File name: Pandora253s1_TucsonAZ_20240901_L2Fit_fout2c1d20230118p1-8.txt File generation date: 20240902T072703.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Armin Sorooshian Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 253 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora253_OF_v3d20221208.txt Instrument calibration file used: Pandora253s1_CF_v1d20230118.txt Level 1 file used: Pandora253s1_TucsonAZ_20240901_L1_smca1c1d20230118p1-8.txt Full location name: University of Arizona Department of Chemical and Environmental Engineering Short location name: TucsonAZ Country of location: United States Location latitude [deg]: 32.2330 Location longitude [deg]: -110.9530 Location altitude [m]: 779 Local noon date: 20240901 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: Full lab calibration+OOB session, absolute calibration done with an uncalibrated lamp, certificate of FEL1441 (GSFC) used First and last pixel inside fitting window: 192 334 Nominal wavelengths inside fitting window [nm]: 305.0464 305.1873 305.3281 305.4689 305.6097 305.7505 305.8913 306.0321 306.1728 306.3136 306.4543 306.5950 306.7358 306.8765 307.0171 307.1578 307.2985 307.4391 307.5798 307.7204 307.8610 308.0016 308.1422 308.2828 308.4234 308.5639 308.7045 308.8450 308.9856 309.1261 309.2666 309.4071 309.5475 309.6880 309.8285 309.9689 310.1093 310.2498 310.3902 310.5306 310.6709 310.8113 310.9517 311.0920 311.2323 311.3727 311.5130 311.6533 311.7936 311.9339 312.0741 312.2144 312.3546 312.4948 312.6351 312.7753 312.9155 313.0556 313.1958 313.3360 313.4761 313.6162 313.7564 313.8965 314.0366 314.1767 314.3167 314.4568 314.5969 314.7369 314.8769 315.0169 315.1569 315.2969 315.4369 315.5769 315.7168 315.8568 315.9967 316.1366 316.2765 316.4164 316.5563 316.6962 316.8360 316.9759 317.1157 317.2556 317.3954 317.5352 317.6750 317.8147 317.9545 318.0942 318.2340 318.3737 318.5134 318.6531 318.7928 318.9325 319.0722 319.2118 319.3515 319.4911 319.6307 319.7703 319.9099 320.0495 320.1891 320.3286 320.4682 320.6077 320.7472 320.8868 321.0263 321.1657 321.3052 321.4447 321.5841 321.7236 321.8630 322.0024 322.1418 322.2812 322.4206 322.5600 322.6993 322.8386 322.9780 323.1173 323.2566 323.3959 323.5352 323.6744 323.8137 323.9529 324.0922 324.2314 324.3706 324.5098 324.6490 324.7882 324.9273 --------------------------------------------------------------------------------------- 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 20240901T134148.7Z 9010.570703 81 1 54.44 2 81.94 85.63 65.70 84.68 0.00 1 0.00 1 0 25 4.588e-01 2.442e-02 4.670e-01 2.041e-02 7.803859e-01 1.201373e-02 8.745155e-03 -6.000000e+00 2.735826e-01 229.05 -2.00 3.29 -2.00 321.86 0.00e+00 1.886544e-02 6.791212e-03 7.655588e-04 -6.000000e+00 1.274231e-02 289.02 -2.00 20.00 -2.00 321.33 0.00e+00 6.678 0.004 302.00 328.00 3 2.6520e+00 4.6676e-02 7.5624e-02 -6.0000e+00 6.8258e-01 7.5518e-01 6.2788e-02 5.4859e-02 -6.0000e+00 7.4015e-01 -8.2717e-01 5.4607e-02 2.2393e-02 -6.0000e+00 4.3505e-01 3.0909e-01 2.5457e-02 2.1481e-02 -6.0000e+00 1.8753e-01 3.1620e-05 -1.8495e-03 5.8675e-04 2.5247e-04 -6.0000e+00 1.3555e-02 -3.4784e-02 0.0000e+00 12 8 8 10 0 0 99.40 25.70 0.53 -0.03478 -0.04868 31 3 1 5 0 1756.050 33.00 20.00 25.70 33.02 3.9 1015.64 900000 112070 900000 900000 -230885 -42055 900000 900000 900000 -50364 -143530 -67922 -43694 -127959 -339 -61616 218207 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784 2451 638 2488 3314 4171 792 4518 3192 2866 3533 -332 3031 -726 459 866 1987 -241 462 1426 -2605 -26 -137 807 1006 -4406 583 -940 376 1721 66 2491 -717 -2667 -1217 2176 663 -3877 -6059 1029 681 -306 -188 980 -4265 -224 -5883 -1453 -2028 2390 -1037 317 -2133 1462 1701 927 -564 -369 2336 -4985 -981 -569 -1659 1789 1918 5110 -179 295 1128 2628 1520 1155 166 1717 1 2974 -2137 1839 -3243 3628 -807 -448 1828 -3428 -3242 SS 20240901T135708.1Z 9010.581343 86 1 54.13 2 78.71 87.65 62.56 86.59 0.00 1 0.00 1 0 25 2.524e-01 4.871e-03 1.635e-01 2.059e-03 6.053542e-01 1.121804e-03 6.562231e-03 -6.000000e+00 1.470007e-01 229.05 -2.00 3.29 -2.00 320.93 0.00e+00 3.641309e-03 5.071852e-04 4.439805e-04 -6.000000e+00 6.592134e-03 289.02 -2.00 20.00 -2.00 320.28 0.00e+00 4.934 0.002 302.00 328.00 3 1.7247e+00 3.7621e-03 5.4157e-02 -6.0000e+00 3.6555e-01 5.0568e-02 5.0413e-03 3.0652e-02 -6.0000e+00 3.9492e-01 -5.3924e-02 4.8502e-03 1.6404e-02 -6.0000e+00 2.3599e-01 9.8660e-03 2.3539e-03 6.9648e-03 -6.0000e+00 1.0122e-01 5.3383e-04 -8.6523e-04 5.9746e-05 7.3620e-05 -6.0000e+00 6.9565e-03 -3.6169e-02 0.0000e+00 12 1 1 12 1 1 98.85 25.70 0.43 -0.03617 -0.04267 134 13 1 5 0 400.900 33.00 20.00 25.70 32.94 4.0 1014.87 -121450 -116041 63363 -48395 105540 -94033 -86489 -62310 -49056 -74912 17800 -43251 -41007 -55445 -296 -20986 -34471 -19254 -25167 -1879 2678 354 -25377 -19439 -11901 -16681 -694 -20654 -15526 -19999 1563 -5854 -2852 -5925 -6004 -13862 -9176 -9378 -1116 -4808 -1093 108 -1373 313 -611 3120 -1180 792 -1624 -497 405 2407 3700 1442 2225 1058 1728 94 -137 -1755 464 1355 2016 3051 613 938 930 880 1629 919 627 862 1016 74 328 -197 259 -368 -1268 -1297 -1084 -758 -352 -1010 -956 -310 -141 29 525 613 737 483 226 428 1 -311 52 163 120 -160 -239 -662 -343 317 -1122 -1366 -1094 -1044 -12 506 178 134 260 61 71 302 597 477 376 -500 -353 -309 24 151 258 -74 270 1099 940 -69 23 -57 -132 -30 -75 -274 -142 179 53 -103 -163 -96 146 -820 -911 127 -221 212 -601 -537 -341 -269 -588 58 -284 -354 -713 -3 -299 -651 -348 -531 -34 48 7 -622 -484 -299 -469 -17 -622 -433 -606 44 -213 -118 -282 -286 -690 -463 -550 -74 -400 -101 11 -148 35 -69 350 -142 96 -209 -67 59 384 644 280 460 231 389 22 -31 -398 104 326 543 919 205 312 300 286 562 364 281 412 490 35 143 -78 93 -129 -479 -570 -559 -448 -231 -714 -719 -248 -108 23 423 482 601 367 162 304 0 -273 48 171 141 -195 -279 -712 -333 295 -1120 -1462 -1229 -1247 -15 711 278 225 444 102 112 451 875 721 602 -852 -610 -522 39 236 387 -107 375 1512 1411 -118 44 -106 -258 -62 -165 -638 -342 438 131 -251 -375 -208 303 SS 20240901T140236.7Z 9010.585147 89 1 54.85 2 77.55 88.37 61.44 87.28 0.00 1 0.00 1 0 25 1.599e-01 4.765e-03 3.049e-02 8.381e-04 5.612098e-01 4.457637e-04 6.070704e-03 -6.000000e+00 9.316424e-02 229.05 -2.00 3.29 -2.00 320.46 0.00e+00 2.152434e-03 1.740346e-04 3.152196e-04 -6.000000e+00 4.177132e-03 289.02 -2.00 20.00 -2.00 319.76 0.00e+00 4.509 0.001 302.00 328.00 3 7.0394e-01 1.3901e-03 4.9659e-02 -6.0000e+00 2.3167e-01 2.7443e-02 1.7765e-03 2.8254e-02 -6.0000e+00 2.5027e-01 -4.2825e-02 1.6253e-03 1.4309e-02 -6.0000e+00 1.4955e-01 8.9273e-03 8.1662e-04 5.3431e-03 -6.0000e+00 6.4164e-02 2.2699e-03 -5.7520e-04 2.4219e-05 5.2080e-05 -6.0000e+00 4.4077e-03 -3.7610e-02 0.0000e+00 10 0 0 10 0 0 3.63 25.70 0.38 -0.03761 -0.04193 505 48 1 5 0 108.600 33.00 19.99 25.70 33.00 4.0 1015.86 -84293 -44432 -40583 -58753 -40289 -60733 -55930 -34983 -36645 -38890 -46098 -50622 -36075 -18527 -20229 -13109 -11872 -5782 -10094 -4046 -6942 -5976 -9748 -11297 -6183 -5193 -8659 -9132 -9564 -5738 -5627 -2215 -1771 -1340 -5191 -6944 -4501 -4331 -2048 -2041 -2260 -1996 -590 -1402 -269 261 976 -464 -633 533 956 793 1087 1969 988 1645 822 -208 124 388 718 1654 1900 1939 1384 851 887 433 1017 962 653 591 266 627 -26 -475 -563 -1086 -666 -468 -960 -936 -1230 -1415 -845 -556 -276 101 470 678 671 942 476 339 378 9 180 581 68 -493 -327 -453 -238 199 -589 -1301 -866 -720 -438 219 56 -2 44 241 49 569 537 389 122 -224 -774 -206 -87 90 160 303 278 1122 846 152 121 -94 5 95 50 -325 -222 126 -15 -204 -31 -112 -19 -701 -300 -322 -567 -300 -526 -485 -277 -338 -407 -546 -674 -498 -271 -377 -275 -281 -142 -283 -114 -210 -181 -314 -399 -226 -201 -360 -375 -381 -226 -250 -112 -104 -87 -347 -456 -306 -341 -192 -233 -298 -286 -88 -219 -42 41 157 -77 -108 95 183 170 256 498 270 467 244 -63 37 113 211 515 662 758 585 359 360 177 439 473 329 318 146 331 -13 -235 -253 -475 -307 -248 -545 -608 -890 -1096 -692 -487 -255 97 455 641 597 777 371 260 310 8 192 648 85 -636 -404 -513 -268 216 -625 -1488 -1037 -914 -596 326 86 -3 73 384 74 874 808 604 186 -362 -1280 -332 -136 146 249 453 398 1591 1304 243 213 -178 9 197 103 -707 -500 289 -35 -464 -67 -230 -39 SS 20240901T140754.5Z 9010.588826 92 1 54.87 2 76.44 89.07 60.35 87.96 0.00 1 0.00 1 0 25 1.089e-01 4.959e-03 1.776e-02 6.526e-04 5.211019e-01 3.436770e-04 5.733862e-03 -6.000000e+00 6.345120e-02 229.05 -2.00 3.29 -2.00 320.14 0.00e+00 1.763257e-03 1.201625e-04 2.212636e-04 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