File name: Pandora85s1_NewOrleansLA-XULA_20250811_L2Fit_fout2c5d20250716p1-8.txt File generation date: 20260326T091233.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c5p1-8 Local principal investigator: Morewell Gasseller Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 85 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora85_OF_v3d20231120.txt Instrument calibration file used: Pandora85s1_CF_v5d20250716.txt Level 1 file used: Pandora85s1_NewOrleansLA-XULA_20250811_L1_smca1c5d20250716p1-8.txt Full location name: Xavier University of Louisiana Short location name: NewOrleansLA-XULA Country of location: United States Location latitude [deg]: 29.9643 Location longitude [deg]: -90.1074 Location altitude [m]: 10 Local noon date: 20250811 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: 196 338 Nominal wavelengths inside fitting window [nm]: 305.0150 305.1556 305.2961 305.4367 305.5772 305.7178 305.8583 305.9988 306.1393 306.2798 306.4203 306.5608 306.7012 306.8417 306.9821 307.1226 307.2630 307.4034 307.5438 307.6842 307.8245 307.9649 308.1052 308.2456 308.3859 308.5262 308.6665 308.8068 308.9471 309.0874 309.2276 309.3679 309.5081 309.6484 309.7886 309.9288 310.0690 310.2091 310.3493 310.4895 310.6296 310.7698 310.9099 311.0500 311.1901 311.3302 311.4703 311.6104 311.7504 311.8905 312.0305 312.1705 312.3105 312.4505 312.5905 312.7305 312.8705 313.0104 313.1504 313.2903 313.4302 313.5702 313.7101 313.8499 313.9898 314.1297 314.2695 314.4094 314.5492 314.6891 314.8289 314.9687 315.1085 315.2482 315.3880 315.5278 315.6675 315.8072 315.9469 316.0867 316.2264 316.3660 316.5057 316.6454 316.7850 316.9247 317.0643 317.2039 317.3435 317.4831 317.6227 317.7623 317.9019 318.0414 318.1809 318.3205 318.4600 318.5995 318.7390 318.8785 319.0179 319.1574 319.2969 319.4363 319.5757 319.7151 319.8545 319.9939 320.1333 320.2727 320.4120 320.5514 320.6907 320.8300 320.9694 321.1087 321.2479 321.3872 321.5265 321.6657 321.8050 321.9442 322.0834 322.2227 322.3619 322.5010 322.6402 322.7794 322.9185 323.0577 323.1968 323.3359 323.4750 323.6141 323.7532 323.8923 324.0313 324.1704 324.3094 324.4484 324.5875 324.7265 324.8655 --------------------------------------------------------------------------------------- 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 20250811T122349.8Z 9354.516549 228 1 54.08 2 78.68 78.98 74.78 253.96 0.00 1 0.00 1 0 25 2.649e-01 9.907e-03 6.786e-02 1.561e-03 5.569312e-01 8.339839e-04 6.896382e-03 -6.000000e+00 1.550453e-01 229.65 -2.00 3.24 -2.00 320.86 0.00e+00 6.978390e-04 3.775042e-04 6.239585e-03 -6.000000e+00 7.117259e-03 294.59 -2.00 20.00 -2.00 320.12 0.00e+00 4.915 0.001 302.00 328.00 3 7.4889e-01 2.8248e-03 6.4804e-02 -6.0000e+00 3.8530e-01 -6.7922e-03 3.7602e-03 5.2508e-02 -6.0000e+00 4.1550e-01 -4.1394e-02 3.4193e-03 1.6587e-02 -6.0000e+00 2.4902e-01 5.6666e-03 1.6752e-03 6.5541e-03 -6.0000e+00 1.0756e-01 1.0892e-03 5.7731e-04 4.5814e-05 6.6847e-05 -6.0000e+00 7.3842e-03 1.7202e-02 0.0000e+00 12 9 8 11 4 0 4.09 33.10 0.47 0.01720 0.02154 264 29 1 5 0 204.830 41.00 20.01 33.10 32.76 3.9 1033.35 -47625 -63044 -44986 -40647 -115101 -75897 -114473 -109860 -73838 -81296 -95966 -73613 -64982 -56056 -6902 -37290 -27342 -12554 6264 -11395 -18144 -19914 -23172 -15155 -27944 -17819 -15213 -16581 -16058 -13538 -12668 -3894 -5062 -3467 -17035 -10326 -15972 -3102 -1815 57 1541 8078 1550 1107 4697 1541 345 -452 -1254 1840 3127 1314 3648 3734 2835 2242 3305 990 1382 138 2214 2759 5148 3503 2926 283 401 -266 522 1780 1245 2315 2174 1121 -313 -1510 -3620 -4344 -3839 -2643 -2405 -1030 -2173 -2228 -292 90 882 1150 1736 1577 467 -408 -1443 -1676 -1051 -1220 -299 796 801 -675 -1220 -2077 -2453 -1036 -981 -1438 -618 -416 225 1327 1716 1787 1350 896 -130 -779 -97 109 379 460 304 779 807 488 241 -529 -1662 -419 -119 -690 -599 -815 -762 -557 -329 30 22 919 759 217 123 -223 -315 -211 -384 -249 -214 -1179 -515 -1236 -1292 -695 -911 -1315 -886 -872 -861 -80 -702 -578 -252 113 -262 -464 -524 -660 -436 -995 -613 -528 -570 -530 -453 -482 -159 -240 -177 -980 -545 -972 -195 -138 5 158 839 181 134 558 192 44 -60 -173 259 475 227 675 753 617 514 778 241 329 33 525 703 1438 1115 997 97 134 -90 188 725 573 1123 1068 536 -141 -623 -1398 -1649 -1550 -1223 -1296 -627 -1484 -1625 -224 67 690 933 1419 1263 391 -320 -1082 -1248 -838 -1006 -281 846 942 -824 -1435 -2270 -2456 -999 -1008 -1589 -713 -510 296 1898 2699 2751 2115 1369 -208 -1181 -144 167 614 789 489 1332 1338 786 373 -794 -2430 -605 -187 -1215 -1061 -1551 -1522 -1164 -732 72 50 2105 1764 497 291 -503 -684 SS 20250811T122945.3Z 9354.520664 231 1 53.69 2 77.41 79.68 75.97 254.79 0.00 1 0.00 1 0 17 2.772e-01 1.223e-02 1.752e-01 5.557e-03 5.112833e-01 2.985095e-03 6.498971e-03 -6.000000e+00 1.633187e-01 229.65 -2.00 3.24 -2.00 320.77 0.00e+00 2.740509e-04 1.289568e-03 5.954207e-03 -6.000000e+00 7.481691e-03 294.59 -2.00 20.00 -2.00 320.01 0.00e+00 4.459 0.001 302.00 328.00 3 2.9781e+00 9.9315e-03 5.9956e-02 -6.0000e+00 4.0577e-01 1.4549e-02 1.3007e-02 5.0756e-02 -6.0000e+00 4.3767e-01 -4.0458e-02 1.1352e-02 1.5624e-02 -6.0000e+00 2.6154e-01 9.4270e-03 5.6007e-03 6.4808e-03 -6.0000e+00 1.1258e-01 1.8540e-04 1.6552e-04 1.6859e-04 5.0484e-05 -6.0000e+00 7.7767e-03 1.6899e-02 0.0000e+00 12 9 8 11 4 0 99.99 33.13 0.70 0.01690 0.01814 82 9 1 5 0 654.730 41.00 20.01 33.13 33.29 3.9 1035.59 -118291 54768 -91485 -8034 -129050 -96649 900000 -103494 -84061 -53655 -66637 -55570 -71604 -40841 -71542 -14371 -28430 15309 61002 -10018 40659 -8961 2112 -15330 34825 -23750 -8492 -11148 -4774 -17023 -9969 -10898 16205 11665 -21692 20248 -17570 11344 2109 -5139 5820 -1421 5312 711 -2088 2695 2682 5379 15265 -3345 3964 1149 9289 918 -3961 1075 1317 509 574 2299 -945 7968 7333 3133 8696 -177 -2633 118 -1792 1986 2618 2479 958 561 -150 -1288 -4000 -3580 -5010 -2609 -4130 -1993 -2267 -696 -79 505 1441 889 3112 2469 -680 -1290 -1717 -796 -2304 -1337 -412 192 216 -1562 -1207 -2112 -2797 -184 -1385 -2153 -423 -353 908 1034 2293 1522 1355 730 -62 -708 -187 -159 592 554 279 1060 182 901 -2 -60 -1417 -614 -884 -822 -714 -409 -892 -83 -356 289 343 416 606 445 99 69 -828 -1690 297 -1262 -47 -2352 -1238 900000 -1733 -1325 -687 -1018 -821 -1481 -765 -2220 -297 -756 287 781 -276 701 -256 56 -529 789 -1030 -326 -428 -165 -679 -417 -531 686 563 -1575 944 -1295 732 182 -576 669 -189 697 101 -307 383 385 761 2002 -551 659 218 1772 207 -998 268 340 134 148 573 -248 2055 2122 1052 2926 -64 -933 41 -671 815 1199 1210 481 273 -68 -538 -1567 -1350 -2025 -1183 -2209 -1189 -1500 -482 -58 397 1190 767 2662 2082 -556 -984 -1236 -557 -1744 -1131 -394 208 258 -1946 -1434 -2337 -2851 -178 -1450 -2431 -494 -438 1191 1481 3558 2532 2278 1195 -96 -1043 -268 -235 924 918 475 1760 297 1411 -3 -87 -2001 -855 -1333 -1375 -1302 -794 -1819 -176 -802 627 771 955 1409 1015 217 159 -1839 SS 20250811T123814.5Z 9354.526557 237 1 54.04 2 75.60 80.66 77.68 255.96 0.00 1 0.00 1 0 25 1.268e-01 9.393e-03 1.979e-02 9.626e-04 4.598312e-01 5.100918e-04 5.701148e-03 -6.000000e+00 7.420284e-02 229.65 -2.00 3.24 -2.00 320.06 0.00e+00 1.914058e-03 1.741665e-04 3.666961e-03 -6.000000e+00 3.406096e-03 294.59 -2.00 20.00 -2.00 319.22 0.00e+00 3.935 0.001 302.00 328.00 3 9.5560e-01 1.5372e-03 4.8046e-02 -6.0000e+00 1.8440e-01 -1.5609e-02 1.8927e-03 3.2133e-02 -6.0000e+00 1.9885e-01 -4.4493e-03 1.5508e-03 1.2734e-02 -6.0000e+00 1.1917e-01 -9.8545e-03 8.0080e-04 3.4153e-03 -6.0000e+00 5.1481e-02 2.4506e-03 4.1597e-04 2.8573e-05 4.3371e-05 -6.0000e+00 3.5336e-03 1.6520e-02 0.0000e+00 12 9 8 11 4 0 99.96 33.23 0.37 0.01652 0.01965 445 49 1 5 0 121.420 41.00 20.01 33.23 33.76 3.9 1037.16 -51171 -32735 -46315 -49980 -55401 -39480 -43345 -29180 -32685 -25521 -45278 -24723 -15824 -20307 -12080 -8486 -8621 -5667 -5932 -2679 -3736 -7880 -4411 -6365 -3497 -2066 -7469 -6275 -7695 -6638 -7754 -2384 -63 -5046 -7436 -6599 -5668 -3699 -2303 1184 -69 817 1030 1097 1537 1027 502 17 156 592 -3 1258 1243 2679 1245 2194 1580 768 271 -69 845 1977 3218 3722 2344 -213 246 -1147 97 1491 1302 1378 1542 905 -162 -1225 -2688 -3464 -2466 -2199 -1832 -1511 -2282 -1761 -645 -374 721 806 1533 1458 665 19 -1516 -1265 -1279 -1190 -542 715 313 -358 -825 -1778 -2138 -1078 -917 -1491 -746 -181 371 1425 1672 1752 1351 857 -134 -441 -260 23 558 588 62 561 677 429 -31 -211 -1451 -273 -171 -586 -535 -801 -819 -633 -195 -50 39 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