File name: Pandora206s1_BuffaloNY_20220621_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T034452.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: ---- 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_v2d20211008.txt Instrument calibration file used: Pandora206s1_CF_v4d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20220621_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: 20220621 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 20220621T121425.5Z 8207.510017 195 1 28.01 2 64.05 81.32 45.98 192.18 0.00 1 0.00 1 0 17 2.345e-01 2.048e-02 1.288e-01 1.329e-02 3.381444e-01 6.737233e-03 4.230793e-03 -6.000000e+00 1.340538e-01 232.88 -2.00 3.55 -2.00 318.47 0.00e+00 -2.861702e-03 1.326333e-03 7.157625e-04 -6.000000e+00 5.859984e-03 285.07 -2.00 20.00 -2.00 317.68 0.00e+00 2.271 0.000 302.00 328.00 3 7.2102e+00 1.8438e-02 2.9040e-02 -6.0000e+00 3.3716e-01 1.3685e-01 2.1057e-02 1.8385e-02 -6.0000e+00 3.6479e-01 1.6583e-02 1.4139e-02 9.4429e-03 -6.0000e+00 2.1668e-01 -1.7272e-02 7.3276e-03 3.4599e-03 -6.0000e+00 9.1590e-02 2.5599e-05 -1.4691e-03 3.7226e-04 3.2097e-05 -6.0000e+00 5.9824e-03 -2.4414e-02 2.4498e-04 12 8 8 10 0 0 89.89 22.06 2.29 -0.02441 -0.03545 7 7 2 8 0 4000.000 19.00 22.06 26.03 25.47 25.39 10.1 1005.31 16178 24089 -18334 -8746 42081 41911 697 30637 -33718 243161 48238 20622 -15214 464 -11639 14145 28376 9300 -706 -15744 15491 -4079 32934 -23714 9538 -19636 511 11948 19215 -8031 9752 10760 17904 6411 12442 7696 3462 3794 1764 -352 -2286 4159 2825 -1644 -4478 4388 -8483 3475 2445 3639 5489 -1174 -1986 -7243 -2716 2660 102 -3577 4177 -1641 -360 1797 250 -3674 2416 -2924 -5157 -2506 1788 1710 -1799 4505 579 1498 82 756 992 1891 -2984 -2508 -496 42 -1990 263 2345 -1594 2571 -576 -608 -239 2777 -737 5851 -2624 141 427 2513 1845 2309 296 -1276 -1720 -1703 200 -1188 -1941 -2671 3190 -1872 102 603 1710 -1205 155 1054 481 -2289 -1030 -3042 -782 161 -2496 944 274 1604 1308 -858 1830 2078 -443 1841 881 -243 691 -698 -942 177 1860 -783 216 -619 165 -1011 642 995 -1181 -495 1296 1262 33 1229 -2875 3153 2138 1178 -1399 42 -1331 1461 2690 1115 -98 -2579 1977 -628 3589 -4817 1542 -4359 98 1927 2624 -1396 1521 1809 3083 1327 2273 1400 718 910 525 -129 -928 1663 1184 -728 -2014 1861 -4028 1430 1005 1483 2335 -581 -1053 -4186 -1572 1541 61 -2209 2395 -976 -215 1118 167 -2776 1753 -2072 -3586 -1655 1185 1300 -1526 3766 506 1246 67 543 639 1174 -1951 -1854 -407 38 -1939 261 2434 -1852 3012 -699 -742 -289 3004 -755 5310 -2486 137 460 2869 2375 3091 399 -1689 -2098 -1970 230 -1472 -2558 -3690 4369 -2752 157 991 2850 -2009 238 1521 650 -3147 -1451 -4671 -1217 253 -3942 1446 405 2206 1778 -1125 2325 2844 -650 2803 1405 -399 1163 -1232 -1759 335 3525 -1538 406 -1122 293 -1758 SS 20220621T122721.1Z 8207.518994 201 1 45.95 2 61.70 83.36 46.50 196.52 0.00 1 0.00 1 0 17 1.766e-02 5.895e-03 3.052e-02 5.242e-03 2.870951e-01 2.651109e-03 3.413984e-03 -6.000000e+00 1.008823e-02 232.88 -2.00 3.55 -2.00 318.62 0.00e+00 3.188513e-04 5.292890e-04 1.446250e-04 -6.000000e+00 4.411475e-04 285.07 -2.00 20.00 -2.00 317.81 0.00e+00 2.099 0.000 302.00 328.00 3 5.5682e+00 7.2872e-03 2.5765e-02 -6.0000e+00 2.5372e-02 9.1155e-03 8.2982e-03 1.5354e-02 -6.0000e+00 2.7456e-02 2.4961e-02 5.4636e-03 7.4519e-03 -6.0000e+00 1.6308e-02 -1.5869e-02 2.8171e-03 2.0938e-03 -6.0000e+00 6.8906e-03 1.7942e-04 -2.8458e-04 1.4998e-04 2.0667e-05 -6.0000e+00 4.5044e-04 -2.3391e-02 1.7940e-04 10 0 0 10 0 0 99.99 22.06 1.11 -0.02339 -0.02553 185 57 1 8 0 248.330 18.99 22.06 26.83 25.47 25.39 10.2 1010.35 5022 5863 -1148 2610 7196 -2663 2699 3212 -1399 3472 3583 5419 2045 -2387 -413 -595 696 141 281 -4535 -802 3098 -2102 -7608 576 214 -623 2782 -3580 -718 2072 1051 4713 -307 2256 -1705 1108 1030 -573 -93 -1824 -2148 -490 -640 -1007 -379 -1324 89 -1886 -1412 544 1623 290 45 610 437 935 457 39 2214 757 641 1012 1147 637 -694 -1632 40 -180 837 1073 -39 607 865 920 397 -5 -477 -386 -573 -1127 -789 -1905 -860 -1169 -905 199 433 534 359 1008 816 -367 -141 314 244 882 796 479 -125 -313 -649 -410 -679 -973 -793 -923 -276 -272 134 240 604 -181 -224 -464 234 -629 155 -185 243 -381 -140 173 -44 758 257 346 815 232 11 665 15 -274 97 475 -20 -343 304 -267 273 57 -586 -501 259 335 -74 154 354 -137 140 187 -96 245 250 375 166 -235 -46 -75 91 19 40 -712 -125 458 -334 -1368 101 39 -117 477 -602 -115 349 193 918 -67 441 -333 231 249 -170 -33 -722 -892 -208 -275 -432 -163 -565 37 -778 -580 233 743 142 24 329 241 525 258 22 1186 423 386 663 810 457 -463 -1020 24 -113 600 847 -33 506 693 686 266 -4 -302 -255 -392 -874 -678 -1777 -827 -1211 -1007 231 519 644 417 1074 796 -331 -134 315 247 990 1002 646 -167 -392 -750 -440 -751 -1187 -1018 -1239 -386 -400 211 400 1019 -297 -343 -652 305 -826 210 -271 379 -612 -220 266 -64 1151 375 477 1120 346 18 1119 24 -444 162 846 -38 -664 599 -535 528 106 -1059 -880 SS 20220621T123434.3Z 8207.524009 204 1 46.28 2 60.39 84.52 46.87 198.90 0.00 1 0.00 1 0 17 1.241e-02 5.958e-03 1.065e-02 2.571e-03 2.757743e-01 1.294654e-03 3.310420e-03 -6.000000e+00 7.094048e-03 232.88 -2.00 3.55 -2.00 317.89 0.00e+00 -1.054476e-04 2.152230e-04 9.484297e-05 -6.000000e+00 3.101314e-04 285.07 -2.00 20.00 -2.00 317.09 0.00e+00 2.015 0.000 302.00 328.00 3 5.3722e+00 3.4931e-03 2.4743e-02 -6.0000e+00 1.7842e-02 2.5404e-02 3.9419e-03 1.4738e-02 -6.0000e+00 1.9305e-02 9.1669e-03 2.4535e-03 7.1268e-03 -6.0000e+00 1.1467e-02 -8.2856e-03 1.2388e-03 1.9434e-03 -6.0000e+00 4.8464e-03 2.4065e-04 6.7763e-05 7.1721e-05 2.0043e-05 -6.0000e+00 3.1664e-04 -2.4185e-02 2.1741e-04 10 0 0 10 0 0 99.95 22.05 0.51 -0.02418 -0.02368 47 15 1 8 0 984.570 19.00 22.05 27.13 25.47 25.39 10.2 1011.63 -867 -746 -1140 -4284 -790 -4761 1515 4654 -483 3470 434 -427 -3272 -372 -1814 -567 -990 1319 -84 5213 1011 364 1952 -1023 1276 763 -85 1154 -2266 -1401 1550 -50 1613 -273 -1266 -2562 -1279 -882 -159 -821 -1598 -969 -292 -990 -808 -493 -1507 -855 -609 -310 336 601 1169 843 61 1504 80 389 1082 234 523 1254 1164 1703 905 -602 -385 -1350 806 206 1144 627 361 352 731 -178 -473 -816 -997 -840 -1154 -897 -2109 -1045 -1084 -558 55 265 568 308 653 779 653 31 120 -73 596 1051 619 -304 -155 -625 -981 -325 -367 -949 -797 -362 -246 211 501 411 112 40 -310 -59 -329 -24 -459 131 -552 -262 267 171 337 473 162 878 796 195 698 144 -157 -130 92 -68 -12 479 -119 -47 104 -578 -650 -66 -63 -101 -374 -60 -356 113 378 -47 347 44 -44 -392 -50 -273 -94 -173 234 -16 969 201 72 387 -223 287 180 -21 268 -499 -299 344 -12 422 -77 -332 -652 -353 -280 -58 -363 -760 -477 -148 -511 -413 -252 -790 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