File name: Pandora132s1_Berlin_20230407_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T192727.2Z 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_20230407_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: 20230407 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 20230407T052002.7Z 8497.222254 207 1 49.87 2 83.00 88.05 94.21 256.36 0.00 1 0.00 1 0 25 5.178e-01 4.788e-02 5.179e-01 4.961e-02 9.921995e-01 2.988948e-02 1.144428e-02 -6.000000e+00 3.060665e-01 226.95 -2.00 3.85 -2.00 322.15 0.00e+00 2.619531e-03 1.387261e-02 5.080419e-03 -6.000000e+00 1.671056e-02 271.27 -2.00 20.00 -2.00 321.72 0.00e+00 7.534 0.009 302.00 328.00 3 2.2593e+00 1.0273e-01 9.9786e-02 -6.0000e+00 7.6363e-01 1.5992e+00 1.2313e-01 7.2769e-02 -6.0000e+00 8.3692e-01 -1.8093e+00 9.5128e-02 3.1357e-02 -6.0000e+00 4.8965e-01 6.9119e-01 4.9965e-02 1.0819e-02 -6.0000e+00 2.0872e-01 9.4234e-06 -6.3143e-05 1.3604e-03 1.3145e-04 -6.0000e+00 1.5483e-02 -3.0361e-02 0.0000e+00 12 8 8 10 0 0 -29.80 15.88 0.61 -0.03036 -0.03084 14 3 4 8 0 3558.800 15.00 15.88 11.82 20.46 20.87 26.7 1006.14 211633 900000 15655 900000 900000 900000 900000 -87557 -95164 900000 900000 900000 900000 142530 -83637 900000 18032 900000 89700 900000 58560 -92995 6976 -92571 -40421 88699 81318 71885 900000 54140 95682 -61873 -26875 101055 -52150 900000 -13533 900000 85485 -6982 900000 82548 191978 58880 46582 16113 -15326 900000 45742 900000 10873 52623 129556 123816 83143 39676 53422 5976 -5388 45140 89161 54883 30034 3023 -21586 69486 23418 86963 -7542 12689 19455 64069 43719 48193 41453 7399 3004 -35967 8564 -16276 -6341 3458 3749 13003 1626 -4237 -1821 3927 -7275 5508 -331 14606 18056 2578 1749 -3887 699 -1922 -1552 9925 -1663 -12134 -15579 3263 3653 2494 -11626 7400 117 -1613 -315 -2286 -2095 -3110 -4279 -1142 1162 -6906 6341 1533 956 6991 -1784 4755 1791 3479 2566 489 926 -1945 197 3603 1059 604 181 -643 -698 1355 237 1508 -940 -832 -4491 10201 900000 755 900000 900000 900000 900000 -4220 -4969 900000 900000 900000 900000 6870 -8429 900000 869 900000 4324 900000 2823 -10188 336 -10141 -2657 4275 3920 3465 900000 2610 4612 -6236 -2120 4871 -4799 900000 -830 900000 4121 -612 900000 3979 9254 2838 2449 1130 -1478 900000 2866 900000 1048 3690 6245 5968 5611 3825 4893 759 -708 3699 4727 4497 3619 490 -4729 6699 3284 7545 -1719 2669 4092 9574 7586 7201 5795 1284 521 -8984 1775 -4779 -2001 1136 1347 4501 662 -1912 -830 1704 -3443 2172 -129 4672 5618 1028 828 -2334 475 -1549 -1360 7741 -1341 -9518 -11401 1973 2337 1705 -9730 5610 109 -1788 -393 -3155 -2965 -4388 -5906 -1496 1517 -10258 8641 2210 1327 8577 -2282 5542 2088 3857 2855 611 1359 -3435 383 7341 2380 1473 474 -1763 -1939 3686 638 3766 -2194 -1779 -9664 SS 20230407T062026.2Z 8497.264193 230 1 49.48 2 73.82 100.18 103.19 267.68 0.00 1 0.00 1 0 17 1.764e-01 5.708e-03 5.105e-02 1.897e-03 5.463168e-01 9.830715e-04 6.640573e-03 -6.000000e+00 1.006290e-01 226.95 -2.00 3.85 -2.00 320.55 0.00e+00 1.958623e-03 3.567487e-04 5.353023e-04 -6.000000e+00 4.257410e-03 271.27 -2.00 20.00 -2.00 320.08 0.00e+00 3.530 0.001 302.00 328.00 3 2.0431e+00 2.8943e-03 4.6662e-02 -6.0000e+00 2.5042e-01 5.4580e-02 3.6474e-03 3.1019e-02 -6.0000e+00 2.7289e-01 -2.8086e-02 3.6101e-03 1.6438e-02 -6.0000e+00 1.6157e-01 -1.6692e-03 1.8356e-03 5.9032e-03 -6.0000e+00 6.7614e-02 1.0883e-03 2.1493e-04 5.5224e-05 5.9161e-05 -6.0000e+00 4.8156e-03 -3.1916e-02 0.0000e+00 10 0 0 10 0 0 52.70 15.92 0.17 -0.03192 -0.03030 236 50 4 8 0 208.720 15.02 15.92 12.93 20.46 20.87 26.8 1011.61 -70426 -44032 -70587 -64551 -50765 -70815 -53622 -75736 -36858 -60392 -32903 -43655 -19952 -15623 -14892 -1625 -15574 177 -12944 2 -12839 -2500 -5581 -6959 -1477 -10471 -2607 -11478 -7554 -9064 -1897 -2355 2090 -468 -4692 -2625 -4488 138 1652 962 -555 -111 1283 -119 2490 561 1728 1133 1679 -628 2340 2528 25 2665 180 2150 363 468 -112 17 954 1174 2792 2061 1358 -432 -7 -1101 1100 1458 501 934 4 783 -164 -398 -1741 -1846 -1621 -830 -1042 -1556 -1565 -1687 -542 -768 579 683 972 919 996 459 -1055 -263 -510 218 64 683 650 -127 -65 -1269 -478 -129 -436 -1341 -319 -681 95 405 345 192 115 -204 -422 -70 408 6 480 -22 -7 -8 628 91 483 113 -465 731 297 81 -364 -452 -453 48 92 -198 134 517 132 -106 228 -564 -256 -782 -432 -953 -788 -498 -838 -585 -1191 -443 -983 -426 -711 -317 -301 -350 -39 -478 5 -455 0 -487 -86 -207 -286 -62 -507 -117 -546 -341 -443 -100 -147 142 -34 -342 -187 -363 13 186 116 -76 -16 192 -19 381 89 275 185 282 -115 457 547 6 673 49 596 105 134 -31 5 273 370 974 796 543 -169 -3 -432 470 708 268 515 2 401 -78 -170 -700 -752 -734 -436 -634 -1069 -1163 -1328 -450 -681 532 641 901 816 823 353 -786 -200 -432 210 70 838 853 -165 -78 -1398 -490 -135 -492 -1613 -400 -910 138 591 545 314 186 -314 -609 -105 616 9 739 -35 -12 -13 1011 142 719 161 -649 1054 478 133 -646 -841 -880 97 200 -452 312 1212 308 -240 484 -1145 -509 SS 20230407T062832.8Z 8497.269824 234 1 49.54 2 72.61 101.86 104.41 269.21 0.00 1 0.00 1 0 17 1.306e-01 5.490e-03 4.310e-02 1.839e-03 5.134423e-01 9.435139e-04 6.279539e-03 -6.000000e+00 7.451796e-02 226.95 -2.00 3.85 -2.00 320.35 0.00e+00 2.207201e-03 3.228076e-04 3.979214e-04 -6.000000e+00 3.152742e-03 271.27 -2.00 20.00 -2.00 319.87 0.00e+00 3.298 0.001 302.00 328.00 3 2.2337e+00 2.7454e-03 4.3682e-02 -6.0000e+00 1.8544e-01 4.8065e-02 3.3860e-03 2.9079e-02 -6.0000e+00 2.0208e-01 -1.8810e-02 3.2199e-03 1.5200e-02 -6.0000e+00 1.1964e-01 -5.6170e-03 1.6564e-03 5.5630e-03 -6.0000e+00 5.0069e-02 1.1613e-03 1.9956e-04 5.3752e-05 5.5024e-05 -6.0000e+00 3.5662e-03 -3.1733e-02 0.0000e+00 10 0 0 10 0 0 67.01 15.93 0.22 -0.03173 -0.03023 245 52 4 8 0 201.320 14.99 15.93 13.50 20.56 20.87 26.8 1014.14 -40978 -51361 -23962 -53085 -26908 -74633 -50788 -47563 -26349 -27294 -32243 -16587 -25601 353 -18148 -837 -11807 -2905 -3899 1686 1778 -8249 3850 -4323 1247 -6203 -2498 -8549 -6284 -1608 -3670 5093 -407 4199 -3676 -3821 -4118 -2678 2522 342 1198 -1529 1628 -1237 2014 596 -655 816 -736 1705 843 2072 584 1697 523 1304 957 -907 509 -882 1397 825 2184 2344 893 -26 -734 -535 284 1348 243 974 93 528 171 -1063 -682 -2258 -914 -656 -1090 -1244 -1778 -1774 -842 -304 424 761 1008 1022 746 182 -552 -106 17 140 386 724 476 -110 -193 -1135 -550 83 -632 -1320 -541 -692 62 387 552 21 214 -167 -180 -185 348 -56 338 -65 117 61 377 214 516 103 -633 839 333 -37 -114 -531 -312 -45 104 -250 25 563 137 -92 211 -411 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