File name: Pandora177s1_WestportCT_20240928_L2Fit_fout2c7d20230401p1-8.txt File generation date: 20241124T071435.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c7p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 177 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora177_OF_v3d20201002.txt Instrument calibration file used: Pandora177s1_CF_v7d20230401.txt Level 1 file used: Pandora177s1_WestportCT_20240928_L1_smca1c7d20230401p1-8.txt Full location name: Westport - Sherwood Island State Park CTDEEP (USEPA AQS ID 09-001-9003) Short location name: WestportCT Country of location: USA Location latitude [deg]: 41.1183 Location longitude [deg]: -73.3367 Location altitude [m]: 4 Local noon date: 20240928 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: None First and last pixel inside fitting window: 218 359 Nominal wavelengths inside fitting window [nm]: 305.1028 305.2437 305.3847 305.5256 305.6665 305.8074 305.9483 306.0891 306.2300 306.3709 306.5117 306.6525 306.7934 306.9342 307.0750 307.2157 307.3565 307.4973 307.6380 307.7788 307.9195 308.0602 308.2009 308.3416 308.4823 308.6230 308.7637 308.9043 309.0450 309.1856 309.3262 309.4668 309.6074 309.7480 309.8886 310.0291 310.1697 310.3102 310.4508 310.5913 310.7318 310.8723 311.0128 311.1533 311.2937 311.4342 311.5746 311.7151 311.8555 311.9959 312.1363 312.2767 312.4170 312.5574 312.6978 312.8381 312.9784 313.1188 313.2591 313.3994 313.5396 313.6799 313.8202 313.9604 314.1007 314.2409 314.3811 314.5213 314.6615 314.8017 314.9419 315.0821 315.2222 315.3623 315.5025 315.6426 315.7827 315.9228 316.0629 316.2030 316.3430 316.4831 316.6231 316.7631 316.9031 317.0432 317.1831 317.3231 317.4631 317.6031 317.7430 317.8829 318.0229 318.1628 318.3027 318.4426 318.5825 318.7223 318.8622 319.0020 319.1419 319.2817 319.4215 319.5613 319.7011 319.8409 319.9807 320.1204 320.2602 320.3999 320.5396 320.6793 320.8190 320.9587 321.0984 321.2381 321.3777 321.5174 321.6570 321.7966 321.9362 322.0758 322.2154 322.3550 322.4946 322.6341 322.7736 322.9132 323.0527 323.1922 323.3317 323.4712 323.6107 323.7501 323.8896 324.0290 324.1684 324.3079 324.4473 324.5867 324.7260 324.8654 --------------------------------------------------------------------------------------- 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 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: 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 20240928T144421.8Z 9037.614141 299 1 49.38 2 51.28 140.38 25.24 206.63 0.00 1 0.00 1 0 25 1.651e-02 1.205e-02 3.112e-04 1.503e-04 1.948364e-01 7.895018e-05 2.358495e-03 -6.000000e+00 9.838284e-03 227.69 -2.00 3.51 -2.00 316.30 0.00e+00 1.057672e-03 8.979487e-06 2.555421e-04 -6.000000e+00 4.393134e-04 286.10 -2.00 20.00 -2.00 315.55 0.00e+00 1.595 0.000 302.00 328.00 3 1.9488e-01 2.0475e-04 1.8749e-02 -6.0000e+00 2.4402e-02 1.5135e-02 2.2761e-04 9.8819e-03 -6.0000e+00 2.6372e-02 -3.9778e-03 1.3234e-04 4.8291e-03 -6.0000e+00 1.5741e-02 -6.7794e-03 6.2202e-05 1.4027e-03 -6.0000e+00 6.7524e-03 7.2400e-02 4.6893e-04 4.6281e-06 1.6964e-05 -6.0000e+00 4.8587e-04 7.5179e-03 0.0000e+00 12 8 8 10 0 0 99.58 23.30 0.34 0.00752 0.01104 2726 627 1 5 0 17.880 26.62 20.00 23.30 25.35 26.6 1025.89 1981 611 -326 -3517 -3647 -2962 -817 374 -1516 -4137 -5334 -3182 -1590 213 626 65 425 1750 1781 2332 1024 861 1605 1891 1670 572 -704 -937 -734 -322 1398 1654 499 -3925 -5751 -4769 -3493 -950 -262 -707 -534 -57 241 284 960 320 -120 -554 -923 116 1076 1057 1179 998 576 1307 435 -171 -292 243 1421 2397 2819 2118 -101 -1417 -1656 -745 1815 1300 1097 1518 1244 1285 -231 -1559 -2876 -3264 -1973 -2283 -2337 -2584 -2835 -1478 -284 474 1340 1341 1667 1290 388 -1059 -1609 -586 -606 -117 804 1427 518 -571 -1592 -2106 -966 -582 -1720 -1766 -1007 -700 901 1504 1511 1064 610 -76 -519 -392 -41 208 1042 558 792 755 1161 692 798 -803 -578 497 11 -237 -990 -1200 -454 20 311 151 759 719 486 -137 -653 -1607 383 126 -66 -678 -640 -503 -146 74 -327 -927 -1201 -732 -400 60 193 21 144 602 631 843 378 317 597 734 679 237 -286 -359 -266 -115 516 654 208 -1684 -2400 -1989 -1604 -458 -147 -446 -360 -39 170 201 673 223 -82 -367 -601 76 730 762 889 779 462 1057 357 -140 -236 198 1196 1969 2459 1909 -90 -1169 -1389 -622 1479 1180 1066 1505 1220 1202 -202 -1357 -2322 -2593 -1654 -2142 -2227 -2667 -3102 -1686 -316 558 1641 1668 2034 1504 454 -1140 -1618 -583 -644 -136 940 1787 673 -725 -1891 -2551 -1152 -729 -2158 -2337 -1379 -996 1329 2319 2220 1547 906 -105 -664 -482 -51 274 1455 823 1184 1110 1642 942 1033 -1085 -755 658 14 -328 -1423 -1757 -678 31 473 240 1230 1181 798 -221 -1023 -2473 SS 20240928T145035.7Z 9037.618469 303 1 48.77 2 50.55 142.15 25.81 209.74 0.00 1 0.00 1 0 17 1.623e-02 1.202e-02 4.202e-04 2.105e-04 1.928540e-01 1.108225e-04 2.335641e-03 -6.000000e+00 9.673479e-03 227.69 -2.00 3.51 -2.00 316.19 0.00e+00 9.292850e-04 1.235465e-05 2.378825e-04 -6.000000e+00 4.319346e-04 286.10 -2.00 20.00 -2.00 315.46 0.00e+00 1.570 0.000 302.00 328.00 3 9.4101e-01 2.8692e-04 1.8491e-02 -6.0000e+00 2.3993e-02 2.0711e-02 3.1940e-04 9.7850e-03 -6.0000e+00 2.5930e-02 -4.7778e-03 1.8453e-04 4.7743e-03 -6.0000e+00 1.5477e-02 -6.4473e-03 8.5916e-05 1.3675e-03 -6.0000e+00 6.6396e-03 3.5247e-02 4.0721e-04 6.4993e-06 1.6908e-05 -6.0000e+00 4.7770e-04 7.0983e-03 0.0000e+00 12 8 8 10 0 0 99.24 23.32 0.34 0.00710 0.01016 1148 264 1 5 0 42.470 26.73 20.00 23.32 26.74 26.5 1034.72 1896 706 -299 -3610 -3573 -2907 -576 538 -1167 -3907 -4962 -3005 -1429 193 670 142 350 1695 1668 2254 986 841 1632 1925 1843 734 -504 -848 -613 -306 1479 1651 441 -3844 -5719 -4829 -3541 -978 -283 -691 -537 -32 256 292 975 279 -118 -530 -917 85 1011 993 1136 943 549 1318 411 -167 -305 243 1366 2336 2798 2065 -133 -1409 -1594 -769 1794 1259 1026 1519 1195 1280 -206 -1592 -2866 -3263 -1987 -2277 -2379 -2610 -2852 -1497 -323 450 1329 1318 1663 1280 400 -999 -1562 -560 -612 -134 762 1368 492 -571 -1573 -2065 -966 -593 -1708 -1750 -985 -707 885 1469 1497 1023 607 -65 -494 -380 -36 218 1014 546 777 712 1159 677 791 -767 -610 500 33 -194 -946 -1152 -419 47 334 182 751 724 485 -164 -659 -1647 387 153 -64 -735 -661 -520 -108 111 -264 -921 -1173 -726 -377 57 217 49 124 610 618 852 380 323 634 710 711 289 -213 -339 -231 -114 567 678 191 -1711 -2477 -2092 -1533 -489 -165 -452 -376 -23 187 214 708 201 -83 -363 -616 57 709 738 884 696 415 1008 319 -129 -233 187 1086 1976 2511 1915 -122 -1194 -1258 -605 1501 1173 1024 1546 1202 1229 -185 -1304 -2374 -2655 -1704 -2003 -2320 -2756 -3191 -1612 -367 542 1664 1676 2074 1525 443 -1098 -1604 -569 -664 -158 909 1747 652 -738 -1905 -2352 -1083 -699 -2181 -2358 -1374 -951 1234 2141 2237 1512 850 -92 -641 -475 -46 291 1438 760 1096 1063 1665 936 1039 -971 -747 619 44 -272 -1378 -1707 -633 68 514 293 1232 1204 806 -268 -1045 -2565 SS 20240928T145554.3Z 9037.622156 306 1 49.58 2 49.94 143.69 26.33 212.30 0.00 1 0.00 1 0 17 1.633e-02 1.195e-02 3.267e-04 1.568e-04 1.912094e-01 8.214486e-05 2.310580e-03 -6.000000e+00 9.732400e-03 227.69 -2.00 3.51 -2.00 316.37 0.00e+00 9.792485e-04 9.484631e-06 2.531364e-04 -6.000000e+00 4.345615e-04 286.10 -2.00 20.00 -2.00 315.62 0.00e+00 1.551 0.000 302.00 328.00 3 2.7873e-01 2.1314e-04 1.8277e-02 -6.0000e+00 2.4139e-02 1.7541e-02 2.3783e-04 9.6916e-03 -6.0000e+00 2.6088e-02 -5.1636e-03 1.3753e-04 4.7363e-03 -6.0000e+00 1.5572e-02 -6.2166e-03 6.4336e-05 1.3666e-03 -6.0000e+00 6.6801e-03 6.9975e-02 4.4159e-04 4.8326e-06 1.6832e-05 -6.0000e+00 4.8061e-04 7.0170e-03 0.0000e+00 12 8 8 10 0 0 99.95 23.30 0.37 0.00702 0.01034 3052 702 1 5 0 15.970 26.73 20.00 23.30 27.31 26.3 1036.74 1971 771 -385 -3432 -3711 -2899 -509 443 -1398 -4099 -5072 -3143 -1445 242 728 132 275 1698 1581 2391 884 859 1594 1942 1704 697 -630 -859 -688 -403 1439 1570 547 -3863 -5675 -4729 -3584 -1059 -284 -763 -590 -68 174 257 930 325 -159 -508 -865 81 1034 993 1170 926 575 1311 383 -163 -339 200 1305 2309 2739 2081 -122 -1398 -1648 -784 1824 1244 1042 1464 1249 1310 -181 -1506 -2846 -3287 -2011 -2365 -2433 -2622 -2905 -1546 -339 419 1293 1285 1644 1268 382 -1016 -1623 -629 -618 -187 749 1414 499 -541 -1585 -2105 -973 -609 -1715 -1776 -988 -727 875 1480 1506 1034 616 -95 -494 -400 -90 188 1005 521 747 745 1140 673 820 -784 -593 471 -5 -214 -946 -1167 -418 63 331 183 757 719 504 -147 -642 -1628 382 159 -79 -663 -653 -492 -90 87 -301 -917 -1138 -720 -362 67 223 43 92 578 555 854 323 312 585 744 684 285 -252 -324 -245 -141 521 609 223 -1622 -2316 -1929 -1610 -499 -156 -471 -389 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