File name: Pandora206s1_BuffaloNY_20240310_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T074700.8Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: Kang Sun Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 206 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora206_OF_v3d20211008.txt Instrument calibration file used: Pandora206s1_CF_v4d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20240310_L1_smca1c4d20220512p1-8.txt Full location name: University at Buffalo Short location name: BuffaloNY Country of location: Canada Location latitude [deg]: 43.0015 Location longitude [deg]: -78.7869 Location altitude [m]: 190 Local noon date: 20240310 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are latency correction, matrix method stray light correction (replaced by simple method) Data caveats: None First and last pixel inside fitting window: 223 365 Nominal wavelengths inside fitting window [nm]: 305.0744 305.2154 305.3564 305.4973 305.6383 305.7792 305.9201 306.0611 306.2020 306.3428 306.4837 306.6246 306.7654 306.9063 307.0471 307.1879 307.3287 307.4695 307.6103 307.7511 307.8918 308.0326 308.1733 308.3140 308.4548 308.5955 308.7362 308.8768 309.0175 309.1582 309.2988 309.4394 309.5801 309.7207 309.8613 310.0019 310.1424 310.2830 310.4236 310.5641 310.7046 310.8451 310.9857 311.1261 311.2666 311.4071 311.5476 311.6880 311.8285 311.9689 312.1093 312.2497 312.3901 312.5305 312.6708 312.8112 312.9515 313.0919 313.2322 313.3725 313.5128 313.6531 313.7934 313.9336 314.0739 314.2141 314.3543 314.4946 314.6348 314.7750 314.9151 315.0553 315.1955 315.3356 315.4758 315.6159 315.7560 315.8961 316.0362 316.1763 316.3163 316.4564 316.5964 316.7364 316.8765 317.0165 317.1565 317.2964 317.4364 317.5764 317.7163 317.8563 317.9962 318.1361 318.2760 318.4159 318.5558 318.6956 318.8355 318.9753 319.1152 319.2550 319.3948 319.5346 319.6744 319.8141 319.9539 320.0937 320.2334 320.3731 320.5128 320.6525 320.7922 320.9319 321.0716 321.2112 321.3509 321.4905 321.6301 321.7697 321.9093 322.0489 322.1885 322.3280 322.4676 322.6071 322.7467 322.8862 323.0257 323.1652 323.3046 323.4441 323.5836 323.7230 323.8624 324.0018 324.1413 324.2806 324.4200 324.5594 324.6988 324.8381 324.9774 --------------------------------------------------------------------------------------- Column 1: Two letter code of measurement routine Column 2: UT date and time for center-time of measurement, yyyymmddThhmmssZ (ISO 8601) Column 3: Fractional days since 1-Jan-2000 midnight for center-time of measurement Column 4: Routine count (1 for the first routine of the day, 2 for the second, etc.) Column 5: Repetition count (1 for the first set in the routine, 2 for the second, etc.) Column 6: Total duration of measurement set in seconds Column 7: Data processing type index Column 8: Solar zenith angle for center-time of measurement in degree Column 9: Solar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 10: Lunar zenith angle for center-time of measurement in degree Column 11: Lunar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 12: Pointing zenith angle in degree, absolute or relative (see next column), 999=tracker not used Column 13: Zenith pointing mode: zenith angle is... 0=absolute, 1=relative to sun, 2=relative to moon Column 14: Pointing azimuth in degree, increases clockwise, absolute (0=north) or relative (see next column), 999=tracker not used Column 15: Azimuth pointing mode: like zenith angle mode but also fixed scattering angles relative to sun (3) or moon (4) Column 16: Fitting result index: 0=no error or warning, 1, 2=warning, >2=error Column 17: Number of function evaluations used, 0=linear fitting or fitting not successful or no fitting done Column 18: rms of unweighted fitting residuals, -9=fitting not successful Column 19: Normalized rms of fitting residuals weighted with independent uncertainty, -9=fitting not successful or no uncertainty used Column 20: Expected rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 21: Expected normalized weighted rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 22: Ozone slant column amount [moles per square meter], -9e99=fitting not successful Column 23: Independent uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 24: Structured uncertainty of ozone slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 25: Common uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 26: rms-based uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 27: Ozone effective temperature [K] Column 28: Independent uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 29: Structured uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 30: Common uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 31: Effective ozone fitting wavelength [nm], -9=fitting not successful Column 32: Diffuse correction applied before fitting at effective fitting wavelength for ozone [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 33: Sulfur dioxide slant column amount [moles per square meter], -9e99=fitting not successful Column 34: Independent uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 35: Structured uncertainty of sulfur dioxide slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 36: Common uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 37: rms-based uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 38: Sulfur dioxide effective temperature [K] Column 39: Independent uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 40: Structured uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 41: Common uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 42: Effective sulfur dioxide fitting wavelength [nm], -9=fitting not successful Column 43: Diffuse correction applied before fitting at effective fitting wavelength for sulfur dioxide [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 44: Molecular scattering air mass factor used for molecular scattering subtraction before the fitting Column 45: Estimated uncertainty of molecular scattering air mass factor, -9=molecular scattering was not subtracted before the fitting Column 46: Lower limit used for wavelength scaling [nm] Column 47: Upper limit used for wavelength scaling [nm] Column 48: Order of smoothing polynomial Column 49: Smoothing polynomial coefficient, order 0 Column 50: Independent uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 51: Structured uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 52: Common uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 53: rms-based uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 54: Smoothing polynomial coefficient, order 1 Column 55: Independent uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 56: Structured uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 57: Common uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 58: rms-based uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 59: Smoothing polynomial coefficient, order 2 Column 60: Independent uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 61: Structured uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 62: Common uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 63: rms-based uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 64: Smoothing polynomial coefficient, order 3 Column 65: Independent uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 66: Structured uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 67: Common uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 68: rms-based uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 69: Mean value of measured data inside fitting window [same units as measurements] Column 70: Wavelength change polynomial coefficient, order 0 Column 71: Independent uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 72: Structured uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 73: Common uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 74: rms-based uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 75: L1 based wavelength change coefficient, order 0, -9=no L1 wavelength change determination Column 76: L1 based wavelength change coefficient, order 1, -9=no L1 wavelength change determination Column 77: L2Fit data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 78: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ1 limit, 0=L1 data quality above 0, 1=Spectral fitting was not successful, 2=Wavelength shift too large, 3=Normalized rms of fitting residuals weighted with independent uncertainty too large Column 79: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 80: L1 data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 81: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ1 limit, 0=Saturated data, 1=Too few dark counts measurements, 2=No temperature given or effective temperature too different from the reference temperature, 3=Dark count too high, 4=Unsuccessful dark background fitting, 5=The dark count differs significantly from the dark map for too many pixels, 6=Absolute value of estimated average residual stray light level too high, 7=Although attempted, no wavelength change could be retrieved, 8=Absolute value of retrieved wavelength shift too large, 9=Retrieved wavelength shift differs too much from the shift predicted by the effective temperature Column 82: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 83: Atmospheric variability [%], 999=no atmospheric variability was determined Column 84: Wavelength effective temperature [°C], 999=no effective temperature given Column 85: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 86: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 87: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 88: Number of bright count cycles Column 89: Number of dark count cycles Column 90: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 91: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 92: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 93: Integration time [ms] Column 94: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Temperature at electronics board 1 [°C], 999=no temperature signal Column 98: Temperature at electronics board 2 [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: Normalized slant column residuals weighted with independent instrumental uncertainty for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting, 0=no independent instrumental uncertainty was given --------------------------------------------------------------------------------------- SS 20240310T143029.8Z 8835.604512 137 1 24.00 2 61.12 128.07 64.67 124.99 0.00 1 0.00 1 0 17 5.647e-01 2.735e-02 3.220e-01 2.188e-02 4.254499e-01 1.093907e-02 5.031803e-03 -6.000000e+00 3.153172e-01 225.68 -2.00 3.55 -2.00 319.43 0.00e+00 6.499827e-04 2.865434e-03 9.273774e-04 -6.000000e+00 1.439016e-02 274.16 -2.00 20.00 -2.00 318.89 0.00e+00 2.061 0.000 302.00 328.00 3 7.8691e+00 3.0520e-02 3.0315e-02 -6.0000e+00 7.8157e-01 7.2250e-02 3.5641e-02 2.2757e-02 -6.0000e+00 8.5294e-01 5.5724e-02 2.9144e-02 1.1070e-02 -6.0000e+00 5.0482e-01 -3.9055e-02 1.5552e-02 3.3558e-03 -6.0000e+00 2.1391e-01 1.4225e-05 -1.0263e-03 6.1302e-04 3.3252e-05 -6.0000e+00 1.4558e-02 -9.0872e-03 9.4051e-05 12 8 8 10 0 0 62.74 17.65 0.47 -0.00909 -0.01680 6 6 2 8 0 4000.000 15.00 17.65 8.51 21.17 21.06 20.0 967.57 -45146 119755 75055 111732 81506 900000 26636 348546 251933 370250 900000 18776 48571 40336 149060 18183 -43407 -44750 5932 -19363 75455 -23851 78388 29204 731 83849 11952 45270 -33003 62200 1627 38329 1648 17091 12119 6787 12336 6881 13630 -6495 -13713 -10196 16947 -8590 20817 2150 -14160 -16272 7517 -1825 2056 3566 -9926 3502 3347 4011 -2121 8088 6466 -4982 -1407 8179 -3864 3072 -3827 175 -75 -1631 5064 -4450 5441 -443 6470 1460 492 -4476 -2860 -2684 -7827 550 1047 204 -4465 -1736 31 3248 302 1660 -1614 2486 -369 445 763 -2405 -2571 -2621 2060 254 3003 993 4205 -563 -372 -3047 3112 -2091 165 1170 -1150 1394 606 1900 -5274 1685 -2259 -868 -2545 -810 -1021 2136 207 385 -14 524 1944 -1388 -422 -190 2026 -2897 1677 61 -743 -426 696 299 1130 131 -322 819 260 -766 -1095 -1274 2554 1601 2383 1738 900000 568 7434 5373 7897 900000 481 1105 1204 3179 913 -4096 -4599 403 -1781 2951 -2337 3065 1969 68 3815 1068 2834 -4114 3272 166 3138 213 2016 1397 805 1538 1059 2398 -1625 -4095 -3097 4225 -2720 5064 618 -4777 -5595 2119 -580 684 1279 -4228 1401 1402 1711 -988 3488 2750 -2338 -656 3761 -2155 1755 -2385 100 -41 -905 2829 -3055 3717 -334 4508 1016 328 -2786 -1599 -1455 -4810 360 777 166 -4095 -1616 30 3294 330 1839 -1848 2611 -366 416 660 -2123 -2470 -2751 2325 330 4041 1332 5094 -649 -406 -3499 3665 -2633 212 1575 -1686 2165 992 3149 -9124 2632 -3385 -1207 -3604 -1176 -1586 3386 335 602 -21 784 2715 -1919 -548 -252 2888 -4574 2703 104 -1309 -780 1347 608 2322 269 -665 1650 502 -1422 -1980 SS 20240310T161652.6Z 8835.678387 197 1 24.01 2 49.22 157.21 51.51 151.40 0.00 1 0.00 1 0 25 1.391e-01 2.055e-02 1.080e-01 1.421e-02 3.346972e-01 6.969532e-03 4.002579e-03 -6.000000e+00 7.716960e-02 225.68 -2.00 3.55 -2.00 318.47 0.00e+00 3.299290e-03 1.359979e-03 5.920561e-04 -6.000000e+00 3.320320e-03 274.17 -2.00 20.00 -2.00 317.89 0.00e+00 1.528 0.000 302.00 328.00 3 7.9623e+00 1.8785e-02 2.3267e-02 -6.0000e+00 1.9145e-01 8.4866e-02 2.1420e-02 1.8435e-02 -6.0000e+00 2.0884e-01 -7.4638e-03 1.4619e-02 8.5879e-03 -6.0000e+00 1.2396e-01 -3.9379e-03 7.6915e-03 3.9832e-03 -6.0000e+00 5.2544e-02 2.4721e-05 2.2584e-04 3.9478e-04 3.3054e-05 -6.0000e+00 3.5424e-03 -7.8936e-03 1.9759e-04 12 8 8 10 0 0 84.24 17.61 1.90 -0.00789 -0.00620 6 6 2 8 0 4000.000 15.00 17.61 6.28 21.17 21.06 19.9 953.42 -20814 30832 -19572 73948 -2539 48459 -16118 81192 -14715 55411 6307 9677 23895 -18058 11839 -10916 28626 -4512 14861 -10192 27147 -16082 15329 -7399 24227 395 -72 -3629 -23063 3275 -4054 10995 -1538 18253 -4139 5485 -13944 3428 3566 1371 -4872 -2580 2825 -2269 5412 -3840 1171 -8575 9647 -1557 4875 -1402 -83 179 4806 -1033 849 492 -970 17855 -3222 7093 -4235 407 -197 765 -5082 343 -2687 -1905 3749 583 1001 643 2480 -3388 -1677 -3427 -3116 -4475 1131 449 -2929 -2722 -51 2598 1820 1498 384 1628 -1088 695 -2219 -440 -1872 1386 692 1535 58 919 2398 -1621 905 -3269 -85 -2387 -128 718 845 -439 932 1159 -1889 -486 -2122 608 -1804 -449 -2311 1510 850 -94 848 -258 1688 -243 -1014 1229 1517 -801 1225 -821 1323 -1595 1497 -155 377 -109 747 -93 1080 -1101 -1776 -1311 1335 -1422 2116 -132 1495 -970 2105 -1071 2180 385 595 1501 -2049 1174 -1495 2876 -666 1899 -1687 3245 -2898 2058 -1317 3263 70 -13 -637 -4605 511 -751 1924 -338 3439 -895 1048 -3569 852 1066 493 -2034 -1097 1183 -1013 2239 -1758 504 -4011 3731 -681 2145 -708 -44 100 2640 -609 500 288 -561 8476 -1955 4212 -3000 298 -145 529 -3502 220 -1897 -1483 3012 501 848 538 1874 -2417 -1068 -2205 -2069 -3456 932 414 -2885 -2783 -54 2889 2136 1815 470 1881 -1183 700 -2117 -403 -1877 1503 820 2021 79 1252 3002 -1925 1004 -3807 -105 -3147 -172 1010 1253 -689 1533 1929 -3114 -736 -3082 809 -2467 -634 -3561 2373 1353 -148 1283 -376 2351 -330 -1312 1585 2123 -1197 1897 -1338 2149 -2775 2615 -287 709 -210 1431 -172 1955 -1950 -3086 SS 20240310T173524.8Z 8835.732926 240 1 6.15 2 46.77 183.49 47.16 176.09 0.00 1 0.00 1 0 17 1.491e-02 5.808e-03 1.366e-02 3.896e-03 2.928575e-01 1.913239e-03 3.549966e-03 -6.000000e+00 8.272840e-03 225.69 -2.00 3.55 -2.00 317.45 0.00e+00 5.288246e-04 2.812643e-04 7.836866e-05 -6.000000e+00 3.560250e-04 274.17 -2.00 20.00 -2.00 316.87 0.00e+00 1.458 0.000 302.00 328.00 3 4.9568e+00 5.0423e-03 2.0844e-02 -6.0000e+00 2.0524e-02 -4.9505e-03 5.6867e-03 1.4972e-02 -6.0000e+00 2.2390e-02 -5.8438e-03 3.5038e-03 7.4658e-03 -6.0000e+00 1.3290e-02 -6.1111e-04 1.7655e-03 2.1694e-03 -6.0000e+00 5.6323e-03 6.0899e-04 2.1016e-04 1.0666e-04 2.2108e-05 -6.0000e+00 3.7991e-04 -7.7530e-03 1.3898e-04 12 1 1 12 1 1 99.91 17.60 0.38 -0.00775 -0.00617 6 31 2 8 0 878.300 15.00 17.60 7.16 21.17 21.06 19.8 958.24 -5369 1766 -6185 3482 -8323 352 -3036 568 -2649 -3601 -811 -3167 1325 -2801 1013 -45 -673 -765 2944 -434 1418 195 1196 13 2940 1151 -702 -69 -2541 1544 1556 992 946 127 -2660 -1955 -3182 -1091 -48 -153 -340 -915 -415 -1037 -317 -1260 207 -511 -266 -608 904 684 341 1738 361 1106 295 1008 220 857 649 645 1618 1808 3 122 290 -548 666 300 322 -12 103 201 356 -725 -101 -475 -701 -849 -629 -1039 -1939 -1338 -994 -205 92 129 71 236 542 135 55 357 214 406 598 633 211 21 -122 -988 -805 52 -701 -799 -768 -859 -156 -61 374 187 445 157 -710 386 92 356 115 364 -105 8 242 386 394 563 611 875 245 471 501 -88 -64 -300 -213 -537 329 -43 -21 -328 79 -388 -355 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