File name: Pandora206s1_BuffaloNY_20240410_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T075048.3Z 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_20240410_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: 20240410 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 20240410T141742.9Z 8866.595635 144 1 24.01 2 52.20 118.33 62.08 89.73 0.00 1 0.00 1 0 17 4.405e-02 1.132e-02 4.558e-02 8.848e-03 2.980643e-01 4.374517e-03 3.569057e-03 -6.000000e+00 2.467198e-02 227.93 -2.00 3.55 -2.00 318.09 0.00e+00 7.886931e-04 7.672788e-04 1.746455e-04 -6.000000e+00 1.066044e-03 277.45 -2.00 20.00 -2.00 317.44 0.00e+00 1.628 0.000 302.00 328.00 3 7.3583e+00 1.1730e-02 2.2408e-02 -6.0000e+00 6.1463e-02 3.2949e-02 1.3296e-02 1.5528e-02 -6.0000e+00 6.6881e-02 1.8158e-02 8.6563e-03 7.6438e-03 -6.0000e+00 3.9706e-02 -1.5601e-02 4.4796e-03 2.2832e-03 -6.0000e+00 1.6809e-02 4.5058e-05 -1.8712e-04 2.4637e-04 2.2846e-05 -6.0000e+00 1.1225e-03 -1.2168e-02 2.2439e-04 12 8 8 10 0 0 99.26 18.07 1.15 -0.01217 -0.01357 6 6 2 8 0 4000.000 15.00 18.07 20.09 21.58 21.48 21.7 1044.89 -703 19534 14033 13691 5906 9099 8669 18999 -1162 7987 -9320 21379 -2802 -7220 -1563 1297 11785 -1918 -991 -2712 6055 5342 2958 -1419 -1075 -1698 4916 3418 -6985 -793 -1506 -1278 323 -3441 152 -3576 -7047 -5719 3245 -1233 -475 -1334 2120 346 2094 -1588 -3902 -4038 1893 -805 1972 834 -1234 615 2684 -5488 569 512 492 504 1945 2189 -154 1837 310 971 -1519 -2414 30 -124 2247 1467 1259 1002 1626 -3841 -1130 -1669 -2251 -2277 -244 809 -2821 -367 -600 730 1299 1150 1294 1699 449 768 -1223 -1794 0 -22 1371 665 1013 167 120 -781 -1221 -1504 -340 -1748 -1066 923 -472 318 -40 444 -1592 168 140 -7 -657 -517 -830 456 618 -437 -75 466 1201 233 -198 709 375 -557 809 550 355 -531 3 -554 312 1019 174 367 -234 -1598 57 -45 1148 908 842 353 504 514 1137 -96 642 -877 1512 -289 -878 -208 189 1621 -317 -170 -491 1029 899 522 -279 -221 -368 1040 689 -1443 -153 -317 -291 80 -924 36 -856 -1926 -1786 1085 -511 -214 -633 1007 169 1001 -791 -1958 -1985 865 -379 964 445 -710 369 1631 -3566 367 329 308 312 1222 1480 -113 1425 244 697 -1076 -1682 22 -100 1937 1328 1138 871 1301 -2987 -773 -1091 -1558 -1797 -206 751 -2818 -372 -655 844 1523 1392 1571 2027 498 800 -1189 -1699 0 -25 1615 857 1382 225 155 -934 -1405 -1744 -427 -2338 -1437 1282 -698 486 -65 730 -2568 254 195 -10 -888 -728 -1224 708 972 -681 -114 670 1668 312 -260 930 518 -832 1225 860 565 -885 5 -1007 574 1855 321 669 -414 -2750 96 SS 20240410T143226.8Z 8866.605865 152 1 9.14 2 49.86 121.93 59.43 92.12 0.00 1 0.00 1 0 17 1.476e-02 6.232e-03 1.269e-02 3.961e-03 2.732548e-01 1.966108e-03 3.306531e-03 -6.000000e+00 8.261352e-03 227.93 -2.00 3.55 -2.00 317.31 0.00e+00 7.757356e-04 2.790750e-04 8.384001e-05 -6.000000e+00 3.571578e-04 277.45 -2.00 20.00 -2.00 316.67 0.00e+00 1.548 0.000 302.00 328.00 3 5.2953e+00 5.1949e-03 2.0904e-02 -6.0000e+00 2.0581e-02 -9.5855e-04 5.8477e-03 1.4150e-02 -6.0000e+00 2.2398e-02 -4.2122e-03 3.5460e-03 6.9899e-03 -6.0000e+00 1.3297e-02 -2.0582e-03 1.7567e-03 2.0441e-03 -6.0000e+00 5.6273e-03 4.0979e-04 9.2706e-06 1.0882e-04 2.1207e-05 -6.0000e+00 3.7610e-04 -1.1650e-02 1.3929e-04 12 1 1 12 1 1 99.89 18.06 0.36 -0.01165 -0.01158 6 21 2 8 0 1304.180 15.01 18.06 20.91 21.58 21.48 21.6 1049.48 -8810 602 -1271 -2375 -3783 -1211 -2217 201 4281 -228 -1832 -5109 -3475 -2287 323 -1515 629 -332 410 2861 1853 -1106 104 -359 -502 1953 -1222 668 -3665 2242 1480 2344 1521 586 -1755 -3369 -2645 -1306 -63 -1185 -537 -1122 402 -873 145 -505 -528 -1031 69 -81 1333 619 1828 1194 86 565 388 1771 2113 -54 177 1721 1258 1656 348 -220 -240 -963 683 -105 729 276 585 -159 507 -252 -212 -164 -110 -1009 -1166 -582 -1980 -1085 -812 -1246 -396 -308 -31 266 22 412 -101 419 326 -65 639 683 377 -199 -174 -972 -575 -229 -756 -552 -285 -433 -601 -8 357 180 74 -81 -372 559 -476 652 240 391 365 -87 280 403 822 688 710 703 494 154 323 -322 76 -181 -85 -20 50 295 -145 -168 -631 -527 -286 -966 66 -147 -278 -390 -116 -229 23 518 -31 -244 -717 -547 -410 61 -324 137 -76 97 685 457 -276 26 -97 -142 560 -364 183 -963 587 394 666 477 193 -542 -1027 -884 -499 -29 -606 -298 -651 237 -526 86 -303 -310 -594 39 -45 786 395 1148 799 60 399 280 1252 1453 -38 127 1312 995 1401 297 -181 -185 -727 540 -91 685 271 571 -150 441 -208 -158 -123 -82 -863 -1064 -585 -2044 -1155 -928 -1463 -484 -389 -39 321 26 436 -103 414 343 -73 752 896 502 -259 -222 -1148 -665 -275 -953 -729 -374 -599 -873 -11 557 283 111 -119 -503 736 -635 899 342 593 538 -133 415 569 1145 917 894 895 681 218 479 -495 117 -280 -140 -33 84 512 -254 -284 -1077 -866 -458 SS 20240410T143718.0Z 8866.609236 154 1 45.79 2 49.11 123.17 58.56 92.93 0.00 1 0.00 1 0 17 9.161e-03 5.057e-03 3.011e-03 8.744e-04 2.657049e-01 4.312996e-04 3.210687e-03 -6.000000e+00 5.128397e-03 227.93 -2.00 3.55 -2.00 317.57 0.00e+00 4.904653e-04 6.483103e-05 6.142361e-05 -6.000000e+00 2.217379e-04 277.45 -2.00 20.00 -2.00 316.91 0.00e+00 1.525 0.000 302.00 328.00 3 3.8621e+00 1.1438e-03 2.0457e-02 -6.0000e+00 1.2776e-02 -1.8101e-02 1.2906e-03 1.3748e-02 -6.0000e+00 1.3904e-02 -7.3122e-04 7.8807e-04 6.7927e-03 -6.0000e+00 8.2545e-03 -3.1959e-03 3.9287e-04 1.9520e-03 -6.0000e+00 3.4930e-03 1.7959e-03 7.8637e-05 2.4151e-05 2.0014e-05 -6.0000e+00 2.3351e-04 -1.1024e-02 1.3117e-04 10 0 0 10 0 0 99.97 18.06 0.24 -0.01102 -0.01043 294 91 1 8 0 155.710 15.00 18.06 21.18 21.58 21.48 21.7 1051.91 -1904 -2568 -790 -2060 -2090 -3884 -541 -545 -1223 -854 -3236 -2201 -1315 -669 267 435 -94 776 -252 866 669 403 878 398 349 98 38 -697 -1106 191 1086 685 1758 -393 -1925 -2054 -1919 -1465 -421 -338 -737 -614 -547 -475 -205 -395 -646 -370 -1018 -89 828 662 750 931 593 893 790 544 503 498 1046 1179 1515 1565 300 -203 -409 -608 338 509 583 292 344 410 316 9 -363 -776 -395 -538 -1041 -854 -1885 -1527 -1062 -729 -295 -80 465 245 381 326 228 250 458 267 538 661 97 -152 -59 -618 -663 -5 -632 -781 -673 -552 -255 178 394 163 189 -25 -172 -17 72 170 231 83 -166 -61 224 207 626 269 486 809 492 379 129 97 -268 80 -61 -8 -49 219 -46 -121 -220 -390 -468 -190 -258 -88 -218 -193 -349 -50 -57 -143 -106 -401 -274 -185 -107 49 88 -20 169 -58 203 160 95 211 102 94 28 11 -186 -272 46 278 189 525 -124 -567 -589 -608 -535 -167 -158 -378 -327 -301 -263 -112 -218 -349 -195 -528 -46 450 386 461 605 399 608 551 378 341 335 722 877 1224 1242 239 -162 -305 -442 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