File name: Pandora132s1_Berlin_20240615_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T222131.9Z 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_20240615_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: 20240615 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 20240615T043648.1Z 8932.192223 129 1 2.81 2 76.14 69.63 127.38 336.67 0.00 1 0.00 1 0 17 3.793e-01 3.067e-02 2.841e-01 2.055e-02 5.848066e-01 1.132987e-02 7.692987e-03 -6.000000e+00 2.285964e-01 233.53 -2.00 3.85 -2.00 320.38 0.00e+00 1.803745e-02 4.055635e-03 1.977149e-03 -6.000000e+00 1.079581e-02 280.02 -2.00 20.00 -2.00 319.80 0.00e+00 4.078 0.001 302.00 328.00 3 3.3235e+00 3.3814e-02 5.3409e-02 -6.0000e+00 5.7902e-01 2.8289e-01 4.0920e-02 3.5798e-02 -6.0000e+00 6.2857e-01 -3.3465e-01 3.4830e-02 2.4325e-02 -6.0000e+00 3.6635e-01 1.4661e-01 1.7600e-02 1.8711e-02 -6.0000e+00 1.5410e-01 1.5558e-04 -1.7276e-03 5.8619e-04 1.9694e-04 -6.0000e+00 1.0942e-02 6.5826e-02 0.0000e+00 12 9 9 12 5 1 999.00 25.93 0.04 0.06583 0.05284 1 7 1 8 0 1400.000 15.03 25.93 21.76 30.65 30.99 30.4 995.11 -172246 900000 -152879 900000 900000 70922 900000 900000 -102230 -44259 900000 -71462 900000 -19067 -79874 5815 900000 88834 69609 900000 43524 72811 -8652 -41153 -18805 79267 1402 29329 -15492 -30594 69928 -7136 218678 -2175 18502 -3569 44975 -2513 17711 14930 25862 64280 5854 18041 -2521 36079 1770 18828 24400 22836 43917 4602 25633 -2394 13634 9961 4197 -7640 1870 10339 1251 28164 806 16122 -5532 8306 -12020 -2166 -3857 1313 -2129 -5582 -1707 662 -1432 -3293 -5707 -3739 1646 -1401 -3450 -1105 -3340 7348 -6374 1291 -3300 1883 29 -1468 5184 -5986 -2626 -3175 4740 -3944 3626 278 -1101 1508 -3073 -515 -2846 2539 -3358 -1893 -1259 51 331 -530 1079 -595 2202 262 -577 355 312 458 -832 1592 887 1107 767 4999 -1139 2498 -2343 1630 91 769 -1291 1281 1089 -310 381 -828 -1300 -294 -347 657 -937 -633 900000 -11482 900000 -9172 900000 900000 1418 900000 900000 -3345 -885 900000 -2338 900000 -659 -5724 222 900000 1776 1772 900000 1424 1721 -456 -2743 -1094 1729 66 1066 -958 -2396 2670 -630 4373 -192 1379 -315 3025 -293 1948 1866 3103 6077 956 2706 -483 4870 348 3232 4148 4262 7319 1140 5938 -703 3460 2636 1162 -2327 515 2946 396 8401 328 6026 -2536 3182 -5621 -983 -2023 725 -1186 -3205 -966 337 -670 -1439 -2520 -1766 866 -828 -2371 -813 -2662 5574 -5515 1095 -3040 1657 25 -1223 4006 -4848 -2048 -2717 4313 -4238 4138 339 -1397 1769 -3634 -540 -3005 2694 -4029 -2210 -1552 67 483 -807 1715 -967 3352 383 -859 519 448 697 -1350 2543 1388 1659 1112 7091 -1647 3344 -3342 2457 148 1356 -2326 2346 2107 -611 788 -1781 -2849 -640 -734 1305 -1874 -1210 900000 SS 20240615T044803.0Z 8932.200034 131 1 49.72 2 74.52 71.71 128.03 339.99 0.00 1 0.00 1 0 17 2.732e-01 1.569e-02 3.116e-01 1.290e-02 5.312946e-01 7.047312e-03 6.677911e-03 -6.000000e+00 1.606342e-01 233.53 -2.00 3.85 -2.00 320.79 0.00e+00 2.686090e-03 2.786452e-03 1.516357e-03 -6.000000e+00 7.071887e-03 280.02 -2.00 20.00 -2.00 320.21 0.00e+00 3.678 0.001 302.00 328.00 3 4.4540e+00 2.2130e-02 4.8624e-02 -6.0000e+00 4.0507e-01 2.5613e-02 2.7905e-02 3.2178e-02 -6.0000e+00 4.3786e-01 -8.2333e-02 2.5831e-02 1.6891e-02 -6.0000e+00 2.5940e-01 4.5716e-02 1.2826e-02 5.6041e-03 -6.0000e+00 1.1064e-01 8.7839e-05 -4.4556e-04 3.9330e-04 7.2463e-05 -6.0000e+00 7.5981e-03 6.4249e-02 0.0000e+00 12 9 8 11 12 0 99.98 25.96 0.41 0.06425 0.06090 88 19 1 8 0 564.850 14.99 25.96 22.02 30.65 31.10 30.7 996.90 900000 -16872 900000 -88629 -45237 -150320 110760 -101732 -56072 43077 32381 -64767 -4132 33878 -8995 71700 -15176 23900 -69184 -33554 -24764 25726 -48010 35891 -34395 -34811 23859 -24587 40532 -25330 60241 -8883 6204 -20429 -15277 -33513 -232 44254 4173 9091 5131 25728 4965 4673 -10318 -4682 2925 21343 4655 7928 8955 10590 6909 994 369 5669 -3599 7302 -4662 2961 -4117 1341 158 -874 3761 -5165 9428 3721 3622 1904 2135 -1428 1058 4769 1900 4876 -3994 2724 -363 3397 -2150 -1356 -70 855 -1956 -2542 1859 -3234 2461 -3008 4523 -5207 -1706 54 -763 1464 -1564 -424 -91 587 -534 673 -395 523 -529 -1302 -1002 -3042 978 -645 1146 -1404 1310 -229 111 -377 292 945 1384 339 -330 1494 819 91 -408 102 2106 1121 1785 -128 -750 -566 -684 37 -143 -189 -140 903 -1140 628 -274 -397 900000 900000 -212 900000 -1317 -569 -4125 1393 -2210 -833 542 407 -1407 -61 426 -206 902 -451 519 -4034 -1420 -963 618 -2580 903 -1848 -1911 709 -1153 1020 -1390 1818 -559 362 -1518 -1048 -2951 -17 2581 434 1019 645 2765 676 647 -1687 -733 432 2684 724 1296 1608 2046 1493 241 94 1407 -984 1753 -1242 748 -1210 419 55 -327 1311 -1884 2975 1344 1499 893 1054 -733 508 2045 756 1723 -1507 1034 -165 1728 -1313 -901 -49 629 -1586 -2197 1594 -2929 2046 -2480 3201 -3811 -1200 41 -655 1408 -1756 -514 -111 679 -566 648 -385 539 -588 -1532 -1244 -4153 1413 -1034 1741 -2385 2076 -345 159 -536 429 1466 2251 563 -539 2308 1229 132 -570 136 2784 1635 2881 -230 -1422 -1115 -1419 82 -331 -451 -339 2172 -2729 1401 -583 -816 900000 SS 20240615T051409.0Z 8932.218160 146 1 46.17 2 70.70 76.54 129.19 347.91 0.00 1 0.00 1 0 17 3.803e-01 2.424e-02 2.655e-01 1.511e-02 4.369474e-01 8.083767e-03 5.885619e-03 -6.000000e+00 2.255965e-01 233.53 -2.00 3.85 -2.00 320.13 0.00e+00 1.855096e-03 2.581292e-03 2.516669e-03 -6.000000e+00 9.889134e-03 280.02 -2.00 20.00 -2.00 319.50 0.00e+00 2.990 0.001 302.00 328.00 3 5.8123e+00 2.3993e-02 4.0907e-02 -6.0000e+00 5.6958e-01 7.8589e-02 2.8555e-02 2.9468e-02 -6.0000e+00 6.1653e-01 -6.4532e-03 2.3354e-02 1.3973e-02 -6.0000e+00 3.6227e-01 -1.2600e-02 1.1976e-02 3.6242e-03 -6.0000e+00 1.5318e-01 4.6044e-05 -9.0885e-04 4.6634e-04 5.6171e-05 -6.0000e+00 1.0573e-02 6.4094e-02 0.0000e+00 12 9 8 11 4 0 99.76 26.01 0.24 0.06409 0.05726 14 3 1 8 0 3296.880 14.98 26.01 22.80 30.76 31.10 30.7 999.88 900000 -95279 139822 -102597 900000 -31283 -128543 900000 93540 96264 -62660 101329 -77268 -36355 130361 37947 5976 -6790 39039 4340 134668 8934 107963 7723 3672 69181 19866 -39666 -3439 151717 9197 72966 -9211 71601 -15409 3786 11060 10 6852 -3331 32864 -1406 3252 -1950 14916 12818 -19456 3212 -1986 25182 -5133 14621 4649 -2627 1850 -6091 15082 -4100 1695 -1537 12444 4030 920 1775 2418 5158 -3676 5545 -1733 2668 -1545 2362 1712 -8820 -9632 -10 10956 -4074 4475 -5921 -775 -3521 1803 -3470 2147 1149 -2282 -924 1781 1338 783 -231 1120 -2367 3168 3223 2067 -1872 -1282 -1061 820 -3018 -2641 -6526 634 -703 -77 -572 1981 406 102 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