File name: Pandora55s1_QueensNY_20220410_L2Fit_fout2c19d20211111p1-8.txt File generation date: 20250606T115239.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c19p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora55_OF_v4d20190723.txt Instrument calibration file used: Pandora55s1_CF_v19d20211111.txt Level 1 file used: Pandora55s1_QueensNY_20220410_L1_smca1c19d20211111p1-8.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: 20220410 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]: 305.0379 305.1778 305.3178 305.4578 305.5977 305.7376 305.8776 306.0175 306.1574 306.2973 306.4372 306.5770 306.7169 306.8567 306.9966 307.1364 307.2762 307.4160 307.5558 307.6956 307.8354 307.9752 308.1149 308.2547 308.3944 308.5341 308.6738 308.8135 308.9532 309.0929 309.2326 309.3723 309.5119 309.6515 309.7912 309.9308 310.0704 310.2100 310.3496 310.4892 310.6287 310.7683 310.9079 311.0474 311.1869 311.3264 311.4659 311.6054 311.7449 311.8844 312.0239 312.1633 312.3028 312.4422 312.5816 312.7210 312.8604 312.9998 313.1392 313.2786 313.4179 313.5573 313.6966 313.8360 313.9753 314.1146 314.2539 314.3932 314.5324 314.6717 314.8110 314.9502 315.0895 315.2287 315.3679 315.5071 315.6463 315.7855 315.9246 316.0638 316.2030 316.3421 316.4812 316.6204 316.7595 316.8986 317.0377 317.1767 317.3158 317.4549 317.5939 317.7329 317.8720 318.0110 318.1500 318.2890 318.4280 318.5669 318.7059 318.8449 318.9838 319.1227 319.2617 319.4006 319.5395 319.6784 319.8172 319.9561 320.0950 320.2338 320.3726 320.5115 320.6503 320.7891 320.9279 321.0667 321.2054 321.3442 321.4830 321.6217 321.7604 321.8991 322.0379 322.1766 322.3152 322.4539 322.5926 322.7312 322.8699 323.0085 323.1471 323.2857 323.4243 323.5629 323.7015 323.8401 323.9786 324.1172 324.2557 324.3943 324.5328 324.6713 324.8098 324.9483 --------------------------------------------------------------------------------------- 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 20220410T114854.2Z 8135.492294 173 1 4.19 2 74.87 92.38 115.86 354.53 0.00 1 0.00 1 0 25 4.946e-01 2.044e-02 2.650e-01 1.248e-02 6.175457e-01 6.799393e-03 7.295316e-03 -6.000000e+00 2.980189e-01 228.20 -2.00 3.51 -2.00 320.08 0.00e+00 7.129753e-03 2.320637e-03 1.680333e-03 -6.000000e+00 1.450508e-02 279.83 -2.00 20.00 -2.00 319.50 0.00e+00 3.759 0.001 302.00 328.00 3 2.9541e+00 1.9867e-02 4.9764e-02 -6.0000e+00 7.4167e-01 1.4447e-01 2.4199e-02 3.2385e-02 -6.0000e+00 8.0704e-01 -1.2790e-01 2.1425e-02 1.8628e-02 -6.0000e+00 4.7760e-01 4.9996e-02 1.0945e-02 8.5801e-03 -6.0000e+00 2.0058e-01 2.9077e-04 -1.6303e-03 3.6399e-04 1.0342e-04 -6.0000e+00 1.5414e-02 -1.0617e-03 -4.4185e-05 12 9 9 12 33 1 999.00 22.59 0.31 -0.00106 -0.01331 1 5 1 5 0 2004.560 25.58 20.00 22.59 12.11 30.7 1063.48 900000 -122053 900000 -208317 900000 -81267 -34803 900000 -85822 -29598 -106608 900000 -91877 900000 43368 386460 -70195 900000 14952 144306 58937 -48250 29914 24631 35806 -29038 900000 -48144 155781 -27673 57678 1006 12053 -21608 -3074 -1518 -5806 -7729 3733 25969 -1890 20570 -13810 -2630 2402 8492 18 24983 6094 -5610 12139 -2863 15732 6408 10436 -1044 14026 4815 -661 829 1637 14139 2174 -1729 4351 3901 3978 4422 -1574 4637 -2159 -1833 3338 -3249 4563 410 1647 1742 906 -1181 -3549 2629 -2658 451 -3589 -2654 -2626 138 -2671 221 -4487 -1137 -1557 2033 -2020 -583 -893 -436 -396 -1285 1019 -293 818 -887 1283 -863 -2047 -481 630 1520 1035 -6 -195 338 -487 521 383 1670 -889 -105 705 8 1826 -854 899 1091 878 713 378 -366 744 -309 521 342 160 340 145 -129 -512 -1339 -183 -529 -3 -90 900000 -2695 900000 -11295 900000 -1222 -423 900000 -1654 -360 -2809 900000 -2841 900000 605 4697 -3908 900000 454 1754 1300 -2923 887 802 1112 -1727 900000 -3478 1893 -1747 1862 65 818 -2179 -266 -127 -525 -805 414 2753 -292 2825 -2737 -489 438 1505 4 4014 1203 -1290 2565 -755 3851 1830 3045 -349 4234 1584 -226 275 546 4462 835 -758 1948 1789 1791 1977 -771 2369 -1277 -1143 2038 -2043 2565 221 818 835 453 -664 -2302 1816 -2082 365 -3139 -2411 -2487 133 -2651 213 -4337 -1026 -1339 1674 -1769 -548 -928 -497 -488 -1662 1291 -358 929 -975 1403 -996 -2481 -597 813 2071 1510 -10 -311 538 -757 779 560 2431 -1350 -164 1119 12 2815 -1309 1329 1571 1233 987 537 -557 1209 -532 927 628 303 668 294 -266 -1062 -2787 -371 -1041 -6 -167 SS 20220410T115813.0Z 8135.498762 176 1 44.88 2 73.11 93.93 116.00 356.80 0.00 1 0.00 1 0 25 1.038e-01 6.125e-03 9.750e-03 4.912e-04 5.787579e-01 2.585662e-04 6.751184e-03 -6.000000e+00 6.146650e-02 228.20 -2.00 3.51 -2.00 319.58 0.00e+00 1.222826e-03 7.519187e-05 6.384881e-04 -6.000000e+00 2.689627e-03 279.83 -2.00 20.00 -2.00 318.96 0.00e+00 3.390 0.001 302.00 328.00 3 1.0978e-01 7.3123e-04 4.5638e-02 -6.0000e+00 1.5287e-01 6.0332e-02 8.6685e-04 3.0486e-02 -6.0000e+00 1.6584e-01 -3.5323e-02 7.2310e-04 1.4972e-02 -6.0000e+00 9.8667e-02 5.0710e-03 3.7721e-04 4.3766e-03 -6.0000e+00 4.1177e-02 7.7305e-03 -1.7051e-03 1.4188e-05 5.2745e-05 -6.0000e+00 3.0993e-03 -7.7694e-04 -8.0363e-05 10 0 0 10 0 0 1.79 22.58 0.19 -0.00078 -0.01359 658 124 1 5 0 68.190 25.58 19.99 22.58 12.06 31.0 1064.90 -37189 -41503 -14280 -45692 -32576 -42212 -34139 -27922 -28845 -32245 -31378 -23705 -23178 -11792 -7157 -5632 -9162 -7479 -3092 -877 -3152 -2319 -2010 -4782 -3153 -5477 -1982 -6253 -2736 -4847 -552 -53 1097 -2937 -1426 456 -1036 -142 40 -320 -1993 -1138 -1786 -785 -1066 361 -492 -29 51 1309 1844 1035 1574 1336 1750 684 1172 73 434 593 1555 1816 1878 1020 -182 649 569 884 1329 1061 118 -277 -774 -668 -664 -362 365 620 1242 74 86 -667 -1395 -1120 -1229 -1051 -860 -630 -545 -489 42 651 766 1549 1385 1230 823 600 -458 -523 -346 -495 217 782 -288 -997 -567 -777 -138 -77 -225 -513 -236 56 116 806 959 904 438 -393 -665 -329 -213 -310 95 7 550 1379 892 149 331 -7 280 138 107 -391 -202 161 -447 -398 -133 -49 44 141 -469 -646 -184 -734 -479 -663 -522 -455 -540 -624 -644 -498 -578 -329 -236 -219 -420 -373 -160 -47 -181 -135 -120 -315 -204 -389 -140 -454 -189 -351 -43 -5 113 -344 -167 52 -125 -20 7 -60 -433 -269 -451 -203 -281 95 -133 -8 15 356 539 337 563 520 677 281 497 32 186 248 648 797 912 523 -102 366 313 481 756 675 80 -203 -553 -493 -460 -228 221 355 730 49 63 -532 -1187 -1028 -1141 -1036 -897 -654 -575 -508 44 628 726 1409 1310 1228 897 712 -586 -712 -464 -620 257 909 -343 -1214 -727 -1007 -189 -110 -341 -812 -387 91 179 1219 1391 1316 666 -611 -1074 -528 -330 -482 142 10 784 1981 1276 227 536 -12 500 249 197 -768 -401 327 -927 -820 -264 -97 85 261 SS 20220410T120508.1Z 8135.503566 180 1 44.15 2 71.80 95.09 116.07 358.48 0.00 1 0.00 1 0 25 7.187e-02 6.251e-03 6.603e-03 4.271e-04 5.433847e-01 2.236661e-04 6.374827e-03 -6.000000e+00 4.256658e-02 228.20 -2.00 3.51 -2.00 319.28 0.00e+00 9.888347e-04 5.880111e-05 4.724757e-04 -6.000000e+00 1.862707e-03 279.83 -2.00 20.00 -2.00 318.64 0.00e+00 3.160 0.001 302.00 328.00 3 9.5761e-02 6.2330e-04 4.2639e-02 -6.0000e+00 1.0586e-01 5.4404e-02 7.2780e-04 2.8446e-02 -6.0000e+00 1.1485e-01 -3.0298e-02 5.7492e-04 1.3991e-02 -6.0000e+00 6.8330e-02 3.4714e-03 3.0208e-04 4.0078e-03 -6.0000e+00 2.8514e-02 1.0182e-02 -1.6752e-03 1.2407e-05 4.7442e-05 -6.0000e+00 2.1465e-03 6.1188e-05 -6.9182e-05 10 0 0 10 0 0 -16.26 22.58 0.22 0.00006 -0.01253 745 141 1 5 0 59.250 25.58 19.99 22.58 12.46 31.1 1067.07 -23109 -26822 -15851 -27779 -23532 -26216 -30761 -18178 -21123 -22011 -23808 -14010 -16268 -7803 -3971 -4168 -5667 -6965 -881 -1623 -1972 -2486 -382 -3241 -1947 -3855 -2044 -4425 -2428 -2080 -600 923 272 -1827 -1810 124 -1438 213 138 -564 -1270 -1095 -1281 -922 -360 -31 -260 28 478 1244 1359 892 1406 1227 1242 902 714 45 371 701 1417 1763 1630 770 -272 508 549 893 1577 864 161 -314 -631 -792 -758 -369 430 749 1182 339 6 -617 -1481 -1234 -1262 -1150 -922 -682 -550 -495 13 546 832 1581 1463 1168 911 682 -435 -543 -400 -532 185 777 -313 -1005 -579 -800 -153 -111 -215 -439 -242 -27 194 843 977 821 459 -367 -713 -391 -190 -299 168 33 558 1499 848 217 277 -91 265 157 139 -398 -171 130 -474 -414 -114 -44 -5 99 -370 -523 -299 -535 -452 -500 -646 -381 -471 -542 -635 -371 -521 -284 -171 -213 -332 -454 -58 -115 -145 -188 -29 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