File name: Pandora88s1_SanAntonioTX_20250427_L2Fit_fout2c2d20240901p1-8.txt File generation date: 20250504T102920.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 88 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora88_OF_v2d20240227.txt Instrument calibration file used: Pandora88s1_CF_v2d20240901.txt Level 1 file used: Pandora88s1_SanAntonioTX_20250427_L1_smca1c2d20240901p1-8.txt Full location name: University of Texas San Antonio Downtown Campus Short location name: SanAntonioTX Country of location: USA Location latitude [deg]: 29.4229 Location longitude [deg]: -98.5025 Location altitude [m]: 230 Local noon date: 20250427 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: OOB session based on clearance session 1 First and last pixel inside fitting window: 198 340 Nominal wavelengths inside fitting window [nm]: 305.0435 305.1841 305.3247 305.4653 305.6059 305.7464 305.8870 306.0275 306.1680 306.3086 306.4491 306.5895 306.7300 306.8705 307.0110 307.1514 307.2918 307.4323 307.5727 307.7131 307.8535 307.9939 308.1342 308.2746 308.4150 308.5553 308.6956 308.8359 308.9762 309.1165 309.2568 309.3971 309.5373 309.6776 309.8178 309.9581 310.0983 310.2385 310.3787 310.5189 310.6590 310.7992 310.9393 311.0795 311.2196 311.3597 311.4998 311.6399 311.7800 311.9201 312.0601 312.2002 312.3402 312.4803 312.6203 312.7603 312.9003 313.0403 313.1802 313.3202 313.4601 313.6001 313.7400 313.8799 314.0198 314.1597 314.2996 314.4395 314.5793 314.7192 314.8590 314.9988 315.1386 315.2785 315.4182 315.5580 315.6978 315.8376 315.9773 316.1170 316.2568 316.3965 316.5362 316.6759 316.8155 316.9552 317.0949 317.2345 317.3741 317.5138 317.6534 317.7930 317.9326 318.0721 318.2117 318.3513 318.4908 318.6303 318.7699 318.9094 319.0489 319.1884 319.3278 319.4673 319.6067 319.7462 319.8856 320.0250 320.1644 320.3038 320.4432 320.5826 320.7220 320.8613 321.0006 321.1400 321.2793 321.4186 321.5579 321.6972 321.8364 321.9757 322.1149 322.2542 322.3934 322.5326 322.6718 322.8110 322.9502 323.0893 323.2285 323.3676 323.5068 323.6459 323.7850 323.9241 324.0632 324.2023 324.3413 324.4804 324.6194 324.7585 324.8975 --------------------------------------------------------------------------------------- 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 20250427T133339.1Z 9248.565036 85 1 5.77 2 69.82 84.88 66.05 85.19 0.00 1 0.00 1 0 17 2.262e-02 6.516e-03 1.449e-02 3.239e-03 3.519849e-01 1.621060e-03 3.847726e-03 -6.000000e+00 1.273865e-02 229.91 -2.00 3.23 -2.00 317.80 0.00e+00 8.794301e-04 2.700558e-04 3.014571e-04 -6.000000e+00 5.683956e-04 287.83 -2.00 20.00 -2.00 316.98 0.00e+00 2.868 0.000 302.00 328.00 3 3.1920e+00 4.3419e-03 3.2629e-02 -6.0000e+00 3.1788e-02 4.0272e-03 4.9069e-03 1.6881e-02 -6.0000e+00 3.4405e-02 -1.1551e-02 3.0886e-03 8.2223e-03 -6.0000e+00 2.0511e-02 7.7129e-04 1.5961e-03 2.3367e-03 -6.0000e+00 8.8462e-03 8.7320e-04 -1.9450e-05 8.5783e-05 2.2620e-05 -6.0000e+00 5.6118e-04 1.1698e-02 0.0000e+00 12 9 1 12 1 1 99.90 25.18 0.33 0.01170 0.01155 11 13 1 5 0 480.790 33.50 19.99 25.18 28.24 0.0 990.67 -5425 -3445 -7696 -10091 -9442 -2075 -9759 -5262 5461 -6842 -3460 286 -5511 -3657 1989 624 1352 -2983 178 1609 3500 1530 630 1039 -416 -2 3640 10 -1362 658 -1263 1920 1937 -2135 -2302 -4269 -346 -844 -1255 -884 -38 -732 465 -1428 944 -620 -355 -15 -385 -501 1226 -258 636 1381 713 1341 891 473 163 102 902 1684 764 2233 1415 560 -543 -1206 848 654 444 225 674 362 114 -324 -959 -1953 -1549 -140 -1516 -1087 -1588 -977 -1343 -494 329 -37 192 634 404 -214 -65 -309 -386 -6 414 758 530 -64 -309 -819 -891 -340 -413 -839 -711 -762 -478 343 586 642 625 564 -35 -394 -572 53 319 541 216 259 966 612 599 -149 -139 -42 374 412 47 -174 -444 -348 93 120 -358 69 389 -131 61 -545 -395 -368 -257 -630 -803 -650 -128 -703 -407 430 -657 -317 26 -625 -481 290 96 219 -534 33 304 666 292 125 222 -95 0 857 2 -295 140 -303 489 550 -620 -674 -1222 -106 -275 -498 -388 -19 -374 227 -724 466 -314 -178 -8 -205 -269 644 -151 390 842 458 873 600 321 108 67 599 1199 566 1790 1107 435 -400 -875 632 530 403 203 609 334 98 -268 -720 -1498 -1155 -119 -1393 -1054 -1596 -1014 -1425 -562 391 -44 229 732 454 -234 -65 -315 -394 -7 501 940 719 -87 -396 -1021 -1064 -405 -518 -1069 -944 -1024 -677 496 877 996 952 844 -50 -531 -799 73 470 817 337 395 1439 882 851 -205 -189 -57 517 619 73 -271 -710 -572 157 206 -635 125 717 -235 105 -942 -656 SS 20250427T141021.9Z 9248.590532 105 1 7.49 2 61.84 89.21 58.24 89.17 0.00 1 0.00 1 0 17 1.083e-02 6.317e-03 4.571e-03 2.093e-03 2.607292e-01 1.052180e-03 2.869036e-03 -6.000000e+00 6.101664e-03 229.91 -2.00 3.23 -2.00 316.37 0.00e+00 5.899208e-04 1.211994e-04 7.361442e-05 -6.000000e+00 2.722337e-04 287.83 -2.00 20.00 -2.00 315.59 0.00e+00 2.108 0.000 302.00 328.00 3 3.5039e+00 2.7463e-03 2.3998e-02 -6.0000e+00 1.5226e-02 7.8490e-03 3.0668e-03 1.2416e-02 -6.0000e+00 1.6480e-02 -3.0724e-03 1.7829e-03 6.0302e-03 -6.0000e+00 9.8242e-03 -1.6960e-03 8.4976e-04 1.7135e-03 -6.0000e+00 4.2375e-03 1.4971e-03 1.9284e-04 5.5229e-05 1.7668e-05 -6.0000e+00 2.6878e-04 1.1199e-02 0.0000e+00 12 1 1 12 1 1 99.98 25.22 0.28 0.01120 0.01265 18 15 1 5 0 393.980 33.50 19.99 25.22 28.79 0.0 992.61 -480 -2378 -1431 -1659 -5954 -714 -1158 -1036 607 -2743 -2613 -2306 -857 -1568 -218 1859 1006 516 1269 1179 1038 518 1738 2141 304 156 -96 959 -307 -289 1535 646 1576 -396 -2770 -3085 -1752 -648 -113 -104 73 -359 -210 -973 -35 -579 -42 -592 -689 -677 374 224 930 952 907 756 290 234 588 161 715 1365 1225 1515 1177 68 -538 -1065 -247 509 490 491 551 524 362 -115 -1071 -1796 -998 -1154 -884 -952 -1649 -1604 -935 -555 243 -147 689 739 479 266 -299 -481 -151 80 102 917 706 159 -69 -906 -1288 -716 -414 -840 -530 -326 -45 179 511 531 467 315 54 -241 -290 -262 284 522 59 87 444 603 524 285 38 -61 362 109 182 -193 -82 -432 11 213 -142 377 454 -310 -371 -386 -565 -81 -451 -278 -303 -979 -107 -186 -185 120 -598 -553 -491 -204 -396 -62 582 329 176 414 399 361 177 599 785 119 64 -40 368 -109 -101 565 257 678 -170 -1203 -1283 -795 -310 -60 -62 48 -232 -140 -664 -23 -393 -28 -407 -466 -453 247 160 693 711 704 595 235 189 464 126 570 1101 1077 1365 1080 61 -446 -903 -204 455 464 488 552 508 346 -104 -927 -1463 -825 -1027 -841 -960 -1725 -1737 -1031 -659 290 -183 862 898 561 299 -322 -489 -160 90 121 1158 930 208 -90 -1091 -1494 -833 -510 -1057 -692 -431 -62 252 765 787 697 440 72 -309 -383 -343 381 756 85 125 648 845 720 375 49 -78 471 152 260 -276 -119 -643 17 332 -229 617 759 -510 -587 -612 -867 SS 20250427T144130.8Z 9248.612162 123 1 53.71 2 55.05 93.11 51.59 92.78 0.00 1 0.00 1 0 17 4.875e-02 1.986e-02 1.638e-02 6.037e-03 2.223811e-01 3.007679e-03 2.566500e-03 -6.000000e+00 2.745120e-02 229.91 -2.00 3.23 -2.00 316.92 0.00e+00 2.824701e-03 3.968872e-04 5.130574e-04 -6.000000e+00 1.225159e-03 287.84 -2.00 20.00 -2.00 316.10 0.00e+00 1.741 0.000 302.00 328.00 3 7.1316e+00 7.9166e-03 1.9974e-02 -6.0000e+00 6.8500e-02 9.2712e-02 8.8766e-03 1.0557e-02 -6.0000e+00 7.4146e-02 -2.5891e-03 5.2295e-03 5.2223e-03 -6.0000e+00 4.4203e-02 -8.4790e-03 2.5517e-03 1.9647e-03 -6.0000e+00 1.9059e-02 5.7503e-05 -3.8734e-04 1.6317e-04 1.5035e-05 -6.0000e+00 1.2096e-03 1.3264e-02 0.0000e+00 12 9 8 11 40 0 99.96 25.26 1.61 0.01326 0.01035 23 3 1 5 0 2335.140 33.50 20.00 25.26 29.25 0.0 995.10 -3572 5924 -7587 1177 -4754 33070 -307 -2013 -9537 -17987 11221 5809 -9237 -6365 676 9966 -657 -1707 308 -11193 9505 7127 -53 1649 4008 -2258 4773 307 7518 1260 -1480 -2053 623 5026 -9906 -14082 -2090 2186 -3523 2949 2942 -1338 1884 429 -3510 4672 3650 383 -5958 1983 2794 -5017 3764 2792 -317 2525 -2279 517 3030 -5008 817 127 2071 4375 3044 2827 4411 -1644 -2805 -2813 40 -2375 -372 1871 -331 -1614 408 -6011 -375 3757 -2757 -298 857 -237 2317 -263 220 913 -888 603 724 -96 -2890 -1254 -2515 462 1524 -543 386 -822 -1369 -1201 -1912 -3556 -321 -2344 -585 957 911 -332 1186 -692 322 1744 -296 925 -2110 1170 1782 721 -855 2302 2254 1992 1597 334 -990 -684 380 -2519 -976 -1222 -1190 255 -1078 1309 975 2697 1227 -497 -2015 -1293 -763 -528 872 -1318 175 -644 2901 -39 -288 -1628 -3526 1579 862 -1805 -1386 157 2347 -177 -480 88 -3716 2619 1959 -16 506 1234 -764 1523 96 2005 350 -451 -668 214 1740 -3627 -5090 -736 839 -1709 1585 1729 -847 1197 280 -2372 2926 2267 238 -3837 1158 1697 -3532 2537 2004 -241 1881 -1814 399 2224 -3948 623 105 1651 3666 2611 2428 3412 -1292 -2291 -2386 37 -2330 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