File name: Pandora132s1_Berlin_20230622_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T201217.0Z 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_20230622_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: 20230622 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 20230622T040348.8Z 8573.169315 91 1 49.89 2 80.84 63.17 104.10 24.27 0.00 1 0.00 1 0 17 4.117e-01 3.175e-02 3.945e-01 2.667e-02 7.332492e-01 1.533634e-02 9.360617e-03 -6.000000e+00 2.484281e-01 233.62 -2.00 3.85 -2.00 321.56 0.00e+00 -3.131597e-03 7.098727e-03 6.440555e-03 -6.000000e+00 1.107524e-02 280.56 -2.00 20.00 -2.00 321.03 0.00e+00 5.960 0.005 302.00 328.00 3 3.3257e+00 5.2958e-02 8.2422e-02 -6.0000e+00 6.2986e-01 6.9541e-01 6.6707e-02 6.7148e-02 -6.0000e+00 6.8180e-01 -9.4403e-01 5.4873e-02 2.6100e-02 -6.0000e+00 4.0186e-01 4.0603e-01 2.6433e-02 7.8668e-03 -6.0000e+00 1.6940e-01 2.3325e-05 -5.7862e-04 7.9366e-04 9.0245e-05 -6.0000e+00 1.1507e-02 7.9624e-03 0.0000e+00 12 8 8 10 0 0 52.30 16.79 0.75 0.00796 0.00361 16 3 4 8 0 3117.790 15.00 16.79 28.24 22.09 22.40 28.7 1016.76 -27398 -33134 900000 -96932 900000 -124612 -116711 -157060 900000 12928 -54246 -24937 -25356 900000 -69255 900000 900000 -22407 900000 59236 11853 -26101 -77659 -43615 181644 112792 -26974 7453 34845 11019 26428 71679 21023 125088 35506 13071 10217 37768 17514 45175 42512 -7121 130054 23562 64988 125490 -5000 25889 32796 37414 13 54733 19460 58981 -5715 29034 23320 5634 18177 25565 18943 -2492 20639 2111 3728 14583 2519 6664 10802 11916 8003 26257 3314 16736 -1298 -11036 2374 -671 -8254 -219 1036 -2143 -1955 1344 1169 1116 -545 -5290 -2663 -1026 -11473 229 -5398 -7624 -9069 2023 2021 -3651 -645 -3909 1376 2358 -3979 -1175 -6260 -2777 -4407 3881 -2332 1746 -4016 2192 1437 -157 -1821 -1405 1605 -867 3222 -1075 2348 1816 2216 1656 3141 2130 1481 3590 -1195 462 783 -477 1885 -572 612 -403 784 -1754 -570 68 -1202 -605 900000 -711 -860 900000 -3661 900000 -5295 -4959 -11124 900000 336 -1537 -648 -718 900000 -4251 900000 900000 -1058 900000 1538 392 -1232 -6417 -2780 4717 2929 -1465 290 995 429 1029 2048 1092 3248 1475 679 610 2060 1410 3167 3312 -857 4390 2264 4050 4236 -623 2420 2981 3498 2 5259 2881 6280 -1106 4524 3876 1083 2927 3718 3050 -550 4073 498 968 3295 641 1731 3058 3432 2570 7841 1087 4868 -404 -3410 616 -190 -2915 -85 418 -1007 -992 701 651 659 -341 -3509 -1685 -605 -7015 118 -2918 -4554 -6316 1471 1699 -3663 -666 -4070 1244 1893 -3231 -965 -5808 -2629 -4505 3958 -2836 2299 -6153 3291 2160 -231 -2592 -1950 2221 -1298 4883 -1728 3554 2641 3407 2477 4462 2938 2046 5285 -2111 819 1505 -982 4022 -1338 1505 -1037 2027 -4668 -1466 164 -3005 -1413 900000 SS 20230622T041736.9Z 8573.178900 96 1 50.05 2 78.94 65.75 103.25 27.35 0.00 1 0.00 1 0 17 4.355e-01 1.455e-02 3.189e-01 1.070e-02 6.312895e-01 6.042543e-03 7.980539e-03 -6.000000e+00 2.597122e-01 233.62 -2.00 3.85 -2.00 321.30 0.00e+00 4.996822e-03 2.749240e-03 3.063864e-03 -6.000000e+00 1.118305e-02 280.57 -2.00 20.00 -2.00 320.77 0.00e+00 5.028 0.003 302.00 328.00 3 3.1405e+00 2.0317e-02 6.3732e-02 -6.0000e+00 6.5470e-01 1.5784e-01 2.6964e-02 4.1012e-02 -6.0000e+00 7.0615e-01 -2.3713e-01 2.6299e-02 2.2940e-02 -6.0000e+00 4.1645e-01 1.0327e-01 1.2638e-02 8.0578e-03 -6.0000e+00 1.7784e-01 8.1130e-05 -2.6485e-04 3.2336e-04 1.2143e-04 -6.0000e+00 1.2052e-02 8.6066e-03 0.0000e+00 12 8 8 10 0 0 62.45 16.79 0.60 0.00861 0.00662 39 8 4 8 0 1283.100 15.00 16.79 28.60 22.09 22.40 28.7 1018.40 900000 -148435 -29233 -94734 -187601 900000 -207303 -41229 -157759 -56802 -99540 12983 199021 -109167 -72757 -79880 51161 -78286 -7797 20115 96989 14566 -40089 40154 -42536 -20132 -51591 20622 -43810 -9908 -21734 15640 18091 -24788 -19240 -30526 253 9315 38857 11457 -3142 9946 -2570 24931 10021 37570 13861 10068 9072 14300 32039 -11 13918 -286 11236 2931 7498 6461 -4454 1741 1704 19634 2304 10707 -2955 4154 1263 1986 6131 -570 3214 -2071 2957 163 1818 -1883 1102 -3027 -3613 -2021 -3880 236 -2718 322 -84 -1961 -282 273 1587 -1527 395 528 198 -2208 -970 -638 221 -21 -40 299 -2196 894 -4052 -1227 -2926 -754 683 -1558 1492 -416 691 -342 391 99 68 -10 449 199 470 114 40 719 601 1666 62 343 466 282 15 -299 617 -37 573 24 -596 -372 794 117 -663 -218 -720 270 900000 900000 -2252 -305 -988 -3736 900000 -5504 -430 -3142 -593 -1350 135 2076 -3189 -1821 -2500 534 -2940 -155 315 1012 243 -1213 586 -1509 -588 -2045 387 -1600 -289 -862 506 642 -1370 -963 -1751 12 496 1865 837 -292 861 -263 1976 941 2743 1316 1029 984 1596 3342 -2 2105 -53 1957 575 1424 1220 -915 338 352 3809 603 2826 -909 1153 358 592 1995 -205 1198 -831 1094 64 632 -615 336 -1013 -1406 -917 -1887 123 -1580 193 -54 -1369 -203 198 1120 -1057 250 313 127 -1550 -697 -531 210 -23 -45 327 -2257 803 -3658 -1125 -2930 -780 739 -1856 1911 -605 1079 -556 620 150 97 -15 644 302 756 188 64 1110 897 2375 86 502 676 443 24 -541 1191 -76 1227 54 -1466 -949 2039 304 -1715 -536 -1667 587 900000 SS 20230622T042419.0Z 8573.183553 99 1 49.34 2 78.01 66.99 102.80 28.83 0.00 1 0.00 1 0 17 3.357e-01 8.618e-03 2.471e-01 6.950e-03 5.982143e-01 3.893929e-03 7.441073e-03 -6.000000e+00 1.989350e-01 233.62 -2.00 3.85 -2.00 321.17 0.00e+00 4.973535e-03 1.716195e-03 9.493727e-04 -6.000000e+00 8.466959e-03 280.57 -2.00 20.00 -2.00 320.63 0.00e+00 4.666 0.002 302.00 328.00 3 2.8975e+00 1.2851e-02 5.8700e-02 -6.0000e+00 5.0183e-01 9.6206e-02 1.6950e-02 3.6611e-02 -6.0000e+00 5.4091e-01 -1.1426e-01 1.6601e-02 2.0226e-02 -6.0000e+00 3.1998e-01 4.0077e-02 8.0488e-03 8.8208e-03 -6.0000e+00 1.3611e-01 1.5013e-04 -3.2615e-04 2.1093e-04 9.9206e-05 -6.0000e+00 9.2233e-03 8.6639e-03 0.0000e+00 11 8 0 10 0 0 87.23 16.74 0.32 0.00866 0.00621 58 12 4 8 0 850.480 15.00 16.74 28.82 22.09 22.40 28.7 1019.38 -100304 -39143 -47220 -146900 -80473 -161853 -107398 -130828 -107324 -111830 -91110 -9973 -91369 -66258 -37949 -36362 -15284 -9238 30158 -13086 -8745 -4876 24988 -16716 41 -22494 8643 -36909 -23046 -7530 -25285 4534 -9362 5214 -33121 3824 -3474 1244 -10978 3020 4490 1988 2517 2404 4026 1245 7802 2607 5658 5702 826 3823 8830 1737 5321 2832 2452 3879 3296 -983 5612 2741 687 459 3757 5601 4283 905 2372 987 -646 387 -922 372 -153 -1052 -3115 -279 -1178 -2113 -1853 -2363 -2375 -1258 -312 -693 1492 1353 15 1659 -244 -361 -801 -314 -1607 43 -98 427 441 -821 -548 -1115 -344 587 -1083 -575 -194 -1322 -63 428 150 362 269 250 -196 -577 881 -475 348 87 40 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