File name: Pandora55s1_QueensNY_20240209_L2Fit_fout2c17d20220526p1-8.txt File generation date: 20240210T051606.3Z Data description: Level 2 spectral fitting results file Data file version: fout2c17p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora55_OF_v5d20190723.txt Instrument calibration file used: Pandora55s1_CF_v17d20220526.txt Level 1 file used: Pandora55s1_QueensNY_20240209_L1_smca1c17d20220526p1-8.txt Full location name: Queens College NYSDEC (USEPA AQS ID 36-081-0124) Short location name: QueensNY Country of location: USA Location latitude [deg]: 40.7361 Location longitude [deg]: -73.8215 Location altitude [m]: 25 Local noon date: 20240209 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: 262 404 Nominal wavelengths inside fitting window [nm]: 305.1320 305.2720 305.4120 305.5520 305.6920 305.8320 305.9719 306.1119 306.2518 306.3917 306.5317 306.6716 306.8115 306.9514 307.0912 307.2311 307.3709 307.5108 307.6506 307.7905 307.9303 308.0701 308.2099 308.3496 308.4894 308.6292 308.7689 308.9087 309.0484 309.1881 309.3278 309.4675 309.6072 309.7469 309.8866 310.0262 310.1659 310.3055 310.4451 310.5847 310.7243 310.8639 311.0035 311.1431 311.2827 311.4222 311.5618 311.7013 311.8408 311.9803 312.1198 312.2593 312.3988 312.5383 312.6777 312.8172 312.9566 313.0960 313.2355 313.3749 313.5143 313.6536 313.7930 313.9324 314.0717 314.2111 314.3504 314.4897 314.6291 314.7684 314.9077 315.0469 315.1862 315.3255 315.4647 315.6040 315.7432 315.8824 316.0216 316.1608 316.3000 316.4392 316.5783 316.7175 316.8566 316.9958 317.1349 317.2740 317.4131 317.5522 317.6913 317.8303 317.9694 318.1085 318.2475 318.3865 318.5255 318.6645 318.8035 318.9425 319.0815 319.2205 319.3594 319.4984 319.6373 319.7762 319.9151 320.0540 320.1929 320.3318 320.4707 320.6095 320.7484 320.8872 321.0260 321.1649 321.3037 321.4425 321.5812 321.7200 321.8588 321.9975 322.1363 322.2750 322.4137 322.5524 322.6911 322.8298 322.9685 323.1072 323.2458 323.3845 323.5231 323.6617 323.8003 323.9389 324.0775 324.2161 324.3547 324.4932 324.6318 324.7703 324.9089 --------------------------------------------------------------------------------------- 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 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: 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 20240209T144823.1Z 8805.616934 129 1 40.79 2 64.36 141.72 68.94 147.71 0.00 1 0.00 1 0 25 2.218e-02 6.579e-03 5.463e-03 1.241e-03 3.617900e-01 6.389988e-04 4.317426e-03 -6.000000e+00 1.301220e-02 224.68 -2.00 3.51 -2.00 317.78 0.00e+00 -3.582068e-05 1.053171e-04 1.360075e-04 -6.000000e+00 5.663451e-04 275.26 -2.00 20.00 -2.00 317.19 0.00e+00 2.297 0.000 302.00 328.00 3 3.2937e+00 1.6893e-03 2.9309e-02 -6.0000e+00 3.2151e-02 3.2233e-02 1.9060e-03 1.8275e-02 -6.0000e+00 3.4974e-02 -1.0822e-02 1.2100e-03 9.1116e-03 -6.0000e+00 2.0794e-02 -9.2782e-04 6.1595e-04 2.6168e-03 -6.0000e+00 8.7851e-03 1.2524e-03 4.2119e-04 3.7935e-05 3.2142e-05 -6.0000e+00 6.6559e-04 1.8158e-02 0.0000e+00 12 9 1 12 5 1 99.98 22.58 0.20 0.01816 0.02132 57 14 1 5 0 703.140 25.90 19.99 22.58 13.53 35.6 1064.39 -10836 6027 -11047 -1540 2403 -5808 7931 -1646 -4853 -6733 -1883 -5979 -3198 2697 -1485 -3476 -580 4170 1010 2906 397 2744 -2991 800 -682 3553 -1969 -1183 -1318 -176 1668 478 -1447 -1806 3333 -1125 -525 560 -347 -1524 -801 -1831 -1188 -547 160 -1222 45 -345 617 427 175 148 1582 1652 1105 1184 627 1105 764 1208 2243 1205 -701 -154 -467 346 -57 1384 692 85 -88 -341 -785 -201 -328 536 1358 903 207 -354 -209 -1494 -1125 -1408 -1056 -794 -489 -734 -561 -99 421 549 1376 1385 928 648 553 -449 -427 -469 -518 -17 799 -32 -675 -486 -911 -238 189 58 -425 -36 -153 -233 416 808 850 637 -99 -716 -294 31 -43 -16 150 210 1317 916 370 621 49 419 127 339 -291 -118 104 -404 -530 -334 -197 -231 90 -834 419 -883 -106 151 -403 536 -136 -441 -645 -179 -649 -389 359 -230 -593 -102 734 190 554 78 537 -643 177 -160 816 -465 -267 -291 -40 404 128 -412 -517 894 -321 -165 201 -143 -701 -390 -929 -611 -282 82 -633 23 -176 316 225 97 87 963 1044 719 789 421 738 505 799 1518 869 -542 -123 -373 264 -42 1032 552 73 -79 -315 -720 -178 -277 421 1009 668 161 -302 -193 -1476 -1156 -1505 -1171 -914 -579 -883 -672 -115 468 578 1391 1399 984 734 672 -582 -570 -622 -663 -21 941 -39 -846 -631 -1218 -327 268 86 -654 -57 -234 -346 590 1109 1165 895 -145 -1080 -446 47 -63 -24 211 288 1756 1233 520 912 75 652 202 550 -490 -203 183 -718 -945 -588 -340 -388 150 SS 20240209T145352.0Z 8805.620741 132 1 50.41 2 63.73 143.01 68.40 148.91 0.00 1 0.00 1 0 25 1.394e-02 6.076e-03 2.442e-03 6.496e-04 3.550632e-01 3.350647e-04 4.251714e-03 -6.000000e+00 8.175799e-03 224.68 -2.00 3.51 -2.00 317.52 0.00e+00 1.406603e-04 5.126624e-05 1.268385e-04 -6.000000e+00 3.558332e-04 275.26 -2.00 20.00 -2.00 316.94 0.00e+00 2.246 0.000 302.00 328.00 3 2.3521e+00 8.8119e-04 2.8693e-02 -6.0000e+00 2.0201e-02 2.6958e-02 9.9224e-04 1.7917e-02 -6.0000e+00 2.1974e-02 -1.3369e-02 6.1372e-04 8.9230e-03 -6.0000e+00 1.3065e-02 4.3162e-04 3.0783e-04 2.5736e-03 -6.0000e+00 5.5200e-03 3.4166e-03 4.4451e-04 1.9799e-05 3.1721e-05 -6.0000e+00 4.1818e-04 1.7851e-02 0.0000e+00 11 1 0 11 4 0 99.48 22.58 0.20 0.01785 0.02119 160 30 1 5 0 315.000 25.90 19.99 22.58 13.58 35.6 1064.83 -6753 -1335 -8500 -2788 -2475 -3708 2313 -1488 -2568 -4418 -744 -1711 -1636 1248 -934 -1539 -553 2131 847 899 783 1910 -402 361 -161 791 -1160 -206 471 841 1500 876 -1400 -1367 980 -866 -14 360 -477 -1561 -782 -1295 -998 -446 -124 -858 -360 -406 695 739 604 622 981 916 757 902 430 698 981 1466 1418 1248 129 -361 -130 138 277 1246 841 194 -216 -432 -585 -433 -217 359 611 1130 159 -172 -588 -1555 -1248 -1275 -1104 -845 -557 -551 -475 -11 275 426 1383 1371 1128 872 675 -336 -531 -406 -525 -22 751 -45 -811 -442 -718 -131 60 -109 -417 -183 -131 -43 533 825 834 616 -86 -538 -321 -179 -315 123 156 391 1346 989 370 482 61 236 118 204 -215 -148 140 -470 -493 -187 -199 -160 18 -603 -119 -799 -230 -191 -297 193 -145 -274 -496 -84 -205 -228 198 -164 -296 -112 441 185 194 179 437 -94 90 -42 210 -306 -51 114 210 409 254 -442 -431 293 -271 -5 138 -211 -764 -411 -692 -544 -244 -68 -471 -194 -218 372 410 348 386 626 614 510 622 302 483 666 995 1006 932 103 -296 -105 108 213 964 693 169 -199 -410 -549 -396 -188 288 466 847 126 -150 -549 -1571 -1311 -1382 -1243 -985 -665 -657 -573 -13 309 450 1427 1414 1217 997 824 -436 -710 -536 -665 -26 884 -54 -1013 -569 -951 -178 85 -161 -631 -282 -200 -63 754 1128 1136 855 -125 -808 -480 -269 -459 175 217 529 1771 1317 518 699 92 363 183 324 -356 -252 241 -826 -869 -321 -336 -263 29 SS 20240209T145912.4Z 8805.624449 135 1 50.27 2 63.13 144.29 67.88 150.09 0.00 1 0.00 1 0 25 1.583e-02 6.193e-03 3.100e-03 8.502e-04 3.488662e-01 4.382149e-04 4.182015e-03 -6.000000e+00 9.287045e-03 224.68 -2.00 3.51 -2.00 317.46 0.00e+00 1.178073e-04 6.608297e-05 1.320730e-04 -6.000000e+00 4.042005e-04 275.26 -2.00 20.00 -2.00 316.88 0.00e+00 2.200 0.000 302.00 328.00 3 2.9289e+00 1.1513e-03 2.8143e-02 -6.0000e+00 2.2947e-02 3.0650e-02 1.2953e-03 1.7607e-02 -6.0000e+00 2.4961e-02 -1.4523e-02 7.9855e-04 8.7691e-03 -6.0000e+00 1.4841e-02 1.2001e-03 3.9954e-04 2.5255e-03 -6.0000e+00 6.2703e-03 2.0202e-03 4.1939e-04 2.5948e-05 3.1462e-05 -6.0000e+00 4.7503e-04 1.7924e-02 0.0000e+00 11 1 0 11 4 0 97.92 22.58 0.15 0.01792 0.02108 88 17 1 5 0 571.190 25.90 20.00 22.58 13.75 35.6 1065.93 -6158 3461 -9778 -2842 -563 -2982 5413 -962 -3889 -4720 -1380 -2584 -2240 2123 -719 -1639 -1671 2901 1364 692 998 1302 -1133 749 -626 2357 -1108 -584 -735 679 1820 173 -1724 -1141 1511 -795 -333 568 -118 -1553 -550 -1777 -1022 -602 202 -1038 -121 -72 784 551 504 638 1312 969 536 1159 511 577 1002 1434 1460 1174 -366 -419 -364 299 204 1352 829 65 -152 -470 -627 -386 -280 542 998 814 19 -96 -536 -1477 -1217 -1215 -1114 -930 -462 -521 -526 -106 319 484 1302 1524 1072 782 630 -374 -456 -428 -616 -55 733 18 -673 -431 -686 -177 110 6 -397 -164 -62 -93 465 833 790 642 -90 -681 -447 -134 -210 134 80 384 1341 912 306 506 -6 370 206 185 -230 -109 65 -424 -382 -270 -261 -180 51 -568 307 -961 -246 -45 -251 462 -97 -430 -543 -159 -330 -326 340 -132 -326 -348 607 300 157 228 301 -278 191 -168 629 -298 -151 -186 175 500 52 -554 -365 462 -254 -116 225 -53 -777 -289 -972 -566 -333 112 -579 -66 -39 429 310 298 396 847 649 368 809 360 405 694 994 1042 883 -293 -347 -301 237 157 1043 679 57 -141 -443 -588 -351 -242 438 767 623 15 -84 -502 -1477 -1267 -1309 -1245 -1079 -550 -630 -632 -124 358 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