File name: Pandora55s1_QueensNY_20220325_L2Fit_fout2c19d20211111p1-8.txt File generation date: 20250606T115112.9Z 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_20220325_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: 20220325 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 20220325T122638.1Z 8119.518497 203 1 51.83 2 72.69 102.82 70.08 195.48 0.00 1 0.00 1 0 17 5.205e-01 3.449e-02 1.850e-01 6.824e-03 4.638302e-01 3.652346e-03 5.326307e-03 -6.000000e+00 3.111788e-01 226.95 -2.00 3.51 -2.00 319.74 0.00e+00 5.689828e-03 1.079251e-03 1.197887e-03 -6.000000e+00 1.452771e-02 278.14 -2.00 20.00 -2.00 319.16 0.00e+00 3.313 0.001 302.00 328.00 3 5.0833e+00 1.0354e-02 4.1652e-02 -6.0000e+00 7.7162e-01 1.3542e-01 1.2254e-02 2.7703e-02 -6.0000e+00 8.3853e-01 -1.2086e-01 9.6609e-03 1.2222e-02 -6.0000e+00 4.9733e-01 5.7679e-02 4.9628e-03 7.6238e-03 -6.0000e+00 2.0828e-01 6.4613e-05 6.9703e-04 2.1380e-04 6.5958e-05 -6.0000e+00 1.6092e-02 -4.4548e-03 5.7595e-04 12 9 8 11 32 0 99.99 22.58 1.59 -0.00445 0.00078 14 3 1 5 0 3701.190 25.58 19.99 22.58 14.32 31.0 1084.34 100006 -2567 900000 -112086 900000 -49700 -114047 900000 158103 2273 -114275 -30695 -57222 900000 900000 9293 -63533 6589 405224 276213 900000 -18036 39260 -18074 96469 -34570 900000 20253 -13162 -17022 16522 53358 9598 -16976 10024 12542 -3648 -4810 34682 28629 -3788 16732 -19208 -2396 2438 34569 -3769 37688 22766 22555 -1468 -7351 1357 22690 22444 4309 25119 7840 18641 -2010 5365 14127 -152 2350 10757 -7307 -706 -5626 382 1025 -5881 -4885 5693 -4220 13168 -1401 4089 12597 -1607 -3007 -8074 4547 262 -1251 -6131 -2332 -6576 -2825 -3830 1129 -2337 -2286 -1614 723 -823 247 -2560 -2713 -227 -2588 2293 1013 433 3632 3419 922 -799 600 1571 5213 2071 -3891 901 -858 -2632 85 85 3520 -1018 -205 -2071 -264 4033 861 275 -230 -1324 784 -1785 -2320 1672 2974 3090 2387 665 -1103 786 815 -255 -1688 -479 -1510 -220 -1380 678 -55 900000 -7237 900000 -1559 -6650 900000 1051 55 -8545 -1104 -3049 900000 900000 454 -6866 397 2694 1836 900000 -1587 2019 -1648 3123 -4006 900000 1401 -1221 -1659 1270 3282 1010 -2462 1134 1349 -469 -697 4090 4166 -838 3310 -5577 -615 610 6523 -1023 7035 4941 5031 -431 -2449 452 6606 6920 1613 8004 2936 6275 -805 2027 5181 -69 1143 5158 -4149 -365 -2960 195 569 -3816 -3353 3657 -2906 7418 -832 2127 5727 -842 -1736 -5523 3121 204 -1049 -5649 -2195 -6751 -2929 -4071 1145 -2360 -2179 -1434 605 -709 228 -2669 -3145 -281 -3417 2889 1224 490 3834 3676 1064 -980 759 2071 7074 3079 -6381 1461 -1392 -4164 125 121 4878 -1509 -316 -3357 -424 6163 1315 410 -334 -1867 1060 -2507 -3487 2622 4866 5235 4189 1224 -2141 1560 1652 -526 -3522 -970 -2983 -415 -2578 SS 20220325T125327.4Z 8119.537123 219 1 24.42 2 67.79 107.68 71.63 201.36 0.00 1 0.00 1 0 25 3.489e-02 6.715e-03 1.087e-02 1.743e-03 3.989073e-01 9.003955e-04 4.735283e-03 -6.000000e+00 2.058984e-02 226.95 -2.00 3.51 -2.00 318.25 0.00e+00 2.299890e-04 1.703243e-04 2.211726e-04 -6.000000e+00 8.984675e-04 278.14 -2.00 20.00 -2.00 317.61 0.00e+00 2.623 0.000 302.00 328.00 3 2.9686e+00 2.4172e-03 3.3301e-02 -6.0000e+00 5.1088e-02 4.5530e-02 2.7417e-03 2.0504e-02 -6.0000e+00 5.5468e-02 -1.7796e-02 1.8166e-03 1.0117e-02 -6.0000e+00 3.3002e-02 1.5390e-03 9.3718e-04 2.8709e-03 -6.0000e+00 1.3800e-02 1.1811e-03 -3.9925e-04 5.2993e-05 3.4859e-05 -6.0000e+00 1.0414e-03 -3.2607e-03 1.0573e-04 12 9 1 12 1 1 99.98 22.58 0.22 -0.00326 -0.00626 34 14 1 5 0 692.380 25.58 20.00 22.58 15.33 31.0 1090.15 -4402 -3982 14954 -15371 -5010 2100 -19273 14339 -5858 -2998 -13836 -5166 -6029 -4104 5229 -1841 -4351 -3471 2395 2891 3480 -819 1526 -2526 -1632 -3422 5027 -2104 -449 -2750 1012 3546 841 -2660 -1245 3301 -734 -1017 1470 -29 -1949 -524 -2073 -1476 -931 614 -994 -327 528 949 493 592 -50 1061 1454 579 1323 867 1344 1041 1386 2118 1066 156 -401 -88 674 274 1355 788 -245 -321 -374 -821 -288 -157 224 1656 969 48 -550 -574 -1287 -1229 -1037 -998 -860 -638 -631 -618 -144 114 478 1412 1523 1322 632 342 -507 -580 -456 -227 -21 894 100 -610 -230 -694 -205 283 -282 -722 -187 -307 -78 589 842 1041 532 -194 -746 -446 -136 20 236 -54 557 1383 683 234 500 233 502 250 305 -228 -168 34 -575 -449 -71 -195 -293 2 -197 -201 667 -891 -249 93 -1081 656 -361 -193 -1018 -369 -487 -380 519 -220 -577 -486 335 419 516 -128 238 -429 -293 -655 908 -396 -81 -498 186 704 187 -645 -299 746 -178 -276 455 -10 -787 -223 -926 -669 -424 278 -455 -148 238 434 234 299 -27 596 847 349 814 538 826 635 848 1332 720 113 -301 -66 485 193 963 602 -203 -279 -332 -723 -243 -126 168 1167 689 37 -458 -519 -1245 -1243 -1089 -1092 -977 -746 -748 -727 -164 125 494 1403 1524 1395 720 419 -662 -781 -609 -291 -25 1053 120 -767 -299 -932 -283 407 -425 -1129 -295 -479 -117 849 1179 1458 765 -290 -1152 -691 -209 31 346 -78 775 1877 942 337 756 365 806 411 514 -397 -300 61 -1059 -827 -129 -346 -507 3 SS 20220325T130334.1Z 8119.544144 222 1 9.73 2 65.97 109.59 72.33 203.53 0.00 1 0.00 1 0 25 1.012e-01 1.296e-02 3.691e-02 5.932e-03 3.724163e-01 3.067166e-03 4.427414e-03 -6.000000e+00 5.966778e-02 226.95 -2.00 3.51 -2.00 318.05 0.00e+00 1.035421e-03 5.472147e-04 1.880548e-04 -6.000000e+00 2.604978e-03 278.14 -2.00 20.00 -2.00 317.41 0.00e+00 2.438 0.000 302.00 328.00 3 4.2722e+00 8.1872e-03 3.1013e-02 -6.0000e+00 1.4805e-01 5.5590e-02 9.2587e-03 1.9171e-02 -6.0000e+00 1.6079e-01 -1.8696e-02 5.9855e-03 9.4490e-03 -6.0000e+00 9.5664e-02 5.5247e-03 3.0636e-03 2.7752e-03 -6.0000e+00 3.9964e-02 3.9295e-04 -1.5355e-03 1.8100e-04 3.3010e-05 -6.0000e+00 3.0212e-03 -8.3201e-04 -6.5524e-05 12 9 9 12 33 1 999.00 22.58 0.28 -0.00083 -0.01237 2 3 1 5 0 3182.560 25.58 20.00 22.58 15.68 31.0 1092.05 12951 -7053 80070 -16558 -6591 39088 -9602 47489 -6968 -676 -20972 -8415 -18906 10366 -6214 1970 -642 -29069 13019 6912 20778 -1586 5441 -2814 -6573 -2233 15070 2158 -1432 2719 -4215 4275 2891 -1225 -2074 1018 -2609 -4587 3508 1490 -3822 1182 -4595 -2295 2201 1598 -4931 68 2217 3548 -270 219 97 4120 2372 1477 2548 773 2523 329 48 3611 267 -198 1360 -2663 1950 -567 2758 241 -373 -1421 -310 153 287 -623 374 2691 -105 -301 -2280 432 -1608 383 -2319 -1398 -1345 -760 -713 -965 -348 -434 1478 364 1609 -347 1040 -311 -382 -871 -156 -906 368 1921 1509 550 -577 -1522 544 1018 -425 -1518 218 -1138 -176 613 1118 849 905 249 -458 -303 403 858 223 -767 96 886 539 -479 966 465 131 458 854 -606 698 -232 -845 -580 -171 -582 -3 -84 608 -448 2378 -1182 -401 1481 -592 1894 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