File name: Pandora206s1_BuffaloNY_20231210_L2Fit_fout2c1d20220512p1-8.txt File generation date: 20240113T142457.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Kang Sun Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 206 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora206_OF_v3d20211008.txt Instrument calibration file used: Pandora206s1_CF_v1d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20231210_L1_smca1c1d20220512p1-8.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: 20231210 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]: 305.0398 305.1808 305.3218 305.4628 305.6038 305.7447 305.8857 306.0266 306.1675 306.3084 306.4493 306.5902 306.7311 306.8720 307.0128 307.1537 307.2945 307.4353 307.5761 307.7169 307.8577 307.9985 308.1393 308.2800 308.4207 308.5615 308.7022 308.8429 308.9836 309.1243 309.2649 309.4056 309.5462 309.6869 309.8275 309.9681 310.1087 310.2493 310.3899 310.5305 310.6710 310.8116 310.9521 311.0926 311.2331 311.3736 311.5141 311.6546 311.7950 311.9355 312.0759 312.2164 312.3568 312.4972 312.6376 312.7779 312.9183 313.0587 313.1990 313.3394 313.4797 313.6200 313.7603 313.9006 314.0408 314.1811 314.3214 314.4616 314.6018 314.7421 314.8823 315.0225 315.1626 315.3028 315.4430 315.5831 315.7232 315.8634 316.0035 316.1436 316.2837 316.4238 316.5638 316.7039 316.8439 316.9839 317.1240 317.2640 317.4040 317.5439 317.6839 317.8239 317.9638 318.1038 318.2437 318.3836 318.5235 318.6634 318.8033 318.9431 319.0830 319.2228 319.3627 319.5025 319.6423 319.7821 319.9219 320.0616 320.2014 320.3412 320.4809 320.6206 320.7603 320.9000 321.0397 321.1794 321.3191 321.4587 321.5984 321.7380 321.8776 322.0172 322.1568 322.2964 322.4360 322.5755 322.7151 322.8546 322.9941 323.1336 323.2731 323.4126 323.5521 323.6916 323.8310 323.9705 324.1099 324.2493 324.3887 324.5281 324.6675 324.8069 324.9462 --------------------------------------------------------------------------------------- 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 20231210T162307.7Z 8744.682728 210 1 24.01 2 66.73 168.78 66.21 200.31 0.00 1 0.00 1 0 25 4.154e-01 2.182e-02 2.645e-01 1.797e-02 3.712036e-01 8.762665e-03 4.343527e-03 -6.000000e+00 2.280817e-01 222.39 -2.00 3.55 -2.00 319.06 0.00e+00 1.584332e-03 2.086479e-03 4.641166e-04 -6.000000e+00 9.946486e-03 274.92 -2.00 20.00 -2.00 318.50 0.00e+00 2.512 0.000 302.00 328.00 3 7.0224e+00 2.3972e-02 3.0914e-02 -6.0000e+00 5.6163e-01 8.1880e-02 2.7865e-02 1.9275e-02 -6.0000e+00 6.1361e-01 3.8945e-02 2.1624e-02 9.4798e-03 -6.0000e+00 3.6532e-01 -1.7137e-02 1.1604e-02 3.4553e-03 -6.0000e+00 1.5631e-01 2.3909e-05 5.2654e-04 5.0288e-04 3.0362e-05 -6.0000e+00 1.0568e-02 8.5931e-03 1.0295e-04 12 8 8 10 0 0 83.40 18.11 1.63 0.00859 0.01255 6 6 2 8 0 4000.000 15.00 18.11 13.11 21.58 21.48 19.4 959.11 53112 405794 128166 81536 25648 113170 -44731 86756 -61989 62097 49744 68631 19873 -1336 18696 36606 13663 8671 23280 -2983 24059 5283 13274 23026 11103 -13302 4769 266 1187 7993 11042 -4362 11429 4302 -4864 3224 -4201 2215 3956 -2967 -1071 2932 2502 -1089 4388 -6510 -3681 -22011 339 -2717 -4355 -1311 -5258 -1899 -514 375 934 1596 -2086 -5903 1789 7762 -2720 -1319 -1733 2673 13958 2343 4127 -1298 1387 2180 6917 833 3657 1448 1774 -1475 -2475 -4118 -1729 351 -3105 -4891 -1233 308 1829 1603 5141 606 -185 -92 -1549 -1923 -2324 -1278 1871 598 1240 1405 1635 -1523 -1379 -2172 1528 -3468 901 1108 183 632 1016 -675 -2404 -1735 -2296 -275 -567 -1729 92 1123 349 268 1893 1147 382 -320 -1113 -1131 122 -831 1645 1078 55 -360 53 650 744 1083 724 976 -869 -1922 -1238 931 7110 2246 1429 599 1983 -2099 1520 -4243 1414 1278 1523 820 -82 1110 2090 1050 745 1829 -319 2013 526 1253 2121 1218 -1955 596 33 136 867 1292 -661 1654 710 -816 483 -748 429 915 -850 -333 920 822 -377 1437 -2403 -1312 -9341 119 -998 -1752 -540 -2398 -895 -249 184 466 812 -1070 -3106 898 3979 -1656 -865 -1159 1636 7211 1340 2475 -915 1047 1701 5117 625 2540 917 1018 -841 -1521 -2963 -1379 297 -2921 -4880 -1272 335 2054 1859 5768 682 -193 -90 -1432 -1748 -2287 -1352 2153 784 1724 1908 2069 -1811 -1559 -2463 1826 -4567 1187 1538 271 978 1680 -1159 -4068 -2730 -3445 -380 -784 -2526 141 1806 569 426 2884 1681 552 -444 -1478 -1525 177 -1279 2626 1795 95 -646 98 1251 1457 2160 1452 1875 -1673 -3576 -2221 SS 20231210T164942.2Z 8744.701183 223 1 2.36 2 66.06 175.41 68.17 206.55 0.00 1 0.00 1 0 17 4.282e-02 9.028e-03 6.222e-02 1.012e-02 3.468693e-01 4.916003e-03 4.224788e-03 -6.000000e+00 2.349236e-02 222.39 -2.00 3.55 -2.00 318.34 0.00e+00 1.019472e-03 9.398469e-04 2.047568e-04 -6.000000e+00 1.025533e-03 274.92 -2.00 20.00 -2.00 317.75 0.00e+00 2.447 0.000 302.00 328.00 3 4.0910e+00 1.3142e-02 2.9679e-02 -6.0000e+00 5.7846e-02 -3.8044e-03 1.4986e-02 1.7821e-02 -6.0000e+00 6.3218e-02 -6.5234e-03 1.0173e-02 8.8931e-03 -6.0000e+00 3.7634e-02 4.2184e-03 5.3798e-03 2.7709e-03 -6.0000e+00 1.6092e-02 5.3235e-04 9.7760e-05 2.7861e-04 2.7995e-05 -6.0000e+00 1.0898e-03 1.0379e-02 -5.5730e-05 12 9 1 12 1 1 999.00 18.11 0.55 0.01038 0.01111 1 23 2 8 0 1177.180 15.00 18.11 13.32 21.58 21.48 19.4 960.42 -13079 -1749 -10916 2146 411 15612 -1755 -8695 15186 -19490 17298 -10845 13523 -8855 -112 -6238 4029 -2129 1311 -9422 101 -3800 -3005 9519 -808 2912 -2598 -4503 -7393 4569 -610 6239 -2936 2589 -3278 -4044 -2089 -3070 1575 -939 473 -708 2153 -1533 1893 -2069 2659 -2954 -450 1324 858 2215 1806 1644 1353 251 416 1893 -748 1253 -957 1241 1021 -130 636 174 381 -506 836 1288 1301 772 124 -920 950 594 -983 -1195 -1176 -1223 -796 -706 -1514 -1130 -491 -1472 38 -641 -326 905 -498 1639 -1507 1898 176 -290 1348 370 306 -248 -99 -63 -596 113 -67 -1060 -1106 -520 -601 519 393 -66 -426 714 -1312 1026 -822 -396 -778 554 -126 -247 138 448 1902 -76 1376 794 1326 465 -32 190 874 572 -716 -986 422 -51 45 -43 -499 -432 -647 -712 -95 -682 112 20 616 -88 -510 815 -1539 966 -808 951 -892 -12 -819 506 -301 188 -1570 16 -602 -486 1460 -145 528 -504 -839 -1320 730 -113 1189 -682 600 -744 -899 -504 -843 501 -354 194 -299 919 -688 820 -940 1174 -1324 -196 591 403 1114 944 919 788 151 249 1141 -451 733 -590 791 700 -98 481 122 258 -341 595 998 1108 672 108 -795 764 439 -672 -808 -827 -964 -691 -667 -1512 -1146 -532 -1688 44 -773 -393 1035 -543 1683 -1476 1804 179 -324 1592 476 419 -334 -127 -76 -683 133 -85 -1389 -1487 -718 -863 780 620 -107 -670 1081 -1902 1395 -1143 -561 -1165 852 -197 -386 210 663 2684 -107 1853 1070 1899 711 -50 308 1436 963 -1255 -1787 769 -96 84 -79 -888 -750 -1118 SS 20231210T165432.1Z 8744.704539 226 1 46.09 2 66.00 176.63 68.57 207.66 0.00 1 0.00 1 0 17 1.880e-02 4.881e-03 1.009e-02 1.310e-03 3.483693e-01 6.369351e-04 4.164090e-03 -6.000000e+00 1.031659e-02 222.39 -2.00 3.55 -2.00 318.91 0.00e+00 4.386797e-04 1.429415e-04 1.287436e-04 -6.000000e+00 4.503485e-04 274.92 -2.00 20.00 -2.00 318.32 0.00e+00 2.442 0.000 302.00 328.00 3 3.2622e+00 1.7303e-03 2.9612e-02 -6.0000e+00 2.5403e-02 -1.1266e-02 1.9967e-03 1.7703e-02 -6.0000e+00 2.7762e-02 5.4292e-03 1.4661e-03 8.9310e-03 -6.0000e+00 1.6527e-02 -7.7252e-03 7.7875e-04 2.6666e-03 -6.0000e+00 7.0667e-03 1.2303e-03 -2.8692e-05 3.6824e-05 2.7142e-05 -6.0000e+00 4.7857e-04 1.0413e-02 -5.1055e-05 10 0 0 10 0 0 99.98 18.10 0.20 0.01041 0.01020 261 81 1 8 0 175.880 15.00 18.10 13.38 21.58 21.48 19.5 961.53 -6780 -5441 -7205 -6225 -5458 -4882 -7306 -2705 -4323 -3100 -3523 -6332 -4601 -3371 2944 -340 -1461 645 784 -102 613 1 -98 -1106 -793 -169 -50 103 -2470 128 588 2205 1362 -100 -1875 -2640 -2028 -1756 -753 -308 -1251 -1013 -598 -754 337 -607 -770 -952 -695 -530 489 682 785 1146 939 899 607 838 320 414 879 1265 1460 1942 387 -49 -357 -426 500 364 711 418 329 349 372 -308 -320 -683 -421 -902 -687 -655 -1909 -1551 -1112 -467 -268 58 385 423 453 465 173 337 543 127 571 764 311 -249 -172 -609 -739 -137 -666 -971 -722 -482 -395 247 335 251 76 72 -173 220 -74 128 -79 -126 -350 -106 270 140 852 310 623 775 625 276 207 -90 -300 46 21 -157 -49 232 -29 -84 -46 -341 -447 -251 -223 -315 -257 -215 -185 -304 -121 -223 -155 -193 -371 -281 -240 231 -31 -145 66 85 -12 71 0 -12 -143 -108 -24 -7 14 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