File name: Pandora21s1_Bremen_20220215_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T100409.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Tom Hanisco Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 21 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora21_OF_v4d20190904.txt Instrument calibration file used: Pandora21s1_CF_v1d20201116.txt Level 1 file used: Pandora21s1_Bremen_20220215_L1_smca1c1d20201116p1-8.txt Full location name: Bremen University Short location name: Bremen Country of location: Germany Location latitude [deg]: 53.0813 Location longitude [deg]: 8.8126 Location altitude [m]: 50 Local noon date: 20220215 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: 286 428 Nominal wavelengths inside fitting window [nm]: 305.0633 305.2039 305.3445 305.4851 305.6257 305.7662 305.9068 306.0473 306.1878 306.3283 306.4688 306.6093 306.7497 306.8902 307.0306 307.1711 307.3115 307.4519 307.5923 307.7326 307.8730 308.0134 308.1537 308.2940 308.4343 308.5747 308.7149 308.8552 308.9955 309.1357 309.2760 309.4162 309.5564 309.6966 309.8368 309.9770 310.1172 310.2573 310.3975 310.5376 310.6777 310.8178 310.9579 311.0980 311.2380 311.3781 311.5181 311.6582 311.7982 311.9382 312.0782 312.2182 312.3581 312.4981 312.6380 312.7779 312.9179 313.0578 313.1976 313.3375 313.4774 313.6172 313.7571 313.8969 314.0367 314.1765 314.3163 314.4561 314.5959 314.7356 314.8754 315.0151 315.1548 315.2945 315.4342 315.5739 315.7135 315.8532 315.9928 316.1325 316.2721 316.4117 316.5513 316.6908 316.8304 316.9700 317.1095 317.2490 317.3885 317.5280 317.6675 317.8070 317.9465 318.0859 318.2254 318.3648 318.5042 318.6436 318.7830 318.9224 319.0617 319.2011 319.3404 319.4798 319.6191 319.7584 319.8977 320.0369 320.1762 320.3155 320.4547 320.5939 320.7331 320.8723 321.0115 321.1507 321.2899 321.4290 321.5682 321.7073 321.8464 321.9855 322.1246 322.2637 322.4028 322.5418 322.6808 322.8199 322.9589 323.0979 323.2369 323.3759 323.5148 323.6538 323.7927 323.9317 324.0706 324.2095 324.3484 324.4872 324.6261 324.7650 324.9038 --------------------------------------------------------------------------------------- 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 20220215T073120.3Z 8081.313429 275 1 11.94 2 84.20 120.11 95.19 316.96 0.00 1 0.00 1 0 33 9.322e-01 1.059e-01 5.408e-01 8.632e-02 1.249271e+00 5.758867e-02 2.751413e-03 -6.000000e+00 5.979908e-01 223.50 -2.00 3.88 -2.00 321.38 0.00e+00 2.146503e-02 1.713848e-02 1.148383e-03 -6.000000e+00 2.946934e-02 265.92 -2.00 20.00 -2.00 321.14 0.00e+00 8.794 0.015 302.00 328.00 3 8.6917e-01 1.6882e-01 9.2895e-02 -6.0000e+00 1.4957e+00 3.0390e+00 1.9308e-01 2.8370e-02 -6.0000e+00 1.6308e+00 -2.7623e+00 1.2504e-01 1.3390e-02 -6.0000e+00 9.4205e-01 9.1254e-01 7.2758e-02 4.7783e-03 -6.0000e+00 4.1589e-01 4.8193e-06 4.3578e-02 2.2244e-03 2.1523e-05 -6.0000e+00 2.9889e-02 -1.0846e-01 9.5888e-03 12 9 9 12 1 1 99.94 22.21 1.01 -0.10846 0.21901 3 3 1 5 0 2940.818 25.17 20.00 22.21 12.56 28.1 994.45 900000 900000 900000 900000 128413 900000 900000 -77832 -60638 103774 900000 73120 900000 -59495 223902 900000 218013 900000 900000 35270 -10124 900000 900000 88072 900000 900000 900000 900000 900000 900000 900000 -26587 20987 900000 71787 900000 172060 900000 900000 -4058 -18921 -10979 281552 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37341 -3994 5465 9241 -281 9715 11228 900000 17506 8470 900000 21444 -18006 239 7493 1571 -1325 6671 -474 3690 10656 -2656 -14459 12580 10308 -1359 -7129 5391 -22276 2711 6262 -7505 4008 3892 5201 7775 -5097 -5023 1750 -14228 -16667 12337 -943 390 -3988 8695 -15064 -8909 1563 8979 2705 -4628 752 13091 -376 11085 5765 -709 -3750 5024 9621 -8739 3156 10286 914 15902 -7539 1074 -1645 -8307 4958 -10591 1847 -7692 2604 -519 6850 2082 SS 20220215T092837.6Z 8081.394880 339 1 4.02 2 71.38 146.34 104.06 341.95 0.00 1 0.00 1 0 25 2.295e-01 1.227e-02 1.917e-01 1.048e-02 5.274961e-01 5.423587e-03 6.866909e-03 -6.000000e+00 1.348118e-01 223.50 -2.00 3.88 -2.00 319.23 0.00e+00 2.232589e-03 1.289484e-03 2.743683e-04 -6.000000e+00 5.497791e-03 265.92 -2.00 20.00 -2.00 318.96 0.00e+00 3.094 0.001 302.00 328.00 3 4.1346e+00 1.4702e-02 4.2659e-02 -6.0000e+00 3.3403e-01 1.2748e-01 1.6975e-02 2.9524e-02 -6.0000e+00 3.6382e-01 -7.3014e-02 1.4393e-02 1.5308e-02 -6.0000e+00 2.1456e-01 2.7817e-02 7.8125e-03 4.6736e-03 -6.0000e+00 9.0034e-02 1.9488e-04 -8.4345e-04 3.0822e-04 5.5704e-05 -6.0000e+00 6.8789e-03 -1.8701e-02 3.3063e-05 12 9 9 12 1 1 999.00 22.21 0.38 -0.01870 -0.02504 1 5 1 5 0 1917.398 25.28 19.99 22.21 13.62 28.1 1000.03 -80351 50430 -40781 161957 -67040 128088 -17693 -28704 18815 -20466 19240 6418 -24934 -54330 10530 -41529 28062 10537 36138 -42 -3451 31044 -2760 27097 -16967 11249 -8024 9262 13333 -7060 19562 17272 11173 -10804 8797 -2725 -6190 -2792 5290 2219 -4069 2713 -3290 4969 -5604 1458 -3624 2029 1168 6062 1223 2954 4035 -1493 440 705 2752 -3888 1325 -1717 1301 2083 -421 975 -414 2262 -2629 970 -3419 809 1221 1582 636 -8 1620 -1433 -1540 1644 1348 -832 -565 -2247 -1373 -361 -2108 1473 -1636 458 -837 224 547 651 944 2227 2284 -1546 1065 -1495 495 113 -266 -757 203 82 -2504 860 -2112 874 137 1120 -669 293 -63 -630 291 -339 1059 -140 1121 -218 5 146 -741 507 -707 1071 -265 1337 -218 -303 310 -29 867 -168 157 -710 767 -225 51 -639 -2 -16 -298 -2574 563 -1116 1656 -2167 1310 -370 -734 346 -578 397 163 -987 -3431 443 -3267 1297 620 1795 -3 -266 1756 -219 1730 -1733 931 -805 779 1061 -699 1683 1737 1333 -1678 1135 -386 -960 -481 1002 503 -1087 731 -974 1404 -1755 435 -1143 617 366 1896 426 1097 1597 -658 199 329 1291 -1930 621 -815 612 1032 -231 572 -256 1359 -1600 574 -2200 551 893 1205 489 -6 1138 -957 -963 981 844 -586 -442 -1950 -1266 -346 -2135 1520 -1789 505 -935 244 571 645 895 2073 2223 -1673 1236 -1915 663 155 -354 -954 241 96 -3066 1072 -2777 1168 193 1653 -1055 475 -103 -1013 449 -507 1549 -209 1715 -347 8 232 -1158 769 -1052 1533 -374 1860 -320 -474 509 -49 1512 -303 293 -1372 1498 -447 101 -1262 -5 -30 -539 SS 20220215T093718.6Z 8081.400910 341 1 9.18 2 70.67 148.45 104.45 343.91 0.00 1 0.00 1 0 25 1.321e-01 8.627e-03 1.190e-01 6.341e-03 5.036771e-01 3.278941e-03 6.584386e-03 -6.000000e+00 7.756188e-02 223.50 -2.00 3.88 -2.00 319.31 0.00e+00 1.516356e-03 7.896033e-04 2.605237e-04 -6.000000e+00 3.163433e-03 265.92 -2.00 20.00 -2.00 319.04 0.00e+00 2.988 0.001 302.00 328.00 3 4.3885e+00 8.8995e-03 4.1001e-02 -6.0000e+00 1.9218e-01 1.1058e-01 1.0288e-02 2.8248e-02 -6.0000e+00 2.0934e-01 -5.6634e-02 8.7667e-03 1.4641e-02 -6.0000e+00 1.2345e-01 1.7233e-02 4.7538e-03 4.4695e-03 -6.0000e+00 5.1789e-02 1.7415e-04 -4.0956e-04 1.8939e-04 5.4649e-05 -6.0000e+00 3.9587e-03 -1.6644e-02 4.9202e-05 12 9 1 12 1 1 97.24 22.21 0.22 -0.01664 -0.01972 3 4 1 5 0 2248.087 25.28 19.99 22.21 13.96 28.3 1004.35 7024 94751 -85003 21596 -10510 3634 -9323 -12807 47217 -16475 -19348 -34677 43510 -6814 -856 5858 1183 2956 1501 29 4026 2300 9379 -5456 -7100 4462 -2582 5571 8705 649 2364 -3044 -4834 -1060 1161 -3339 449 3991 2664 2187 755 -1276 -6385 -1519 984 2505 -2012 -3200 1424 1385 2612 666 2129 -2116 1074 166 2575 994 12 -930 1580 1118 -1547 -218 314 2007 369 -21 1701 930 2465 -1482 678 -1383 645 -472 -611 -535 66 -609 -39 -500 -2232 -1581 -1212 -982 -49 160 -462 621 1083 753 1362 -41 1520 1096 1454 -399 -166 -147 94 -865 563 623 -2510 -336 -628 -5 230 -498 441 -657 -85 -4 309 486 1127 -63 119 -943 -768 -474 -740 811 -37 149 1255 1617 819 155 -49 261 47 67 85 -522 432 95 -107 -409 -521 -19 8 106 744 -3536 339 -207 61 -185 -291 697 -461 -582 -1304 942 -280 -40 296 69 183 101 2 284 166 653 -464 -656 389 -244 477 709 59 232 -358 -646 -145 154 -458 63 628 504 485 189 -349 -1905 -444 284 721 -609 -988 431 436 868 244 830 -911 471 76 1178 462 5 -428 723 546 -841 -126 189 1176 213 -12 1023 618 1752 -1135 513 -1031 446 -305 -368 -315 41 -417 -30 -421 -2041 -1510 -1208 -1024 -53 176 -513 671 1117 736 1266 -38 1463 1151 1671 -506 -223 -201 124 -1081 658 718 -3061 -421 -818 -7 324 -747 696 -1081 -140 -7 476 720 1640 -94 183 -1513 -1245 -760 -1161 1230 -56 215 1744 2238 1192 241 -81 446 83 122 160 -1019 856 192 -216 -816 -1013 -35 15 SS 20220215T095622.9Z 8081.414154 356 1 17.46 2 69.27 153.18 105.16 348.26 0.00 1 0.00 1 0 25 3.115e-02 4.819e-03 1.851e-02 1.448e-03 4.734568e-01 7.503551e-04 6.225900e-03 -6.000000e+00 1.829169e-02 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