File name: Pandora132s1_Berlin_20230927_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T204534.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c13p1-8 Local principal investigator: Thomas Ruhtz Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 132 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora132_OF_v1d20200910.txt Instrument calibration file used: Pandora132s1_CF_v13d20210422.txt Level 1 file used: Pandora132s1_Berlin_20230927_L1_smca1c13d20210422p1-8.txt Full location name: Institute of Space Sciences FU Berlin Short location name: Berlin Country of location: Germany Location latitude [deg]: 52.4600 Location longitude [deg]: 13.3100 Location altitude [m]: 100 Local noon date: 20230927 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: Modification of session 11, but different RefDay (April 2021). First and last pixel inside fitting window: 243 385 Nominal wavelengths inside fitting window [nm]: 305.1071 305.2480 305.3889 305.5298 305.6707 305.8116 305.9524 306.0932 306.2341 306.3749 306.5157 306.6565 306.7973 306.9380 307.0788 307.2195 307.3603 307.5010 307.6417 307.7824 307.9231 308.0638 308.2044 308.3451 308.4857 308.6264 308.7670 308.9076 309.0482 309.1888 309.3293 309.4699 309.6104 309.7510 309.8915 310.0320 310.1725 310.3130 310.4534 310.5939 310.7344 310.8748 311.0152 311.1556 311.2960 311.4364 311.5768 311.7172 311.8575 311.9979 312.1382 312.2785 312.4188 312.5591 312.6994 312.8397 312.9800 313.1202 313.2604 313.4007 313.5409 313.6811 313.8213 313.9615 314.1016 314.2418 314.3819 314.5221 314.6622 314.8023 314.9424 315.0825 315.2225 315.3626 315.5026 315.6427 315.7827 315.9227 316.0627 316.2027 316.3427 316.4827 316.6226 316.7626 316.9025 317.0424 317.1823 317.3222 317.4621 317.6020 317.7418 317.8817 318.0215 318.1613 318.3012 318.4410 318.5807 318.7205 318.8603 319.0000 319.1398 319.2795 319.4192 319.5589 319.6986 319.8383 319.9780 320.1177 320.2573 320.3969 320.5366 320.6762 320.8158 320.9554 321.0949 321.2345 321.3741 321.5136 321.6531 321.7927 321.9322 322.0717 322.2111 322.3506 322.4901 322.6295 322.7689 322.9084 323.0478 323.1872 323.3266 323.4659 323.6053 323.7447 323.8840 324.0233 324.1627 324.3020 324.4413 324.5805 324.7198 324.8591 324.9983 --------------------------------------------------------------------------------------- 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: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Temperature at electronics board 1 [°C], 999=no temperature signal Column 98: Temperature at electronics board 2 [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: 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 20230927T060305.9Z 8670.252151 142 1 49.15 2 81.41 103.98 127.26 297.82 0.00 1 0.00 1 0 17 5.026e-01 2.382e-02 2.665e-01 1.159e-02 6.531628e-01 6.554816e-03 8.106881e-03 -6.000000e+00 2.936874e-01 226.98 -2.00 3.85 -2.00 321.72 0.00e+00 8.053245e-04 3.405277e-03 5.408546e-03 -6.000000e+00 1.510984e-02 278.03 -2.00 20.00 -2.00 321.21 0.00e+00 6.311 0.005 302.00 328.00 3 2.1207e+00 2.3352e-02 7.7796e-02 -6.0000e+00 7.3213e-01 2.9379e-01 3.1706e-02 5.2993e-02 -6.0000e+00 8.0141e-01 -4.8476e-01 3.0506e-02 2.5107e-02 -6.0000e+00 4.7148e-01 2.0885e-01 1.4309e-02 6.3045e-03 -6.0000e+00 1.9978e-01 7.2138e-05 8.1458e-05 3.6306e-04 1.2210e-04 -6.0000e+00 1.4382e-02 -8.4964e-03 0.0000e+00 12 9 9 12 4 4 47.15 6.20 0.30 -0.00850 -0.00788 49 10 4 8 0 1002.800 15.00 6.20 22.85 21.38 21.88 28.7 979.47 900000 -105676 900000 900000 -136522 900000 -210519 900000 -188918 900000 -143998 900000 -96124 -78280 75184 -98254 900000 -86770 900000 -21084 112929 -52046 900000 56072 -46928 900000 -5597 237923 -65157 900000 5681 34215 82020 -7847 66835 -38624 78944 -32024 123261 2837 42212 25864 10922 57781 -12175 75911 14743 59657 -13136 25788 39144 15667 50556 11546 37520 -4447 20615 -3281 22642 3220 11434 18019 7352 21602 -2298 25346 -133 11467 6326 11051 7756 1503 9269 284 11839 -6803 5436 -427 3313 3389 -2101 3654 -5482 3443 -6537 1487 -743 1317 -29 -2490 5607 -3143 2557 -6510 -1193 -6820 -2986 -2573 -1271 1028 -3392 2052 -6679 1931 -3793 -1375 -420 -1504 998 -1002 1974 -608 1300 -2348 454 171 134 1081 516 1501 -213 1801 -237 708 1288 1396 267 1880 1939 -347 829 -1082 391 -477 611 218 -266 1244 -1103 195 -887 444 -1650 900000 -1517 900000 900000 -2239 900000 -7770 900000 -6972 900000 -3691 900000 -2168 -1846 848 -3928 900000 -3647 900000 -497 1274 -1654 900000 759 -1732 900000 -151 2683 -2739 900000 167 887 1480 -354 1357 -2059 1602 -2167 2363 192 2333 1779 817 2997 -1161 3339 1214 3229 -1401 2210 3267 1670 4561 1503 4358 -743 2726 -542 2785 475 1629 2679 1379 3876 -537 4365 -29 2375 1563 2968 2330 493 2737 85 2876 -1799 1215 -106 910 1105 -842 1562 -2788 1705 -3827 855 -459 812 -18 -1501 2915 -1679 1266 -3764 -746 -5251 -2556 -2480 -1288 1001 -3182 1641 -5526 1522 -3410 -1279 -411 -1605 1157 -1331 2787 -917 1910 -3431 612 225 182 1531 779 2304 -327 2608 -339 972 1697 1767 337 2523 2957 -608 1558 -2190 824 -1083 1464 546 -685 3187 -2856 476 -2053 958 -3613 SS 20230927T061119.0Z 8670.257859 146 1 50.05 2 80.20 105.66 128.28 299.86 0.00 1 0.00 1 0 25 4.020e-01 1.047e-02 2.455e-01 4.955e-03 6.154816e-01 2.679718e-03 7.383815e-03 -6.000000e+00 2.288204e-01 226.98 -2.00 3.85 -2.00 321.49 0.00e+00 4.215770e-03 1.312258e-03 7.680381e-04 -6.000000e+00 1.011507e-02 278.02 -2.00 20.00 -2.00 320.96 0.00e+00 5.611 0.004 302.00 328.00 3 1.3177e+00 9.1880e-03 6.5791e-02 -6.0000e+00 5.6813e-01 6.3593e-02 1.2574e-02 3.6826e-02 -6.0000e+00 6.1909e-01 -1.2241e-01 1.2868e-02 1.9470e-02 -6.0000e+00 3.6817e-01 5.4731e-02 6.1229e-03 7.9883e-03 -6.0000e+00 1.5495e-01 3.2130e-04 -2.3013e-04 1.4961e-04 9.3289e-05 -6.0000e+00 1.1038e-02 -8.2741e-03 0.0000e+00 12 9 9 12 4 4 88.44 6.28 0.32 -0.00827 -0.01000 201 43 4 8 0 246.480 15.00 6.28 23.37 21.38 21.88 28.7 982.62 -26538 -163267 900000 -192149 -49412 -207863 -26621 -158737 31003 -115674 -122004 -43916 -88148 51128 -94099 26201 -72106 26485 -27991 -22826 1871 -61824 42093 -78581 45111 -56415 15 -27892 -24437 -13954 -32061 20519 -31899 22802 -25365 -91 -9382 5890 7271 -6295 13536 -8011 15147 284 14324 -1981 12252 4020 994 7522 2075 12328 4422 10328 3094 5742 1910 3769 7414 1209 7695 1347 8700 3199 4965 1930 2277 2693 -392 5905 -2170 3337 -91 1671 -37 -2 -215 -3907 3295 -1976 865 -2516 -1267 -2934 -1142 -1048 -183 767 -458 2421 -268 1679 -2149 565 -831 -860 54 -488 714 -1478 251 -1299 -152 -140 -829 -866 -1051 -510 -229 533 -255 206 49 -109 -245 -347 280 -135 663 -517 425 256 1075 421 577 90 -1051 1623 256 731 -336 46 -149 67 126 -490 376 115 356 -267 303 -518 -755 -128 -1936 900000 -3038 -239 -3560 -129 -2091 150 -1285 -1532 -297 -1192 247 -2182 215 -1777 269 -527 -430 28 -1762 447 -3037 545 -1962 0 -714 -614 -351 -1162 525 -1572 672 -1164 -3 -422 276 411 -477 935 -735 1156 26 1156 -193 1065 394 106 810 264 1578 671 1592 540 1015 358 687 1271 221 1394 292 1811 778 1221 476 553 685 -116 1880 -813 1218 -33 568 -12 -1 -64 -1265 1035 -776 384 -1302 -702 -1758 -719 -703 -128 542 -324 1589 -169 972 -1259 341 -577 -693 50 -509 784 -1631 251 -1187 -130 -125 -796 -881 -1135 -588 -292 752 -395 329 78 -165 -351 -483 396 -203 1048 -850 682 395 1595 608 801 120 -1403 2259 408 1297 -652 93 -320 154 308 -1252 973 301 923 -665 708 -1153 -1675 SS 20230927T062009.2Z 8670.263995 150 1 49.70 2 78.91 107.48 129.35 302.09 0.00 1 0.00 1 0 25 2.862e-01 6.882e-03 1.537e-01 3.621e-03 5.626890e-01 1.928895e-03 6.902944e-03 -6.000000e+00 1.629308e-01 226.98 -2.00 3.85 -2.00 321.21 0.00e+00 3.731677e-03 8.739904e-04 1.254069e-03 -6.000000e+00 7.099956e-03 278.02 -2.00 20.00 -2.00 320.66 0.00e+00 5.015 0.003 302.00 328.00 3 1.5113e+00 6.3257e-03 5.9038e-02 -6.0000e+00 4.0453e-01 2.2684e-02 8.3761e-03 3.2995e-02 -6.0000e+00 4.4083e-01 -2.9373e-02 8.3794e-03 1.7948e-02 -6.0000e+00 2.6198e-01 8.0148e-03 4.0683e-03 6.8129e-03 -6.0000e+00 1.0984e-01 4.8265e-04 -2.5396e-04 1.0990e-04 8.4335e-05 -6.0000e+00 7.8303e-03 -8.3682e-03 0.0000e+00 12 9 1 12 4 4 96.16 6.22 0.23 -0.00837 -0.01028 221 47 4 8 0 223.800 15.00 6.22 24.10 21.48 21.88 28.7 985.48 -67628 -131845 -43113 -64979 -121316 -17440 -131497 -100338 -86135 -69896 -102542 -65704 -21758 -41186 -1576 -69637 -6282 -33009 -18033 -25744 6549 -17020 -32543 -20465 -26560 1816 -19763 -5698 -21338 -7630 -1198 -1966 14991 -17527 -621 -17132 6688 -4029 4520 -4386 1977 7305 -890 7968 -2567 2554 664 5768 837 3100 3960 3476 4290 -839 3915 395 3203 922 635 1648 1975 4191 1572 4089 1285 2116 756 288 1177 795 2309 366 1216 -468 721 -1372 -322 -1784 -835 -744 -1637 -1590 -2754 -783 -1240 -428 314 135 866 647 1204 -483 -221 -665 175 100 -18 998 -201 68 -615 -668 -959 -483 -1300 -1678 -316 -1221 586 355 630 139 360 -406 54 102 232 246 229 -158 -319 377 598 456 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