8723 321.0115 321.1507 321.2899 321.4290 321.5682 321.7073 321.8464 321.9855 322.1246 322.2637 322.4028 322.5418 322.6808 322.8199 322.9589 323.0979 323.2369 323.3759 323.5148 323.6538 323.7927 323.9317 324.0706 324.2095 324.3484 324.4872 324.6261 324.7650 324.9038 --------------------------------------------------------------------------------------- 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: Temperature at electronics board [°C], 999=no temperature signal Column 95: Spectrometer control temperature [°C], 999=no temperature signal Column 96: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 97: Temperature in head sensor [°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 20220217T100937.8Z 8083.423354 363 1 5.13 2 67.74 156.37 108.87 326.95 0.00 1 0.00 1 0 25 1.572e-01 1.066e-02 9.342e-02 7.575e-03 3.914007e-01 3.899280e-03 5.402386e-03 -6.000000e+00 9.191040e-02 223.61 -2.00 3.88 -2.00 318.65 0.00e+00 -8.657924e-04 7.574494e-04 1.385684e-04 -6.000000e+00 3.760606e-03 266.09 -2.00 20.00 -2.00 318.35 0.00e+00 2.618 0.000 302.00 328.00 3 4.7118e+00 1.0423e-02 3.4192e-02 -6.0000e+00 2.2775e-01 1.5496e-02 1.1788e-02 2.2337e-02 -6.0000e+00 2.4848e-01 2.2093e-03 8.6056e-03 1.1373e-02 -6.0000e+00 1.4650e-01 -4.3175e-04 4.6188e-03 3.3478e-03 -6.0000e+00 6.1176e-02 2.1810e-04 -6.1691e-03 2.3467e-04 4.4527e-05 -6.0000e+00 4.7196e-03 -8.7864e-03 -9.5782e-04 12 9 9 12 1 1 99.99 22.21 0.46 -0.00879 -0.05514 3 8 1 5 0 1237.548 25.28 20.00 22.21 12.54 28.3 976.49 19001 -19537 3747 -19816 163522 -14179 29711 -36896 -4025 -29037 -5171 -6260 -3854 18941 -12169 15187 -10699 17578 -310 4396 -7341 -3192 -42 -6847 9886 -3816 11521 -5416 10724 -11661 8451 2783 -2712 6245 -7896 1171 -10679 1555 -1492 3601 687 -632 -1275 -2140 465 -2087 352 -659 4508 -2564 1869 -88 2274 2153 -458 2853 -352 2753 -1673 3475 222 685 438 479 504 -929 2573 -1719 5235 -251 1635 -1177 -145 -957 -1242 1053 -420 918 -1580 1650 -1566 -239 -2097 -1000 -296 -1704 -204 -1162 174 -1238 -227 792 1849 1219 463 1121 312 1284 -890 511 -1744 841 -106 860 -1426 -946 60 -416 226 -775 418 -425 338 -14 -58 852 -318 61 -190 -787 -456 592 134 -42 284 750 518 484 698 406 1307 442 784 -430 180 -118 -314 -277 -790 -51 -323 404 -596 565 -911 147 -935 1394 -581 871 -2206 -199 -1931 -287 -373 -253 1179 -1163 1268 -1221 1644 -36 508 -970 -411 -5 -1002 1331 -611 1618 -860 1415 -1889 1219 467 -523 1163 -1642 222 -2407 361 -420 1123 243 -240 -504 -866 185 -851 140 -264 1738 -1074 794 -41 1100 1102 -249 1558 -202 1544 -961 1897 127 410 283 329 355 -647 1673 -1143 3441 -188 1302 -1001 -123 -800 -990 767 -288 601 -1086 1207 -1298 -214 -2029 -1005 -309 -1888 -233 -1371 204 -1445 -252 827 1817 1176 464 1201 365 1613 -1197 690 -2327 1044 -126 1006 -1761 -1218 79 -572 323 -1167 656 -689 544 -23 -88 1221 -452 87 -283 -1224 -722 928 206 -64 416 1063 715 661 986 608 2041 716 1296 -735 317 -216 -587 -525 -1512 -96 -598 725 -1051 SS 20220217T102206.7Z 8083.432022 371 1 50.17 2 67.04 159.59 109.86 329.87 0.00 1 0.00 1 0 17 2.215e-01 1.227e-02 1.517e-01 1.093e-02 3.934139e-01 5.661206e-03 5.193857e-03 -6.000000e+00 1.302535e-01 223.61 -2.00 3.88 -2.00 319.35 0.00e+00 -8.457368e-04 1.307252e-03 1.824692e-04 -6.000000e+00 5.308292e-03 266.09 -2.00 20.00 -2.00 319.05 0.00e+00 2.543 0.000 302.00 328.00 3 5.9177e+00 1.5401e-02 3.3552e-02 -6.0000e+00 3.2282e-01 3.8306e-02 1.7653e-02 2.2102e-02 -6.0000e+00 3.5149e-01 5.0818e-02 1.4012e-02 1.1403e-02 -6.0000e+00 2.0728e-01 -2.5831e-02 7.5316e-03 3.4797e-03 -6.0000e+00 8.7010e-02 6.7618e-05 5.1410e-05 3.5025e-04 4.4341e-05 -6.0000e+00 6.6370e-03 -1.8871e-02 2.0908e-04 12 8 8 10 0 0 99.99 22.22 0.58 -0.01887 -0.01848 90 18 1 5 0 557.354 25.28 20.00 22.22 13.27 28.4 980.98 21655 -35500 13355 -33450 183881 -56143 64348 -10985 121390 17270 15980 436 20037 31668 1373 44611 -16959 12412 -12234 18558 -1864 -1492 13909 -17677 24692 -12753 -6332 -4573 13651 -9421 16733 -9580 -4854 11387 -9077 8384 -4779 16661 -1761 3999 -2657 -211 -867 -3877 2675 -1517 3524 686 905 -56 3340 -3280 -1559 414 -2036 3795 -3120 2628 -2488 -815 -985 693 1095 -1241 819 -2154 2364 443 1536 102 626 -11 2962 2419 2309 608 2042 1450 -2264 2092 -1889 239 -2418 -925 -492 -1969 421 -496 1384 -848 1399 -709 1428 1184 -145 -35 382 1014 -203 263 -900 -387 -769 191 -1749 -2077 -288 -274 828 -285 520 -378 609 -445 -545 1192 -1022 -222 -770 235 -1471 1597 -697 535 357 -237 940 392 806 840 1502 -164 361 348 337 -720 -811 1319 208 545 -893 -550 -923 517 -1486 396 -1417 1960 -2634 1202 -416 1747 618 599 20 851 1405 89 2268 -1539 934 -1189 1451 -178 -144 1212 -2134 2227 -1660 -790 -548 1354 -1135 1714 -1352 -719 1540 -1449 1137 -770 2542 -373 938 -738 -61 -263 -1234 806 -477 1059 210 279 -18 1089 -1226 -616 171 -901 1649 -1483 1191 -1167 -372 -458 337 577 -720 482 -1270 1273 239 862 64 431 -8 2133 1701 1528 374 1136 776 -1297 1276 -1352 187 -2105 -841 -472 -2040 450 -554 1529 -933 1426 -684 1259 1016 -131 -35 421 1232 -269 352 -1174 -464 -865 210 -2063 -2611 -373 -372 1177 -438 849 -648 1031 -730 -838 1700 -1452 -319 -1171 374 -2436 2555 -1108 815 523 -333 1254 520 1118 1260 2398 -279 628 629 639 -1452 -1692 2756 442 1141 -1827 -1075 -1751 SS 20220217T110821.0Z 8083.464132 397 1 52.08 2 65.31 171.81 112.79 341.08 0.00 1 0.00 1 0 25 1.480e-02 5.196e-03 1.347e-03 1.961e-04 3.583187e-01 1.008492e-04 4.802669e-03 -6.000000e+00 8.697028e-03 223.61 -2.00 3.88 -2.00 318.50 0.00e+00 2.615195e-04 1.881921e-05 1.313319e-04 -6.000000e+00 3.545478e-04 266.10 -2.00 20.00 -2.00 318.20 0.00e+00 2.378 0.000 302.00 328.00 3 1.4664e-01 2.6907e-04 3.1000e-02 -6.0000e+00 2.1555e-02 4.5721e-03 3.0346e-04 2.0108e-02 -6.0000e+00 2.3476e-02 2.5448e-03 2.1486e-04 1.0270e-02 -6.0000e+00 1.3844e-02 -5.1752e-03 1.1453e-04 3.0743e-03 -6.0000e+00 5.8069e-03 2.7742e-02 -5.8095e-04 6.1401e-06 3.7565e-05 -6.0000e+00 4.4368e-04 -1.8053e-02 1.8943e-05 10 0 0 10 0 0 99.24 22.22 0.27 -0.01805 -0.02242 2627 515 1 5 0 18.423 25.28 20.00 22.22 15.38 28.8 992.82 -4735 -5367 -4600 -5938 -4352 -5030 -4906 -2729 -3530 -3246 -3493 -2434 -2868 -2035 -1906 -1844 -1490 -816 -462 -712 -356 -218 349 -564 -513 -780 -1207 -778 -55 534 358 1000 -76 -1031 -1116 -685 -1261 -812 -741 -1116 -1047 -929 -698 -599 -194 -401 -182 -303 37 544 705 804 967 832 614 824 748 578 783 1003 1271 1280 1278 707 212 479 477 644 875 414 -114 -188 -298 -267 -109 143 308 520 516 -113 -486 -1065 -1457 -1244 -1083 -994 -622 -466 -211 -140 285 432 819 1131 1008 775 786 434 -337 -442 -341 -476 183 162 -683 -711 -623 -420 -68 23 -20 -145 -111 3 202 571 562 423 91 -439 -659 -296 -310 -88 293 349 923 1193 819 549 393 155 233 344 -41 -154 -32 -15 -441 -291 -277 -315 -108 -197 -252 -224 -283 -189 -211 -215 -131 -191 -187 -208 -152 -203 -168 -183 -200 -174 -100 -60 -96 -49 -30 49 -85 -83 -132 -207 -128 -9 83 59 182 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