File name: Pandora206s1_BuffaloNY_20231124_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T065458.5Z 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_20231124_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: 20231124 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 20231124T154402.6Z 8728.655586 266 1 24.00 2 66.06 160.06 125.29 18.43 0.00 1 0.00 1 0 17 3.318e-01 3.060e-02 2.254e-01 2.569e-02 3.178877e-01 1.271937e-02 4.188393e-03 -6.000000e+00 1.847149e-01 222.60 -2.00 3.55 -2.00 318.78 0.00e+00 3.516396e-03 2.804248e-03 1.675242e-03 -6.000000e+00 8.639673e-03 276.73 -2.00 20.00 -2.00 318.18 0.00e+00 2.446 0.000 302.00 328.00 3 7.8394e+00 3.4645e-02 3.0150e-02 -6.0000e+00 4.5586e-01 7.0482e-02 3.9970e-02 2.1241e-02 -6.0000e+00 4.9897e-01 5.6880e-02 2.9417e-02 8.2841e-03 -6.0000e+00 2.9432e-01 -2.2136e-02 1.5712e-02 4.2418e-03 -6.0000e+00 1.2658e-01 1.2094e-05 -6.5290e-04 7.3917e-04 3.4063e-05 -6.0000e+00 8.7174e-03 -1.8208e-02 -7.0478e-05 12 8 8 10 0 0 -66.67 17.88 2.53 -0.01821 -0.02311 6 6 2 8 0 4000.000 15.00 17.88 6.71 21.38 21.27 18.5 905.55 -6257 900000 91633 900000 77697 900000 -59652 900000 -50832 900000 169673 261061 47127 33933 70074 -14679 89122 13640 33390 -9665 42783 1075 45892 13369 3828 7940 3676 4475 -10174 35559 -9568 12665 5192 20848 9711 1848 3587 13009 6010 -7296 10837 -195 1819 -4669 16073 -7813 -9029 -23649 13160 -4916 4577 -2223 35 2605 4919 777 -7315 3501 -6640 -1941 -3037 11326 -8204 5434 -4650 3519 -2605 735 2253 -4810 1701 -4578 4111 2291 5891 -2008 1599 -1529 -4379 -1286 -548 3368 1560 -1981 1327 4904 323 -1275 1910 4914 -308 2012 -3542 -147 -1537 -2572 2631 1127 1067 606 3621 -2039 230 -3105 3326 -4375 787 817 729 -21 2244 642 -2739 -920 -583 1942 -4969 -231 -1541 -4067 -946 -1912 1695 2984 248 -1014 -72 2223 3955 -3760 2510 -685 1612 -705 406 -720 704 2466 1071 842 -716 -2229 -743 -273 900000 2294 900000 1945 900000 -4431 900000 -4268 900000 4247 6534 1966 1925 3274 -1766 4164 1388 2939 -1366 3662 137 3944 1630 535 1109 543 621 -1536 3560 -1607 1871 918 3316 1592 318 669 2552 1524 -2498 3395 -71 680 -1896 5321 -3324 -3856 -11533 4410 -1993 1807 -1016 16 1277 2435 407 -4235 1806 -3699 -1025 -1680 5889 -5703 3576 -3405 2185 -1613 431 1384 -3639 1323 -3944 3230 1754 4024 -1368 954 -901 -2817 -920 -425 2795 1409 -1929 1342 5128 371 -1535 2237 5352 -325 1957 -3345 -131 -1484 -2710 2945 1435 1447 805 4362 -2376 251 -3616 3977 -5733 1023 1118 1053 -33 3650 1078 -4583 -1408 -815 2563 -7030 -326 -2283 -6571 -1498 -2991 2576 4272 344 -1364 -91 2770 5260 -5807 3854 -1119 2622 -1217 715 -1346 1321 4653 2057 1562 -1336 -4050 -1292 SS 20231124T161309.8Z 8728.675808 285 1 27.96 2 64.57 167.38 123.23 26.34 0.00 1 0.00 1 0 17 3.284e-02 8.119e-03 2.747e-02 5.137e-03 3.107517e-01 2.490252e-03 3.733085e-03 -6.000000e+00 1.802526e-02 222.60 -2.00 3.55 -2.00 318.27 0.00e+00 8.925883e-04 4.665757e-04 9.530226e-05 -6.000000e+00 7.925269e-04 276.72 -2.00 20.00 -2.00 317.65 0.00e+00 2.314 0.000 302.00 328.00 3 6.0049e+00 6.6461e-03 2.7474e-02 -6.0000e+00 4.4377e-02 3.9793e-02 7.5831e-03 1.5799e-02 -6.0000e+00 4.8486e-02 5.4734e-03 5.0588e-03 7.9166e-03 -6.0000e+00 2.8889e-02 -8.2909e-03 2.6545e-03 2.4451e-03 -6.0000e+00 1.2358e-02 9.1887e-05 9.4409e-05 1.4285e-04 2.4330e-05 -6.0000e+00 8.3613e-04 -1.1620e-02 1.4212e-04 11 8 0 10 0 0 99.93 17.88 0.45 -0.01162 -0.01091 11 11 1 8 0 2541.730 15.01 17.88 8.15 21.38 21.27 18.9 916.91 -1979 14408 7207 -6876 -10506 2697 1370 732 -148 3985 6043 -26937 5490 -3620 -1561 1129 2382 3059 1398 3769 1994 1760 302 125 -2293 -885 -2171 -937 -1996 672 1501 1793 2742 529 -3156 -3248 116 -1648 -2983 -1427 1526 -2886 708 -678 -552 -489 -178 -3241 -8 357 -186 705 786 1727 848 763 781 2246 613 320 76 1412 1465 1523 -150 -2728 10 -1244 1245 -261 1694 388 1268 1789 1580 -748 -4025 -357 -1466 -867 -1816 -208 -1679 -877 -1068 177 267 26 553 771 986 386 -513 -15 1214 -599 464 505 670 -237 297 -653 -599 -1421 -411 -1553 -936 -334 -46 698 166 -30 -453 494 -822 -231 -674 66 -21 348 -117 322 793 79 1273 734 -229 749 961 -47 -233 -207 -256 368 29 215 -80 441 14 -82 -317 -475 -597 -115 791 443 -458 -658 142 78 47 -11 299 437 -2689 476 -387 -190 151 330 442 215 590 324 282 50 22 -442 -176 -441 -183 -365 120 290 376 630 130 -739 -741 28 -458 -1017 -567 645 -1283 315 -309 -250 -231 -83 -1524 -4 162 -91 355 419 969 497 456 477 1342 363 188 46 918 1043 1131 -113 -2010 7 -831 867 -205 1427 344 1110 1491 1264 -546 -2755 -234 -995 -669 -1542 -193 -1635 -883 -1158 204 311 31 665 915 1072 400 -493 -14 1203 -651 558 658 895 -321 374 -785 -671 -1671 -524 -2032 -1275 -475 -67 1082 267 -49 -715 742 -1184 -311 -914 94 -30 542 -186 497 1189 118 1772 1015 -303 997 1343 -71 -362 -332 -418 622 51 395 -147 823 27 -153 -569 -822 -1042 SS 20231124T173850.7Z 8728.735309 332 1 24.01 2 64.17 189.62 113.92 46.78 0.00 1 0.00 1 0 17 2.216e-01 2.319e-02 1.900e-01 1.796e-02 3.066876e-01 8.746121e-03 3.699697e-03 -6.000000e+00 1.217381e-01 222.60 -2.00 3.55 -2.00 318.49 0.00e+00 3.854548e-03 1.764390e-03 8.647872e-04 -6.000000e+00 5.347335e-03 276.72 -2.00 20.00 -2.00 317.89 0.00e+00 2.281 0.000 302.00 328.00 3 7.5767e+00 2.3552e-02 2.7575e-02 -6.0000e+00 2.9972e-01 9.1840e-02 2.6916e-02 1.7990e-02 -6.0000e+00 3.2737e-01 5.1356e-02 1.8784e-02 7.8275e-03 -6.0000e+00 1.9506e-01 -2.9804e-02 1.0022e-02 4.4884e-03 -6.0000e+00 8.3532e-02 1.8656e-05 6.3606e-04 5.0255e-04 3.6143e-05 -6.0000e+00 5.6409e-03 -2.0575e-02 5.0687e-05 12 8 8 10 0 0 -125.34 17.90 1.53 -0.02058 -0.01580 6 6 2 8 0 4000.000 15.00 17.90 8.82 21.38 21.27 18.5 917.32 -37592 37246 99117 50740 37405 112826 52685 51672 40622 27402 150241 6747 41009 4465 2332 13012 23460 -1917 11546 -8588 5169 200 35936 14760 -6929 7472 -4047 10997 -6949 21438 1785 15907 6627 602 -9803 -14457 -15040 -2851 10766 -5121 14107 -5110 5722 -4614 -1706 -5980 -4671 -15353 1937 3661 4973 3334 -1795 3353 -2144 2106 -3019 -1538 -4756 2075 -3919 6196 2167 1261 -780 -3986 -337 -2309 6406 -2219 2185 -260 3727 913 3246 -3567 -3576 515 -4588 -3675 -1218 1970 -4470 2089 -646 2452 683 1937 1464 1748 1878 -2043 486 -2315 1033 -2771 2830 293 2508 1476 4113 -1108 -1528 -288 1091 -2409 -913 292 427 860 -1030 736 -3982 2015 -2485 2283 -2168 -1245 -2202 -270 591 -1190 1866 562 1324 -538 -948 -40 2085 -2976 2301 -1303 -304 -1503 -527 1618 971 849 214 1197 -710 283 -1177 -2674 1452 2256 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