File name: Pandora132s1_Berlin_20250112_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20250113T000145.4Z 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_20250112_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: 20250112 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 20250112T095202.6Z 9143.411141 366 1 44.33 2 76.21 160.14 100.06 359.91 0.00 1 0.00 1 0 17 4.095e-01 1.337e-02 3.223e-01 1.002e-02 6.398205e-01 5.361531e-03 7.964121e-03 -6.000000e+00 2.307674e-01 221.39 -2.00 3.85 -2.00 321.07 0.00e+00 6.146048e-03 2.121416e-03 1.763271e-03 -6.000000e+00 9.905174e-03 266.11 -2.00 20.00 -2.00 320.70 0.00e+00 4.102 0.001 302.00 328.00 3 3.3672e+00 1.6233e-02 5.5417e-02 -6.0000e+00 5.6813e-01 1.4645e-01 2.1606e-02 4.0583e-02 -6.0000e+00 6.2049e-01 -1.4264e-01 2.3385e-02 2.0163e-02 -6.0000e+00 3.6750e-01 6.1707e-02 1.1739e-02 8.9469e-03 -6.0000e+00 1.5801e-01 1.5009e-04 -1.2509e-03 2.9424e-04 8.8765e-05 -6.0000e+00 1.1385e-02 4.3122e-02 0.0000e+00 12 9 8 11 4 0 99.98 24.73 0.18 0.04312 0.03372 161 35 4 8 0 275.280 13.91 24.73 8.44 29.16 29.47 29.4 938.74 -210780 -42174 -194614 900000 54787 -130882 -25680 -101809 -75748 -163028 28596 -125268 -40651 22327 -508 139886 -40124 21316 -17231 113640 -41586 -46787 -57214 -28408 -31667 -37201 50824 -44484 -11815 -34554 48165 2257 238 -7614 -13439 43403 -11827 4637 -13566 25353 -5564 10626 -858 9968 -4466 1466 21171 -4489 17880 6520 8002 12669 10410 7128 1532 6983 -1220 9417 -1599 8108 1799 5398 5278 6699 2500 4816 4277 -637 4754 -1146 1894 -581 -442 -247 -283 -1089 -1058 144 -1981 2951 -450 -1636 -2793 -2063 -2064 -2036 1793 -669 1531 -1238 2156 -773 -1120 -225 422 -314 -170 -7 -2269 90 436 703 1391 -507 -1458 -1031 -175 -1109 585 -604 -130 -1143 81 93 216 1351 581 453 -484 -437 -544 901 853 794 1098 926 1818 775 259 -345 -211 -239 112 276 -406 162 147 982 -329 -192 -542 -1151 900000 -5426 -412 -4837 900000 535 -1510 -251 -1084 -740 -3618 279 -2557 -469 218 -7 1366 -962 333 -421 1110 -1340 -1599 -2082 -915 -1113 -1417 794 -1781 -358 -1518 1129 99 12 -409 -735 1398 -762 308 -1298 1881 -558 1058 -91 1061 -511 179 2191 -570 2112 857 1158 1934 1765 1329 314 1395 -265 1797 -332 1547 394 1294 1438 1956 766 1398 1253 -210 1696 -486 827 -261 -190 -98 -100 -356 -338 49 -807 1352 -245 -1002 -1849 -1435 -1528 -1592 1401 -539 1174 -920 1439 -501 -726 -157 336 -293 -181 -8 -2841 106 459 664 1260 -492 -1523 -1128 -201 -1392 806 -935 -215 -1948 132 145 317 1925 861 708 -801 -728 -879 1372 1255 1124 1489 1206 2364 1119 426 -631 -413 -490 242 631 -987 404 370 2457 -812 -447 -1184 -2406 900000 SS 20250112T100239.6Z 9143.418514 371 1 50.16 2 75.70 162.63 100.04 2.18 0.00 1 0.00 1 0 17 4.572e-01 2.660e-02 3.115e-01 1.748e-02 6.132222e-01 9.435761e-03 7.743040e-03 -6.000000e+00 2.614768e-01 221.39 -2.00 3.85 -2.00 320.71 0.00e+00 4.290730e-03 3.391730e-03 9.460013e-04 -6.000000e+00 1.279382e-02 266.11 -2.00 20.00 -2.00 320.32 0.00e+00 3.963 0.001 302.00 328.00 3 4.8965e+00 2.7914e-02 5.1780e-02 -6.0000e+00 6.4535e-01 3.4424e-01 3.4851e-02 3.4505e-02 -6.0000e+00 7.0700e-01 -2.7981e-01 3.4025e-02 1.9361e-02 -6.0000e+00 4.1627e-01 1.0794e-01 1.7476e-02 7.7883e-03 -6.0000e+00 1.8099e-01 3.5274e-05 -1.4349e-03 5.1742e-04 9.2432e-05 -6.0000e+00 1.2964e-02 4.2827e-02 0.0000e+00 12 9 8 11 12 0 99.74 25.43 0.34 0.04283 0.03205 22 5 1 8 0 2279.600 13.85 25.43 8.75 29.16 29.47 29.4 940.34 -198658 900000 900000 900000 -90071 900000 -40032 -167828 900000 9654 900000 -116589 -45953 4280 -24712 -20821 30887 900000 119160 136966 -34679 120184 -20568 900000 -15462 -7525 25587 -49304 190501 -5458 248944 -4320 9583 -5049 3312 -29318 104364 36090 2309 30086 6421 22497 -20416 11461 24711 -6317 3264 12453 27005 15528 13874 5758 9704 4719 18111 15808 8712 3364 10286 9376 -3108 4694 -2966 11675 -3991 20336 10795 -474 14983 -2611 -4746 -2381 607 -498 -3647 3475 7631 -2201 -4233 4942 -1194 -2781 -3316 -1455 -2651 -1491 5783 -2145 -4287 -1516 3709 1163 1527 -5929 -1212 -3407 -2676 179 -1793 2796 -2486 851 4241 931 -3379 -2606 -942 -1539 1234 -295 778 61 -1686 -761 -275 1813 527 364 -308 -462 2304 2979 2435 -291 3031 -1632 2952 278 405 -938 -373 310 1398 648 1070 -1075 452 261 -1491 127 -2463 242 900000 -10987 900000 900000 900000 -1672 900000 -681 -8308 900000 164 900000 -4870 -1209 86 -803 -741 717 900000 2028 2331 -1770 2045 -955 900000 -765 -349 831 -3280 3242 -270 4236 -294 623 -375 215 -2721 3197 2401 257 2886 844 2645 -3790 1560 2982 -1055 505 1811 3551 2474 2490 1229 2147 1161 4035 3693 2183 864 2387 2205 -885 1387 -1065 3901 -1556 5977 3474 -182 5586 -1297 -2548 -1252 296 -226 -1529 1231 2515 -855 -1945 2431 -715 -1872 -2391 -1087 -2128 -1247 4661 -1878 -3727 -1206 2593 783 1013 -4577 -1018 -3373 -3001 198 -2091 3244 -2746 817 3805 908 -3664 -2943 -1106 -1960 1695 -455 1167 102 -2785 -1175 -399 2524 765 557 -498 -754 3551 4360 3455 -407 3939 -2126 3680 388 638 -1650 -696 599 2815 1394 2420 -2553 1071 621 -3512 278 -5170 470 900000 SS 20250112T101811.3Z 9143.429298 377 1 3.03 2 75.06 166.30 99.89 5.49 0.00 1 0.00 1 0 25 3.284e-01 2.203e-02 2.633e-01 1.726e-02 6.046296e-01 8.961281e-03 7.748141e-03 -6.000000e+00 1.852180e-01 221.39 -2.00 3.85 -2.00 320.01 0.00e+00 3.263241e-03 2.726791e-03 1.164818e-03 -6.000000e+00 8.832227e-03 266.11 -2.00 20.00 -2.00 319.63 0.00e+00 3.805 0.001 302.00 328.00 3 3.4613e+00 2.5155e-02 5.0115e-02 -6.0000e+00 4.5761e-01 2.2464e-01 3.0254e-02 3.3508e-02 -6.0000e+00 5.0014e-01 -1.6030e-01 2.8289e-02 1.8310e-02 -6.0000e+00 2.9523e-01 5.0590e-02 1.4935e-02 6.7230e-03 -6.0000e+00 1.2775e-01 1.8170e-04 -4.4634e-04 4.8158e-04 7.6877e-05 -6.0000e+00 9.1318e-03 4.0932e-02 0.0000e+00 12 9 9 12 5 1 999.00 24.94 0.34 0.04093 0.03758 1 7 1 8 0 1507.830 14.58 24.94 9.25 29.16 29.47 29.2 941.40 -31012 -102656 900000 -151200 -133010 -143915 -137040 36316 900000 900000 -77225 900000 4118 20315 -986 -8990 -13728 -23918 131856 -12567 38239 21834 9777 -8508 99804 -27306 -27465 -10495 -47433 29558 -37722 33409 -7263 -2534 -29359 -8403 11746 16184 19126 -8528 22588 5640 1517 12692 4075 7883 14304 7168 -5427 10806 -7978 659 2890 14876 10668 4505 2147 3210 290 -4826 13914 -370 12673 1193 8593 145 2709 2311 1614 -1265 -3800 5353 -6020 -350 -9055 4035 2893 -1108 -91 -2776 -1320 -3811 -2854 -2090 -2043 -2924 -1829 443 668 1164 -3320 -114 -2246 491 -1150 -1187 -514 1877 2974 -1129 192 -568 2606 1596 -2783 -3059 -264 2482 884 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