File name: Pandora132s1_Berlin_20221029_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T183558.8Z 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_20221029_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: 20221029 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 20221029T070056.0Z 8337.292315 81 1 49.68 2 82.27 124.23 123.68 92.62 0.00 1 0.00 1 0 17 5.023e-01 2.729e-02 3.696e-01 1.735e-02 6.999263e-01 9.762313e-03 8.697952e-03 -6.000000e+00 2.901264e-01 222.74 -2.00 3.85 -2.00 321.62 0.00e+00 8.756817e-03 4.546298e-03 1.065637e-03 -6.000000e+00 1.344273e-02 273.50 -2.00 20.00 -2.00 321.17 0.00e+00 6.922 0.007 302.00 328.00 3 1.8825e+00 3.2877e-02 7.9225e-02 -6.0000e+00 7.1562e-01 5.6059e-01 4.2994e-02 4.2378e-02 -6.0000e+00 7.8147e-01 -6.7305e-01 4.1489e-02 2.3180e-02 -6.0000e+00 4.6125e-01 2.8392e-01 2.0186e-02 1.1525e-02 -6.0000e+00 1.9722e-01 4.3535e-05 -1.3161e-03 5.2347e-04 1.4997e-04 -6.0000e+00 1.4100e-02 3.7292e-02 0.0000e+00 12 8 8 10 0 0 26.54 20.45 0.48 0.03729 0.02740 38 8 4 8 0 1307.130 15.05 20.45 22.53 24.75 25.17 27.1 1018.83 -10643 -90210 -37984 900000 -206214 900000 -169726 -158433 900000 -132284 -105972 -86583 -43133 -95896 -28875 -81240 900000 -22966 205693 35925 -64287 900000 -27859 67460 -16756 900000 -58533 -5041 97011 180642 53876 -2880 58867 1276 149281 -13343 64609 26047 2063 11732 -1670 63543 -24318 54920 -3259 90576 26236 46451 37841 26511 50520 -6148 45750 -1091 31112 15220 14676 13639 8153 27862 2702 28469 4734 31759 2147 7769 15887 -8657 4313 6528 7794 -2608 18098 -4910 10548 688 6298 1279 -1783 982 -1248 5938 -9034 2455 -5603 3084 3879 1935 1334 -5777 5292 -8825 216 -10318 -5572 -3424 -484 683 -2844 1857 -3245 880 -2875 -29 -2209 -882 -263 -2315 -526 -1370 -603 -1639 140 278 -1277 1152 1694 2486 -1878 1784 -390 3242 144 2971 3838 -1733 1582 1209 1919 -660 2130 -275 -55 -512 -297 -406 994 965 -1048 531 -2159 -1034 900000 -180 -1663 -642 900000 -9504 900000 -5475 -4868 900000 -3251 -2116 -1729 -729 -3536 -665 -3619 900000 -670 3476 668 -2864 900000 -942 1140 -538 900000 -2769 -136 1639 3053 1184 -131 1592 60 2523 -699 1747 1232 146 852 -150 3114 -2959 3063 -330 3673 2084 3140 2941 2509 4183 -987 4716 -190 4048 2366 2282 2074 1268 3578 479 4426 1064 5957 498 1825 3463 -2354 1173 1945 2431 -906 5352 -1523 2763 181 1543 359 -609 353 -531 2627 -4982 1278 -3366 1796 2330 1195 809 -3559 2723 -4962 111 -6499 -3886 -2740 -436 682 -3076 1846 -3075 718 -2341 -24 -2009 -836 -265 -2593 -652 -1928 -917 -2594 214 406 -1806 1571 2381 3669 -3043 2809 -608 4661 206 4017 4964 -2285 2041 1735 3134 -1239 4194 -586 -124 -1238 -760 -1072 2627 2558 -2765 1302 -5060 -2274 900000 SS 20221029T070911.5Z 8337.298049 85 1 49.54 2 81.24 125.98 122.50 94.15 0.00 1 0.00 1 0 17 4.839e-01 2.514e-02 3.316e-01 1.572e-02 6.356162e-01 8.664912e-03 8.535144e-03 -6.000000e+00 2.748400e-01 222.74 -2.00 3.85 -2.00 321.34 0.00e+00 1.504271e-03 3.784885e-03 6.039978e-03 -6.000000e+00 1.285272e-02 273.50 -2.00 20.00 -2.00 320.88 0.00e+00 6.207 0.005 302.00 328.00 3 2.5911e+00 2.8118e-02 7.6165e-02 -6.0000e+00 6.7792e-01 4.1365e-01 3.6695e-02 5.2661e-02 -6.0000e+00 7.3885e-01 -5.3767e-01 3.4985e-02 2.7924e-02 -6.0000e+00 4.4027e-01 2.3322e-01 1.7188e-02 8.0274e-03 -6.0000e+00 1.9335e-01 4.7255e-05 -7.4623e-05 4.8341e-04 1.4559e-04 -6.0000e+00 1.3604e-02 3.6601e-02 0.0000e+00 12 8 8 10 0 0 19.59 20.45 0.55 0.03660 0.03604 30 6 1 8 0 1651.070 15.06 20.45 23.07 24.75 25.17 27.0 1019.75 900000 900000 -124876 -111630 -115424 -71344 -151790 -82352 -99518 900000 -5547 -176610 900000 -60555 900000 -43810 135973 19626 98368 99568 56945 74829 -50589 248529 -51063 162441 -59056 900000 -2452 26847 79316 80392 61583 -9850 21929 -33245 22886 20857 27494 40238 13843 27607 11238 7101 -8507 57190 9791 57302 2519 24108 19908 21629 20286 7050 29277 10818 9414 -190 14109 17696 7369 19725 11401 10156 -127 23 7415 7617 3126 5201 6365 -2593 3135 -4337 10323 -7998 2837 -3803 -3410 -1404 -30 -883 -6172 1771 -1973 962 -533 1102 -3053 -607 404 -3682 5309 -6389 -1493 207 -893 -2835 -2392 -1288 -2736 692 -1404 560 -3017 -1801 -4310 548 -284 -713 1155 -875 599 -2116 363 -334 2577 617 847 2111 606 2289 340 3508 2523 1375 -238 -459 -53 -134 1543 -1355 810 363 -39 -685 473 807 -923 386 -1824 -905 900000 900000 900000 -3997 -2796 -2731 -1092 -5704 -1719 -2631 900000 -85 -12781 900000 -2107 900000 -1707 2082 464 1506 1524 1046 1146 -2605 3805 -2985 2487 -3616 900000 -90 822 1700 1969 1980 -633 974 -2646 1191 1341 1978 2895 1399 2536 1239 815 -1042 4027 1124 4211 335 2805 2682 3146 3230 1236 4706 1957 1729 -37 2549 3088 1523 4046 2602 2530 -35 6 1837 2025 992 1810 2321 -1039 1134 -1557 3161 -2438 834 -1170 -1220 -580 -14 -465 -3668 1033 -1274 639 -373 764 -2150 -394 242 -2173 2867 -4232 -1082 172 -856 -3081 -2683 -1369 -2676 592 -1196 495 -2960 -1842 -4810 633 -370 -1039 1781 -1407 927 -3196 508 -465 3611 934 1345 3346 949 3384 496 4795 3353 1777 -316 -673 -87 -246 2985 -2833 1754 842 -97 -1753 1215 2074 -2353 919 -4149 -1947 900000 SS 20221029T072605.9Z 8337.309791 90 1 49.49 2 79.21 129.60 120.07 97.23 0.00 1 0.00 1 0 17 2.546e-01 8.327e-03 1.840e-01 4.993e-03 5.561033e-01 2.657514e-03 6.936871e-03 -6.000000e+00 1.443257e-01 222.73 -2.00 3.85 -2.00 320.99 0.00e+00 2.696189e-03 1.084232e-03 5.483263e-04 -6.000000e+00 6.232938e-03 273.50 -2.00 20.00 -2.00 320.51 0.00e+00 5.143 0.003 302.00 328.00 3 2.0502e+00 8.2938e-03 5.9561e-02 -6.0000e+00 3.5563e-01 1.1136e-01 1.0747e-02 3.2687e-02 -6.0000e+00 3.8739e-01 -8.7573e-02 1.0849e-02 1.7346e-02 -6.0000e+00 2.3026e-01 2.8946e-02 5.4217e-03 6.4707e-03 -6.0000e+00 9.9172e-02 2.4491e-04 -7.3884e-04 1.5263e-04 7.3071e-05 -6.0000e+00 6.9851e-03 3.7235e-02 0.0000e+00 11 8 0 10 0 0 82.10 20.49 0.35 0.03723 0.03168 94 20 1 8 0 526.410 15.18 20.49 23.27 24.86 25.28 26.9 1020.97 66939 -75718 -17571 -101833 -52383 -81305 -110082 -60523 -122750 10409 -109206 -22369 -40664 33467 16795 -47231 21395 -38160 20361 -30872 3658 -21615 -20760 -12162 184 4542 -18530 17891 -45776 -4507 -18262 -1055 -11471 5641 925 -11225 14743 -4281 6335 -4668 1201 -210 2479 7439 5034 4673 292 12893 -1284 7317 2890 2662 -102 4253 4999 2188 1974 -2758 5596 -1585 2270 2876 1975 3118 40 3594 -2030 1380 814 1764 1118 -277 -65 74 1954 -3074 1053 -2748 1956 -1902 -844 -1379 -2451 -954 -1951 1515 -947 953 257 995 215 356 -771 248 429 -1000 715 -618 414 -327 -507 -437 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