File name: Pandora64s1_NewHavenCT_20240815_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240816T050741.4Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 64 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora64_OF_v3d20190516.txt Instrument calibration file used: Pandora64s1_CF_v4d20190911.txt Level 1 file used: Pandora64s1_NewHavenCT_20240815_L1_smca1c4d20190911p1-8.txt Full location name: New Haven - Criscuolo Park CTDEEP (USEPA AQS ID 34-017-0006) Short location name: NewHavenCT Country of location: USA Location latitude [deg]: 41.3014 Location longitude [deg]: -72.9029 Location altitude [m]: 4 Local noon date: 20240815 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: Mod WL cal slit func 9 First and last pixel inside fitting window: 249 390 Nominal wavelengths inside fitting window [nm]: 305.1279 305.2688 305.4097 305.5506 305.6915 305.8324 305.9732 306.1141 306.2549 306.3958 306.5366 306.6774 306.8182 306.9590 307.0997 307.2405 307.3812 307.5220 307.6627 307.8034 307.9441 308.0848 308.2255 308.3662 308.5068 308.6475 308.7881 308.9287 309.0693 309.2099 309.3505 309.4911 309.6316 309.7722 309.9127 310.0533 310.1938 310.3343 310.4748 310.6153 310.7557 310.8962 311.0366 311.1771 311.3175 311.4579 311.5983 311.7387 311.8791 312.0195 312.1598 312.3002 312.4405 312.5808 312.7211 312.8614 313.0017 313.1420 313.2822 313.4225 313.5627 313.7030 313.8432 313.9834 314.1236 314.2638 314.4039 314.5441 314.6842 314.8244 314.9645 315.1046 315.2447 315.3848 315.5249 315.6649 315.8050 315.9450 316.0851 316.2251 316.3651 316.5051 316.6451 316.7850 316.9250 317.0649 317.2049 317.3448 317.4847 317.6246 317.7645 317.9044 318.0442 318.1841 318.3239 318.4638 318.6036 318.7434 318.8832 319.0230 319.1628 319.3025 319.4423 319.5820 319.7217 319.8614 320.0011 320.1408 320.2805 320.4202 320.5598 320.6995 320.8391 320.9787 321.1183 321.2579 321.3975 321.5371 321.6766 321.8162 321.9557 322.0953 322.2348 322.3743 322.5138 322.6532 322.7927 322.9322 323.0716 323.2110 323.3504 323.4899 323.6292 323.7686 323.9080 324.0474 324.1867 324.3260 324.4654 324.6047 324.7440 324.8833 --------------------------------------------------------------------------------------- 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: Temperature at electronics board [°C], 999=no temperature signal Column 95: Spectrometer control temperature [°C], 999=no temperature signal Column 96: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 97: Temperature in head sensor [°C], 999=no temperature signal Column 98: Humidity in head sensor [%], -9=no humidity signal Column 99: Pressure in head sensor [hPa], -9=no pressure signal Columns 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: 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 20240815T114847.9Z 8993.492221 96 1 48.44 2 71.10 88.01 161.11 306.42 0.00 1 0.00 1 0 25 7.678e-02 7.502e-03 1.231e-02 1.107e-03 4.671216e-01 6.028163e-04 5.489144e-03 -6.000000e+00 4.710227e-02 231.79 -2.00 3.52 -2.00 319.05 0.00e+00 6.847101e-04 1.504471e-04 3.675884e-04 -6.000000e+00 2.110628e-03 289.99 -2.00 20.00 -2.00 318.24 0.00e+00 3.049 0.000 302.00 328.00 3 2.7617e+00 1.6852e-03 3.9522e-02 -6.0000e+00 1.1784e-01 3.1365e-02 1.9533e-03 2.4782e-02 -6.0000e+00 1.2688e-01 -1.2768e-02 1.4101e-03 1.2085e-02 -6.0000e+00 7.5664e-02 -2.8871e-03 7.3787e-04 3.3592e-03 -6.0000e+00 3.2114e-02 8.7372e-04 -5.6543e-04 3.3557e-05 3.8867e-05 -6.0000e+00 2.2867e-03 -9.7512e-04 -5.3651e-05 11 8 0 10 0 0 87.30 21.40 0.20 -0.00098 -0.00522 100 24 1 5 0 484.380 25.90 20.02 21.40 27.20 40.2 1032.29 -12811 -22559 -13206 -26539 -64730 -24817 -10984 -23985 -5496 -15751 -10360 -15043 -7449 -8213 -3365 -528 -2762 -499 -150 107 438 1074 454 -843 -341 789 -1181 -2296 -1044 -4007 290 -818 1915 456 -4834 -3080 -2798 -1565 83 789 -937 -112 -159 -431 -170 279 -382 519 -833 -646 1637 1822 1247 1409 392 810 979 755 438 372 816 1348 1282 3150 1336 -1007 187 -773 665 1674 436 526 -509 49 -70 -1001 -508 -2084 -891 -355 -1359 -853 -1840 -2109 -665 -629 323 402 1114 586 444 527 -439 127 743 344 -212 971 620 -570 -594 -1615 -1752 196 224 -1482 -269 -706 -293 278 881 207 197 81 35 -158 607 -273 613 256 -254 -303 649 18 998 697 -895 585 801 314 454 -579 -533 -261 429 -107 -495 343 186 -300 79 -674 -289 -611 -337 -719 -2426 -648 -276 -779 -165 -556 -361 -632 -350 -467 -216 -37 -213 -41 -13 10 40 99 45 -84 -36 85 -128 -241 -118 -459 36 -115 292 71 -760 -506 -522 -344 20 216 -283 -35 -52 -143 -57 94 -130 178 -297 -244 664 743 549 662 192 410 502 384 220 189 436 786 765 1976 841 -618 113 -486 462 1209 339 417 -397 36 -50 -658 -318 -1352 -642 -273 -1191 -778 -1800 -2073 -693 -691 367 461 1251 626 467 520 -421 127 772 403 -265 1258 829 -744 -762 -1926 -2026 236 288 -1911 -364 -1017 -433 423 1408 335 308 126 51 -226 880 -417 942 405 -399 -462 1001 27 1478 996 -1271 831 1246 505 777 -993 -952 -472 819 -203 -961 670 358 -580 146 -1207 SS 20240815T115438.1Z 8993.496274 99 1 48.34 2 70.01 88.96 161.93 309.24 0.00 1 0.00 1 0 25 1.235e-01 1.293e-02 2.722e-02 2.635e-03 4.471169e-01 1.433671e-03 5.398860e-03 -6.000000e+00 7.578615e-02 231.79 -2.00 3.52 -2.00 319.13 0.00e+00 2.274672e-03 3.623799e-04 1.257497e-03 -6.000000e+00 3.395684e-03 289.99 -2.00 20.00 -2.00 318.32 0.00e+00 2.893 0.000 302.00 328.00 3 4.4816e+00 4.0247e-03 3.7873e-02 -6.0000e+00 1.8960e-01 5.9766e-02 4.6663e-03 2.4285e-02 -6.0000e+00 2.0413e-01 -4.5417e-02 3.3266e-03 1.1963e-02 -6.0000e+00 1.2173e-01 1.3762e-02 1.7330e-03 3.3938e-03 -6.0000e+00 5.1678e-02 1.8403e-04 -5.7964e-04 8.0991e-05 4.3486e-05 -6.0000e+00 3.6785e-03 -4.6530e-04 2.5513e-05 12 8 8 10 0 0 97.47 21.41 0.07 -0.00047 -0.00482 24 6 1 5 0 2013.840 25.90 20.01 21.41 27.57 40.2 1034.32 -16957 -12202 2643 -4561 -130096 -24891 -21354 -17574 15835 11560 -16339 -170 -8704 -9605 1150 -2035 5846 15318 2473 7998 -1202 7688 12346 4810 -3220 4119 276 -5192 -3219 -11570 -1460 1333 5342 859 -2943 258 -969 -803 797 -773 202 1484 1495 -2602 1678 1374 1150 493 -276 -3167 4354 1214 4346 1258 1461 1344 2303 -550 639 240 893 1692 2639 3540 2015 -1394 791 51 566 1241 1146 635 809 -643 -634 -2060 27 -2907 -1071 -622 -1661 -1735 -1851 -1891 -572 -988 802 -179 1170 511 -868 -618 -2226 -865 -303 331 -249 1198 409 -205 -786 -1603 -2308 -55 -94 -1557 -780 537 7 878 1372 815 628 280 -484 -354 358 -405 424 744 -176 263 1013 672 1367 611 -1435 809 718 308 462 -812 -661 -568 233 -185 -283 393 440 -370 -174 -877 -486 -362 70 -120 -10094 -767 -692 -615 436 350 -674 -7 -434 -579 74 -151 429 1106 213 683 -114 669 1087 487 -352 433 30 -567 -361 -1439 -186 183 782 132 -448 40 -173 -170 189 -213 59 454 475 -869 544 451 379 166 -95 -1189 1661 493 1828 581 693 658 1133 -275 311 119 464 913 1543 2192 1248 -848 467 31 383 895 878 500 618 -472 -443 -1328 16 -1834 -743 -471 -1372 -1592 -1734 -1878 -603 -1063 883 -202 1282 554 -885 -588 -2151 -825 -318 373 -304 1537 545 -265 -988 -1939 -2723 -67 -119 -2068 -1054 758 11 1347 2213 1327 990 431 -707 -520 517 -616 657 1182 -280 418 1552 983 1978 856 -2004 1175 1102 495 788 -1406 -1190 -1045 439 -362 -562 788 870 -705 -329 -1601 SS 20240815T120505.5Z 8993.503536 102 1 48.40 2 68.04 90.68 163.31 314.86 0.00 1 0.00 1 0 25 3.421e-02 7.310e-03 5.419e-03 7.969e-04 4.059963e-01 4.319597e-04 4.802242e-03 -6.000000e+00 2.098785e-02 231.79 -2.00 3.52 -2.00 318.41 0.00e+00 6.550883e-04 8.791084e-05 3.181895e-04 -6.000000e+00 9.404321e-04 289.99 -2.00 20.00 -2.00 317.57 0.00e+00 2.651 0.000 302.00 328.00 3 2.6214e+00 1.1763e-03 3.4319e-02 -6.0000e+00 5.2506e-02 2.5313e-02 1.3387e-03 2.1450e-02 -6.0000e+00 5.6535e-02 -9.2053e-03 8.8603e-04 1.0416e-02 -6.0000e+00 3.3714e-02 -2.7696e-03 4.5802e-04 2.8696e-03 -6.0000e+00 1.4310e-02 1.6007e-03 -4.5337e-04 2.4423e-05 3.3600e-05 -6.0000e+00 1.0189e-03 -1.1413e-03 -4.5788e-05 11 8 0 10 0 0 94.22 21.40 0.15 -0.00114 -0.00455 146 35 1 5 0 331.480 25.90 20.02 21.40 28.30 40.1 1037.61 -7211 -4133 -4529 -9439 -30571 -6853 -10281 -2917 -4709 -4493 -9491 -5352 -3811 -1081 -1078 901 -1502 931 -404 1595 -231 -78 1007 788 -247 460 -458 -1625 -1339 -1900 965 -310 1482 -1174 -4994 -2958 -1397 -1564 452 268 -477 -886 282 -943 -312 234 -587 -56 -392 -350 1457 927 1402 1307 434 821 1092 377 263 547 583 1415 1542 2393 1089 -1055 61 -1306 997 1655 413 375 -239 343 -75 -953 -659 -1927 -679 -313 -1289 -802 -2045 -1855 -585 -397 51 207 967 508 396 508 -559 80 775 423 -125 1000 333 -450 -555 -1582 -1811 280 334 -1414 -361 -733 -194 333 788 269 298 251 -112 -83 521 -136 554 382 -246 -295 683 151 930 832 -953 599 898 278 390 -483 -569 -398 478 -177 -390 297 145 -389 141 -702 -302 -181 -204 -411 -1544 -281 -479 -143 -259 -259 -590 -361 -300 -98 -114 103 -172 112 -51 209 -31 -11 144 121 -40 77 -76 -260 -211 -319 176 -63 325 -264 -1115 -686 -362 -445 151 102 -184 -359 117 -398 -132 99 -249 -24 -170 -159 709 489 733 726 251 487 655 225 155 325 366 959 1065 1739 784 -733 41 -917 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