File name: Pandora159s1_Wakkerstroom_20210110_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T024413.3Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: B. Scholes Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 159 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora159_OF_v5d20191004.txt Instrument calibration file used: Pandora159s1_CF_v3d20201207.txt Level 1 file used: Pandora159s1_Wakkerstroom_20210110_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: 20210110 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 20210110T034253.0Z 7680.154780 105 1 48.01 2 85.11 112.19 48.78 94.49 0.00 1 0.00 1 0 25 7.032e-01 7.900e-02 5.371e-01 6.641e-02 9.697156e-01 3.985169e-02 1.009968e-02 -6.000000e+00 4.172744e-01 227.66 -2.00 3.06 -2.00 321.89 0.00e+00 -6.731268e-03 1.243140e-02 6.561020e-03 -6.000000e+00 1.972611e-02 282.31 -2.00 20.00 -2.00 321.33 0.00e+00 10.023 0.006 302.00 328.00 3 1.6551e+00 1.2816e-01 9.8064e-02 -6.0000e+00 1.0440e+00 1.8597e+00 1.5085e-01 5.9608e-02 -6.0000e+00 1.1440e+00 -2.1380e+00 8.5435e-02 2.2805e-02 -6.0000e+00 6.7121e-01 8.4440e-01 4.9440e-02 6.7951e-03 -6.0000e+00 2.8993e-01 8.4530e-06 -5.1390e-03 1.7727e-03 1.0393e-04 -6.0000e+00 2.0134e-02 1.6040e-03 12 8 8 10 0 0 40.66 19.55 0.85 0.00160 -0.03701 12 3 4 8 0 4000.000 15.00 19.55 19.96 21.69 21.69 14.5 909.97 900000 900000 687 -60128 152808 70515 900000 171346 900000 53619 -19264 -68500 900000 137856 900000 71598 -11940 38390 900000 900000 95071 164462 900000 337522 74684 -58502 16841 900000 70677 -84796 900000 65950 -30405 211722 900000 900000 -66683 88796 -18608 900000 126893 129285 900000 39830 138798 900000 900000 -7049 122756 900000 900000 900000 28136 900000 227757 37810 86502 158095 -222 102656 6475 96821 -3405 83453 23207 97519 101728 23398 22693 103874 36938 -20841 8210 13746 12885 8397 43194 51423 33757 84826 -15460 -19403 7628 2070 10347 29834 9917 4363 53261 -7209 19256 43937 -9928 60 1544 -15948 15260 2375 -7122 1068 -3296 88 -18941 6037 -7252 -9218 -7124 -9702 -1186 -1643 -10643 -6306 -378 3807 -1470 869 -8260 -4157 -1125 9236 9481 6379 -4124 -1237 22649 10216 8400 3445 -4778 4643 1833 2334 861 748 -208 -2225 3397 709 1700 1105 -4942 -8730 4153 900000 900000 95 -12622 9852 4546 900000 11047 900000 3457 -1798 -10407 900000 8888 900000 4616 -1713 3377 900000 900000 6130 10603 900000 21761 4815 -10211 1325 900000 4557 -13529 900000 4252 -4071 13650 900000 900000 -10730 5725 -2461 900000 8181 8335 900000 3597 8949 900000 900000 -861 7914 900000 900000 900000 3380 900000 14684 4735 6833 10193 -36 6619 863 6242 -581 6970 3711 7551 7491 3795 4053 9694 7166 -7256 2096 3047 2555 1517 5114 5738 5032 9257 -5242 -7915 2676 813 3956 9898 4149 1956 14752 -3430 6623 11191 -4178 24 708 -10228 8550 1751 -6417 915 -2799 65 -14778 3567 -5166 -7113 -5668 -8558 -1076 -1734 -14160 -8906 -526 5076 -2001 1121 -11684 -5887 -1629 12511 12499 8201 -5556 -1577 22257 11023 8930 4018 -6995 7300 3355 4639 1863 1743 -525 -6040 8864 1919 4512 2822 -12283 -20505 8093 SS 20210110T035717.8Z 7680.164789 108 1 49.50 2 82.13 110.67 45.66 93.13 0.00 1 0.00 1 0 25 5.496e-01 9.162e-03 3.347e-01 5.384e-03 7.471670e-01 2.964586e-03 7.259776e-03 -6.000000e+00 3.121078e-01 227.66 -2.00 3.06 -2.00 321.76 0.00e+00 8.189384e-03 1.649495e-03 5.689279e-03 -6.000000e+00 1.381089e-02 282.31 -2.00 20.00 -2.00 321.25 0.00e+00 6.830 0.002 302.00 328.00 3 1.3572e+00 1.1095e-02 7.6806e-02 -6.0000e+00 7.7554e-01 1.5830e-01 1.6728e-02 6.6603e-02 -6.0000e+00 8.4306e-01 -1.5839e-01 1.8176e-02 2.0557e-02 -6.0000e+00 5.0230e-01 4.7063e-02 8.3230e-03 1.3038e-02 -6.0000e+00 2.1312e-01 2.4300e-04 -1.3391e-03 1.5039e-04 8.1396e-05 -6.0000e+00 1.4722e-02 2.0248e-03 11 8 0 10 0 0 34.34 19.55 0.33 0.00202 -0.00804 101 22 4 8 0 490.030 15.00 19.55 20.67 21.69 21.69 14.5 914.62 -176898 -187123 -141711 -132240 -210376 -234169 -231573 -199984 -214528 -88922 -57136 -105728 -90058 -80006 900000 -7061 -66949 -86944 -12285 -56343 -49931 -42759 14746 -26167 -36795 -49796 -12490 -13909 -22296 8346 2037 -21603 -6275 -14295 5717 30295 9087 -15190 7809 -4675 -1362 386 -7933 -10469 6794 6785 1528 -9397 346 2814 -2653 10296 3063 2417 1849 4375 -4457 -1103 818 5347 642 2681 8611 3668 4035 5514 3667 4563 6181 2443 4381 831 1381 -141 -773 73 1424 1541 -3188 -1449 -1440 -694 -1994 -466 -1922 -1717 -1582 -82 168 275 1551 843 -247 2049 903 -326 485 -535 -759 -445 421 432 1449 -418 -1981 -680 4670 -870 -1292 -597 -622 -504 -547 73 623 1052 1003 110 -409 -661 -862 -324 -338 -421 735 608 1400 1065 -315 453 425 402 276 473 -74 -428 91 184 -1031 186 -72 16 75 -929 -1071 -744 -694 -1532 -2104 -2167 -1544 -2136 -467 -300 -555 -482 -531 900000 -37 -737 -1311 -99 -743 -635 -509 105 -298 -497 -801 -144 -162 -288 91 29 -485 -142 -378 121 505 204 -509 257 -206 -65 20 -466 -657 372 386 95 -687 25 212 -237 923 323 280 229 551 -626 -150 106 657 86 393 1370 702 819 1101 743 958 1420 671 1302 265 433 -42 -212 18 326 365 -903 -484 -567 -312 -995 -243 -1079 -1024 -991 -52 107 168 877 451 -130 1105 558 -239 410 -524 -815 -479 422 390 1179 -347 -1781 -639 4393 -925 -1528 -788 -916 -792 -869 112 908 1477 1421 164 -651 -1085 -1402 -504 -504 -612 1025 819 1819 1459 -495 806 829 836 606 1102 -184 -1123 241 493 -2796 481 -175 38 166 SS 20210110T040343.2Z 7680.169250 111 1 50.40 2 80.80 110.00 44.27 92.52 0.00 1 0.00 1 0 25 3.531e-01 7.190e-03 1.999e-01 2.591e-03 6.542646e-01 1.394293e-03 6.447884e-03 -6.000000e+00 2.003891e-01 227.66 -2.00 3.06 -2.00 321.35 0.00e+00 7.050739e-03 6.834639e-04 1.413057e-03 -6.000000e+00 8.873401e-03 282.31 -2.00 20.00 -2.00 320.79 0.00e+00 5.947 0.001 302.00 328.00 3 1.0636e+00 4.7968e-03 5.8554e-02 -6.0000e+00 4.9791e-01 6.9036e-02 6.7030e-03 3.6621e-02 -6.0000e+00 5.4111e-01 -7.3695e-02 7.0309e-03 1.6747e-02 -6.0000e+00 3.2227e-01 2.0101e-02 3.3424e-03 1.0330e-02 -6.0000e+00 1.3683e-01 7.2022e-04 -9.9897e-04 7.3122e-05 8.4437e-05 -6.0000e+00 9.4431e-03 1.9329e-03 11 8 0 10 0 0 26.69 19.55 0.27 0.00193 -0.00557 192 41 4 8 0 257.100 15.00 19.55 21.27 21.69 21.69 14.6 918.20 46709 -155288 -65656 -136854 -119829 -171385 -145727 -64190 -128110 6928 -120971 27572 -48640 36135 -46084 -24088 -36817 -18423 -34490 -10132 -5583 -34647 42363 -42835 -4171 -39669 -10612 -33098 -5305 -24451 -15820 -22593 -4815 -1896 -18313 4978 -11639 7965 -4147 4504 -5757 843 -4622 2057 77 1744 -693 -122 3022 1248 4811 -1134 7792 -256 2606 263 2299 -1551 -1656 2309 280 3531 2149 3598 -1078 2688 702 2803 500 1223 -169 2077 -281 -244 286 -164 1903 -937 1475 -1137 1134 -1202 -831 -1279 -957 -869 -400 -492 -32 245 637 1260 819 2195 448 792 608 645 -1054 -45 -126 -145 694 -49 -1319 -1298 -2847 -988 -149 -171 -78 -230 7 256 298 1145 620 399 -244 -552 -865 425 -133 178 696 414 1097 1765 215 149 361 -207 282 137 -182 -611 216 -191 -288 -376 157 88 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