File name: Pandora159s1_Wakkerstroom_20240312_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20240312T221414.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Refilwe Kai Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 159 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora159_OF_v6d20191004.txt Instrument calibration file used: Pandora159s1_CF_v3d20201207.txt Level 1 file used: Pandora159s1_Wakkerstroom_20240312_L1_smca1c3d20201207p1-8.txt Full location name: Global Change Institute, University of Witwatersrand field site in Wakkerstroom Short location name: Wakkerstroom Country of location: South Africa Location latitude [deg]: -27.3493 Location longitude [deg]: 30.1438 Location altitude [m]: 1760 Local noon date: 20240312 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: 222 364 Nominal wavelengths inside fitting window [nm]: 305.0731 305.2139 305.3547 305.4955 305.6363 305.7770 305.9178 306.0585 306.1992 306.3399 306.4806 306.6213 306.7620 306.9026 307.0433 307.1839 307.3246 307.4652 307.6058 307.7464 307.8869 308.0275 308.1681 308.3086 308.4492 308.5897 308.7302 308.8707 309.0112 309.1517 309.2921 309.4326 309.5730 309.7135 309.8539 309.9943 310.1347 310.2751 310.4155 310.5558 310.6962 310.8365 310.9769 311.1172 311.2575 311.3978 311.5381 311.6784 311.8186 311.9589 312.0991 312.2393 312.3795 312.5198 312.6599 312.8001 312.9403 313.0805 313.2206 313.3607 313.5009 313.6410 313.7811 313.9212 314.0612 314.2013 314.3414 314.4814 314.6214 314.7615 314.9015 315.0415 315.1814 315.3214 315.4614 315.6013 315.7413 315.8812 316.0211 316.1610 316.3009 316.4408 316.5807 316.7205 316.8604 317.0002 317.1400 317.2798 317.4196 317.5594 317.6992 317.8389 317.9787 318.1184 318.2582 318.3979 318.5376 318.6773 318.8170 318.9566 319.0963 319.2359 319.3756 319.5152 319.6548 319.7944 319.9340 320.0736 320.2131 320.3527 320.4922 320.6318 320.7713 320.9108 321.0503 321.1898 321.3292 321.4687 321.6081 321.7476 321.8870 322.0264 322.1658 322.3052 322.4446 322.5839 322.7233 322.8626 323.0019 323.1413 323.2806 323.4199 323.5591 323.6984 323.8377 323.9769 324.1162 324.2554 324.3946 324.5338 324.6730 324.8121 324.9513 --------------------------------------------------------------------------------------- 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: 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 77: 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 78: 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 79: 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 80: 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 81: 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 82: Atmospheric variability [%], 999=no atmospheric variability was determined Column 83: Wavelength effective temperature [°C], 999=no effective temperature given Column 84: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 85: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 86: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 87: Number of bright count cycles Column 88: Number of dark count cycles Column 89: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 90: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 91: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 92: Integration time [ms] Column 93: Spectrometer control temperature [°C], 999=no temperature signal Column 94: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 95: Temperature in head sensor [°C], 999=no temperature signal Column 96: Temperature at electronics board 1 [°C], 999=no temperature signal Column 97: Temperature at electronics board 2 [°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 20240312T042434.0Z 8837.183727 47 1 49.10 2 85.14 91.02 111.56 92.67 0.00 1 0.00 1 0 25 6.326e-01 2.410e-02 4.458e-01 1.511e-02 9.425004e-01 9.318058e-03 8.769311e-03 -6.000000e+00 3.746287e-01 227.37 -2.00 3.06 -2.00 322.50 0.00e+00 8.745507e-03 6.215491e-03 1.065894e-02 -6.000000e+00 1.920151e-02 282.14 -2.00 20.00 -2.00 322.08 0.00e+00 10.063 0.006 302.00 328.00 3 -6.9487e-02 4.0483e-02 1.1955e-01 -6.0000e+00 9.4024e-01 8.1285e-01 6.1453e-02 1.1482e-01 -6.0000e+00 1.0322e+00 -9.9718e-01 6.3111e-02 3.7272e-02 -6.0000e+00 6.0082e-01 3.8486e-01 2.7785e-02 1.3182e-02 -6.0000e+00 2.5254e-01 6.4597e-05 -1.2602e-03 4.3575e-04 1.1070e-04 -6.0000e+00 1.9034e-02 1.1357e-02 12 8 8 10 0 0 49.68 19.58 0.62 0.01136 0.00189 77 17 4 8 0 637.540 14.98 19.58 14.45 21.69 21.88 27.6 829.17 -191795 -272541 900000 900000 900000 -284802 900000 900000 900000 -61374 -97618 900000 900000 900000 900000 900000 149038 900000 -91775 -41597 -75974 900000 -34042 -148055 900000 -8799 58885 -128997 900000 -95551 900000 -80134 134797 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562 2737 -118 -269 945 1964 3363 -3441 -274 -449 2442 -685 2886 372 3284 181 690 492 1874 1373 -2361 1090 -1563 679 -3981 420 -614 1293 277 -283 -1667 -611 -11697 -2279 -672 825 -1861 -3121 -2294 -3194 3191 270 1174 742 -258 264 50 1274 2665 858 -399 5339 2136 4754 121 1151 1546 2042 244 1555 -936 -2797 2083 -2757 1893 -1063 1090 -3359 -1038 SS 20240312T043834.2Z 8837.193451 50 1 49.30 2 82.03 89.41 108.61 91.02 0.00 1 0.00 1 0 33 4.506e-01 7.385e-03 2.107e-01 3.166e-03 7.116897e-01 1.717019e-03 6.882014e-03 -6.000000e+00 2.552022e-01 227.37 -2.00 3.06 -2.00 321.56 0.00e+00 4.019376e-03 9.103832e-04 2.011597e-03 -6.000000e+00 1.149272e-02 282.14 -2.00 20.00 -2.00 321.03 0.00e+00 6.753 0.002 302.00 328.00 3 6.1801e-01 6.1847e-03 6.5651e-02 -6.0000e+00 6.3363e-01 1.3372e-01 9.0678e-03 3.9995e-02 -6.0000e+00 6.8909e-01 -1.0894e-01 9.7219e-03 1.8108e-02 -6.0000e+00 4.1059e-01 3.0996e-02 4.5113e-03 8.0286e-03 -6.0000e+00 1.7456e-01 5.6174e-04 -1.1173e-03 8.8004e-05 7.1752e-05 -6.0000e+00 1.2236e-02 1.0948e-02 11 8 0 10 0 0 99.54 19.57 0.27 0.01095 0.00255 182 39 4 8 0 270.800 14.99 19.57 15.51 21.69 21.88 27.7 835.19 -205884 -92794 -234521 900000 -155248 1456 -165115 -142698 -119111 -96363 -157280 -90083 -79655 -103198 -5792 -75120 -38190 -78193 18470 -33820 11038 16999 3785 -15498 1690 -1678 -52854 37062 -25996 4027 -22540 32416 -13710 -120 -6674 758 -2280 -12060 -2748 -12759 1763 -2158 4775 -5711 10338 -4271 12154 -3243 4342 4286 6080 7404 3127 5473 -1282 5442 -1793 3900 -3034 1934 1124 2571 3408 4648 2102 1166 3536 913 3511 1042 2158 -1393 1870 -46 -487 296 544 481 -1486 39 -420 -1112 -2367 -191 -1479 11 -1360 -21 27 200 981 58 -102 950 984 -392 949 3 59 -392 -229 -458 1084 151 -1578 -1063 -766 -587 -516 80 -720 -63 -106 421 284 1351 656 686 -29 -816 -801 92 -35 -193 700 -129 1825 1169 311 -130 296 -83 75 298 -322 -402 -42 62 -580 86 -73 275 138 -1585 -286 -3032 900000 -858 4 -1096 -878 -660 -465 -1460 -514 -537 -1149 -32 -986 -403 -1359 139 -445 98 143 38 -207 21 -23 -1182 345 -448 58 -512 528 -403 -3 -190 20 -69 -483 -123 -748 101 -139 304 -413 655 -321 813 -263 346 373 582 791 383 716 -190 788 -287 587 -475 286 174 437 658 1005 493 272 800 222 929 327 732 -509 653 -15 -149 81 140 128 -462 14 -181 -549 -1290 -108 -906 7 -926 -15 19 132 601 34 -58 559 654 -307 850 3 66 -436 -239 -430 925 132 -1498 -1062 -801 -659 -632 109 -1095 -100 -171 655 421 1915 941 1032 -46 -1353 -1312 143 -54 -283 990 -178 2393 1618 490 -232 574 -171 163 677 -781 -1026 -108 163 -1517 216 -173 615 301 SS 20240312T044420.9Z 8837.197464 53 1 51.53 2 80.75 88.74 107.39 90.35 0.00 1 0.00 1 0 25 2.497e-01 5.674e-03 8.488e-02 1.311e-03 6.354755e-01 6.954844e-04 6.268501e-03 -6.000000e+00 1.413949e-01 227.37 -2.00 3.06 -2.00 321.17 0.00e+00 3.586202e-03 3.271818e-04 1.738614e-03 -6.000000e+00 6.265595e-03 282.14 -2.00 20.00 -2.00 320.59 0.00e+00 5.918 0.001 302.00 328.00 3 -1.0327e-01 2.3357e-03 5.7530e-02 -6.0000e+00 3.5110e-01 6.3190e-02 3.2207e-03 3.4435e-02 -6.0000e+00 3.8182e-01 -2.3357e-02 3.3382e-03 1.5429e-02 -6.0000e+00 2.2742e-01 -3.2935e-03 1.5991e-03 6.8894e-03 -6.0000e+00 9.6467e-02 2.3937e-03 -1.0330e-03 3.6939e-05 5.8873e-05 -6.0000e+00 6.6785e-03 1.0489e-02 10 0 0 10 0 0 75.80 19.56 0.25 0.01049 0.00273 553 119 2 8 0 89.140 14.99 19.56 16.01 21.69 21.88 27.9 838.63 -98061 -64450 -28076 -68320 -45826 -121109 -79872 -104275 -57634 -107668 -64825 -72204 -28506 -44694 -27760 -18877 -23697 -5667 -2329 2989 -19071 -9786 -23013 -7496 -20867 -6477 -21962 -12967 -7152 -11515 -412 -5994 2145 -5333 -1710 -6455 -1687 -5681 -1814 -6023 -1292 -2153 -1192 1001 -93 1472 -559 1193 1244 4556 1549 3067 1727 2373 717 1421 95 -402 585 810 2921 1289 2629 749 546 891 987 771 2103 648 307 -719 -458 31 -896 224 -514 447 68 304 -668 -942 -1663 -1044 -882 -880 -502 -582 143 -44 1023 319 1143 1330 1177 531 800 291 -472 -131 -130 246 898 511 -1599 -819 -820 -730 -235 -175 -327 -407 90 289 503 1143 792 403 -53 -832 -502 -215 -142 -281 427 169 1140 1625 223 153 -33 90 -95 286 -460 -424 103 0 -480 -52 119 35 344 -477 -264 -86 -306 -152 -852 -409 -787 -310 -1033 -431 -600 -197 -474 -316 -237 -355 -79 -34 44 -363 -171 -486 -149 -515 -147 -536 -312 -163 -300 -12 -196 75 -214 -64 -253 -70 -297 -113 -466 -107 -195 -113 95 -9 146 -58 127 139 532 208 457 287 425 138 285 20 -84 118 161 592 295 679 222 169 269 292 237 712 257 135 -330 -207 13 -349 77 -167 147 25 135 -350 -563 -1002 -663 -597 -635 -380 -452 110 -33 759 223 759 913 910 439 762 318 -563 -154 -143 242 804 467 -1610 -865 -912 -867 -305 -254 -525 -686 150 464 758 1638 1149 615 -87 -1422 -845 -346 -221 -422 612 233 1504 2231 351 271 -64 185 -206 602 -1046 -1011 249 1 -1185 -123 265 78 753 SS 20240312T045539.4Z 8837.205317 58 1 51.93 2 78.24 87.42 105.00 89.05 0.00 1 0.00 1 0 25 9.536e-02 5.786e-03 2.018e-02 6.798e-04 5.233828e-01 3.483760e-04 5.223035e-03 -6.000000e+00 5.400555e-02 227.37 -2.00 3.06 -2.00 320.46 0.00e+00 1.718849e-03 1.303258e-04 7.786384e-04 -6.000000e+00 2.393080e-03 282.14 -2.00 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