File name: Pandora55s1_QueensNY_20210223_L2Fit_fout2c11d20210101p1-8.txt File generation date: 20260625T181001.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c11p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora55_OF_v4d20190723.txt Instrument calibration file used: Pandora55s1_CF_v11d20210101.txt Level 1 file used: Pandora55s1_QueensNY_20210223_L1_smca1c11d20210101p1-8.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: 20210223 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: 261 404 Nominal wavelengths inside fitting window [nm]: 305.0145 305.1546 305.2946 305.4346 305.5746 305.7145 305.8545 305.9945 306.1344 306.2744 306.4143 306.5542 306.6941 306.8340 306.9739 307.1138 307.2536 307.3935 307.5333 307.6732 307.8130 307.9528 308.0926 308.2324 308.3722 308.5120 308.6517 308.7915 308.9312 309.0710 309.2107 309.3504 309.4901 309.6298 309.7695 309.9091 310.0488 310.1884 310.3281 310.4677 310.6073 310.7469 310.8865 311.0261 311.1657 311.3053 311.4448 311.5844 311.7239 311.8634 312.0029 312.1424 312.2819 312.4214 312.5609 312.7003 312.8398 312.9792 313.1187 313.2581 313.3975 313.5369 313.6763 313.8156 313.9550 314.0944 314.2337 314.3730 314.5124 314.6517 314.7910 314.9303 315.0695 315.2088 315.3481 315.4873 315.6265 315.7658 315.9050 316.0442 316.1834 316.3226 316.4617 316.6009 316.7401 316.8792 317.0183 317.1574 317.2966 317.4357 317.5747 317.7138 317.8529 317.9919 318.1310 318.2700 318.4090 318.5481 318.6871 318.8260 318.9650 319.1040 319.2429 319.3819 319.5208 319.6598 319.7987 319.9376 320.0765 320.2153 320.3542 320.4931 320.6319 320.7708 320.9096 321.0484 321.1872 321.3260 321.4648 321.6036 321.7423 321.8811 322.0198 322.1586 322.2973 322.4360 322.5747 322.7134 322.8520 322.9907 323.1294 323.2680 323.4066 323.5453 323.6839 323.8225 323.9611 324.0996 324.2382 324.3768 324.5153 324.6538 324.7924 324.9309 --------------------------------------------------------------------------------------- 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 100-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-387: 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 20210223T130115.5Z 7724.542541 231 1 51.04 2 75.91 116.34 113.98 346.17 0.00 1 0.00 1 0 29 4.691e-01 1.341e-02 1.259e-01 2.463e-03 6.247149e-01 1.308858e-03 7.229207e-03 -6.000000e+00 2.757511e-01 225.27 -2.00 3.51 -2.00 320.22 0.00e+00 3.515038e-03 4.604142e-04 1.086422e-03 -6.000000e+00 1.211327e-02 275.83 -2.00 20.00 -2.00 319.70 0.00e+00 4.018 0.001 302.00 328.00 3 2.7973e+00 3.8242e-03 5.1879e-02 -6.0000e+00 6.8210e-01 1.1335e-01 4.7492e-03 3.3982e-02 -6.0000e+00 7.4131e-01 -9.7173e-02 4.4667e-03 1.6692e-02 -6.0000e+00 4.4157e-01 3.1794e-02 2.2765e-03 6.3591e-03 -6.0000e+00 1.8598e-01 2.7758e-04 -1.4230e-03 7.1190e-05 6.6072e-05 -6.0000e+00 1.4027e-02 -3.2350e-03 -1.9324e-05 12 8 8 10 0 0 96.90 22.83 0.24 -0.00324 -0.01393 41 8 1 5 0 1244.530 25.68 20.00 22.83 10.07 26.8 1011.95 -143139 395707 900000 -164859 -83271 32974 -76966 56310 -18649 -81422 -128371 -44263 -81449 18423 900000 -44115 -77509 -9427 110955 32538 32052 20480 7824 -23212 -32402 -1503 109024 -15784 -18537 -22935 1672 9760 -8758 -29897 1158 55899 -2405 -8760 8862 16480 -8532 -1706 -7440 -1248 -1610 18626 -4304 11056 4411 9135 2213 -1118 -1612 9432 10025 4753 6946 3271 4274 370 1138 4562 1582 -2998 1475 -1945 4079 793 4873 1590 -1822 -365 1681 -1562 1271 -60 1057 4189 -709 -1271 -791 493 -599 -978 -2826 -1512 -2240 -924 -1837 -994 -289 -41 935 1815 -13 731 -39 400 -55 -835 -307 -456 369 743 239 -1014 -476 -490 -568 888 304 -853 48 -617 -384 803 776 1480 188 -107 -1605 -180 409 711 93 304 -87 1258 994 -278 789 568 614 443 571 -405 24 110 -398 -1594 -19 52 187 -263 -2558 950 900000 -4875 -1105 139 -953 216 -165 -1418 -3682 -637 -1975 221 900000 -1434 -3942 -284 1184 768 790 574 252 -1048 -1717 -64 1713 -789 -943 -1248 81 512 -635 -2914 87 2499 -190 -821 839 1729 -1292 -266 -1299 -214 -283 2788 -808 1853 811 1692 468 -267 -424 2437 2752 1432 2130 1050 1349 119 363 1476 574 -1251 641 -899 1771 352 2167 793 -1034 -218 1017 -954 723 -32 519 1914 -346 -685 -483 334 -451 -788 -2426 -1347 -2095 -888 -1807 -966 -272 -37 792 1488 -11 672 -40 451 -67 -1088 -399 -568 427 816 264 -1176 -573 -613 -744 1222 450 -1353 78 -1013 -617 1235 1162 2206 289 -171 -2652 -295 653 1106 141 453 -126 1777 1439 -432 1309 1001 1128 840 1119 -828 50 236 -861 -3475 -41 108 370 -511 SS 20210223T130729.2Z 7724.546866 234 1 50.39 2 74.86 117.50 114.24 347.62 0.00 1 0.00 1 0 25 2.282e-01 9.074e-03 6.174e-02 1.733e-03 5.864466e-01 9.105836e-04 6.832858e-03 -6.000000e+00 1.341277e-01 225.27 -2.00 3.51 -2.00 319.88 0.00e+00 2.034021e-03 2.891321e-04 9.779960e-04 -6.000000e+00 5.891891e-03 275.83 -2.00 20.00 -2.00 319.34 0.00e+00 3.755 0.001 302.00 328.00 3 2.4631e+00 2.6000e-03 4.8387e-02 -6.0000e+00 3.3180e-01 6.7684e-02 3.1488e-03 3.1319e-02 -6.0000e+00 3.6053e-01 -3.8644e-02 2.8367e-03 1.5404e-02 -6.0000e+00 2.1466e-01 5.7918e-03 1.4707e-03 5.1255e-03 -6.0000e+00 9.0446e-02 5.2538e-04 -9.6878e-04 5.0545e-05 5.7070e-05 -6.0000e+00 6.8062e-03 -4.0509e-03 2.3948e-06 11 8 0 10 0 0 94.38 22.83 0.21 -0.00405 -0.01133 64 12 1 5 0 787.250 25.68 20.02 22.83 10.20 26.8 1012.52 -99527 26080 900000 -89833 -88001 43102 -62470 84005 -41727 -37525 -97182 -33551 -49494 -435 90598 -17291 -40501 -16442 40078 3708 19470 -2755 4679 -17929 -15902 -5822 28510 -12006 -12987 -9773 -7230 12066 -6673 -13944 -1748 18656 -3670 -5740 4145 5119 -4859 -2539 -2757 -2445 -2102 7083 -2954 4979 1226 4624 566 -1005 -1278 4895 4235 2912 3165 1889 1009 129 1589 2736 1362 -1603 1129 -1328 2716 -827 3457 1018 -753 -692 544 -1046 648 201 568 2394 213 -202 -930 636 -1365 -1247 -1812 -1103 -1315 -662 -1098 -497 189 55 1180 1168 690 963 119 848 -355 -614 -462 -229 148 1177 -165 -701 -572 -470 -425 230 213 -887 72 -217 -181 572 933 1006 341 -186 -995 -381 14 -61 -239 157 227 1351 851 118 465 442 579 175 456 -429 43 81 -239 -1264 -193 -103 234 102 -1574 151 900000 -1735 -1606 221 -896 337 -624 -591 -2837 -594 -1194 -8 911 -565 -1869 -672 1054 145 687 -122 198 -991 -934 -334 1234 -751 -811 -604 -479 777 -590 -1448 -167 1458 -362 -648 510 739 -878 -493 -567 -522 -455 1438 -666 1067 279 1070 145 -284 -395 1547 1434 1041 1171 715 384 48 590 1051 573 -761 561 -692 1347 -418 1744 569 -468 -459 365 -704 411 120 313 1247 115 -119 -621 467 -1110 -1076 -1641 -1039 -1296 -672 -1137 -509 188 52 1060 1024 620 927 126 982 -447 -813 -611 -290 175 1329 -189 -834 -707 -602 -567 322 318 -1410 117 -353 -287 876 1387 1494 521 -295 -1624 -621 23 -95 -365 234 330 1910 1230 181 762 765 1038 323 869 -851 88 169 -501 -2665 -397 -207 452 193 SS 20210223T131726.5Z 7724.553778 237 1 50.92 2 73.19 119.38 114.60 349.97 0.00 1 0.00 1 0 25 1.277e-01 7.740e-03 2.417e-02 1.317e-03 5.326634e-01 6.842697e-04 6.272360e-03 -6.000000e+00 7.502670e-02 225.27 -2.00 3.51 -2.00 319.45 0.00e+00 1.372291e-03 1.885807e-04 5.518070e-04 -6.000000e+00 3.257745e-03 275.83 -2.00 20.00 -2.00 318.89 0.00e+00 3.406 0.001 302.00 328.00 3 2.3511e+00 1.9082e-03 4.3704e-02 -6.0000e+00 1.8559e-01 5.3881e-02 2.2440e-03 2.7761e-02 -6.0000e+00 2.0168e-01 -2.9270e-02 1.8514e-03 1.3809e-02 -6.0000e+00 1.2000e-01 3.8015e-03 9.7390e-04 4.2189e-03 -6.0000e+00 5.0355e-02 8.7565e-04 -1.1085e-03 3.8855e-05 5.0050e-05 -6.0000e+00 3.8058e-03 -3.7268e-03 -2.1933e-05 11 8 0 10 0 0 93.54 22.83 0.23 -0.00373 -0.01206 93 18 1 5 0 541.590 25.68 19.99 22.83 10.45 26.8 1013.96 -62776 -8510 49646 -57531 -53299 -11675 -46702 -2118 -28397 -29916 -47002 -18539 -30812 -6170 17267 -16140 -20952 -17752 13042 1713 4671 -283 2522 -6000 -9958 -3050 7192 -6881 -6011 -5824 -2618 4071 -1294 -7866 -1449 9574 -785 -1532 1530 2053 -2804 -2255 -2801 -1608 -1298 3405 -555 1656 860 1774 1275 -43 -498 3131 2484 1765 1802 849 974 536 1211 1853 1083 -289 567 -279 1844 224 2461 1060 28 -381 173 -479 117 -220 409 1746 358 54 -455 -180 -1594 -1265 -1724 -1152 -1387 -1088 -804 -566 -71 200 913 1657 1110 1376 602 846 -338 -670 -503 -397 55 910 -19 -975 -663 -908 -107 119 152 -429 -154 -13 10 547 908 949 420 -335 -978 -473 -258 48 0 190 420 1342 1073 252 456 156 501 254 329 -400 -114 228 -325 -955 -173 -209 47 94 -1247 -120 443 -1414 -1202 -172 -981 -33 -633 -737 -1439 -469 -1009 -197 537 -807 -1234 -1109 660 102 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