File name: Pandora132s1_Berlin_20240414_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T214633.8Z 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_20240414_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: 20240414 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 20240414T053919.3Z 8870.235640 148 1 12.58 2 77.49 90.49 97.36 20.80 0.00 1 0.00 1 0 17 2.848e-01 1.270e-02 2.371e-01 8.780e-03 5.873033e-01 4.602971e-03 7.216199e-03 -6.000000e+00 1.632623e-01 227.62 -2.00 3.85 -2.00 320.76 0.00e+00 4.348320e-03 1.762780e-03 5.290900e-04 -6.000000e+00 7.262864e-03 272.27 -2.00 20.00 -2.00 320.26 0.00e+00 4.490 0.002 302.00 328.00 3 3.0174e+00 1.3870e-02 5.5662e-02 -6.0000e+00 4.0811e-01 1.5285e-01 1.7493e-02 3.3969e-02 -6.0000e+00 4.4583e-01 -1.6602e-01 1.7087e-02 1.7620e-02 -6.0000e+00 2.6213e-01 6.7418e-02 8.5922e-03 6.8348e-03 -6.0000e+00 1.0962e-01 1.5941e-04 -1.2494e-03 2.5394e-04 7.1135e-05 -6.0000e+00 7.9615e-03 1.3949e-01 0.0000e+00 12 9 9 12 5 1 73.61 26.83 0.31 0.13949 0.13010 11 10 2 8 0 1047.750 15.06 26.83 23.40 35.19 35.54 30.4 1005.44 29721 -120480 -106661 128868 -51539 -65588 900000 -56181 900000 -113089 -12663 -61830 50886 -74795 -92014 -43117 -32225 -31703 -5422 26904 5786 30975 2299 101545 12234 -21648 29280 -11638 -13178 7410 -14663 11504 -5766 29093 -5984 2063 16382 14516 5733 9508 -19305 1623 -4623 1088 155 606 5998 11586 20082 1907 5711 2286 3364 1836 -950 1655 4491 3284 3946 3192 3724 6885 1761 2102 2634 1091 -3107 3925 3114 441 2884 -2321 1746 -2151 -2140 -1721 -2782 2462 -1920 142 -2501 -114 -2298 814 -612 185 -620 393 -552 -1005 1407 111 -235 -1664 -1609 -244 1691 -1564 232 255 -2241 1346 -508 -1306 -777 -253 -503 -312 -470 14 434 -878 273 839 1644 753 47 -259 -843 -506 788 1158 122 844 -430 2239 482 -377 435 22 330 -388 1375 -670 -747 286 24 -712 -529 56 -117 158 900000 254 -2624 -1909 1103 -481 -765 900000 -743 900000 -2903 -138 -1395 475 -3026 -5154 -1644 -1203 -1258 -173 628 167 723 77 1477 409 -1010 797 -480 -605 329 -958 653 -399 1358 -400 143 1185 1299 651 1146 -3029 235 -726 164 24 96 924 1758 3000 347 1108 499 777 450 -248 427 1111 801 954 820 1060 2146 634 770 926 382 -1183 1568 1426 224 1469 -1213 820 -954 -856 -649 -1097 1048 -1006 84 -1709 -82 -1791 606 -492 154 -532 329 -444 -820 1045 81 -180 -1459 -1501 -257 1966 -1993 284 287 -2328 1278 -509 -1416 -884 -302 -645 -439 -683 21 698 -1407 411 1273 2397 1129 74 -406 -1370 -807 1287 1817 186 1231 -608 3025 706 -626 740 41 633 -786 2908 -1436 -1667 646 56 -1617 -1148 121 -240 321 900000 SS 20240414T054449.9Z 8870.239466 151 1 44.39 2 76.65 91.58 97.07 21.93 0.00 1 0.00 1 0 17 4.095e-01 2.848e-02 2.956e-01 1.559e-02 5.471751e-01 8.389508e-03 6.923464e-03 -6.000000e+00 2.352329e-01 227.62 -2.00 3.85 -2.00 320.91 0.00e+00 6.135116e-03 3.223569e-03 1.781686e-03 -6.000000e+00 1.116561e-02 272.27 -2.00 20.00 -2.00 320.39 0.00e+00 4.226 0.002 302.00 328.00 3 4.3609e+00 2.5788e-02 5.2304e-02 -6.0000e+00 5.8687e-01 2.2637e-01 3.2240e-02 3.1708e-02 -6.0000e+00 6.4154e-01 -2.9857e-01 2.9807e-02 1.8775e-02 -6.0000e+00 3.8075e-01 1.3764e-01 1.4894e-02 8.8588e-03 -6.0000e+00 1.6134e-01 5.4598e-05 -6.2200e-04 4.8393e-04 1.0511e-04 -6.0000e+00 1.1529e-02 1.3618e-01 0.0000e+00 12 9 8 11 12 0 99.97 26.86 -0.09 0.13618 0.13150 36 8 2 8 0 1232.940 14.98 26.86 23.35 35.19 35.54 30.6 1005.82 900000 -109413 900000 -141568 198227 -15942 18879 -19288 -60431 900000 -160632 900000 -87680 123914 -23353 900000 23817 49116 900000 77260 -10170 -4947 900000 -44109 12891 -1182 58791 99219 78567 77135 34235 177975 -3498 98988 -28504 23243 -6292 20400 8859 15180 19466 -1879 35605 6641 10198 -7568 43153 4749 16751 24181 -11355 23204 13991 16250 -13673 20262 -2544 5601 -3735 5783 9941 3854 7038 -538 15964 -455 17551 -1891 1818 1828 5330 2069 -2123 12266 2582 7135 -9184 -6731 -5144 -4676 1424 -4567 -519 -3368 152 -3284 1829 -2298 -2156 2317 -2772 -3478 490 312 -5846 2888 -3417 -1542 -819 -358 657 -2096 2863 -3140 3665 -1467 2188 -1468 -1055 -296 1898 474 -2782 818 -488 2835 182 3961 -2698 1982 -2265 1006 861 795 3012 -242 4926 -2407 151 556 -1202 1112 -218 1312 -585 2239 -2089 147 -1296 186 -638 -353 900000 900000 -4076 900000 -6055 3009 -242 287 -293 -1418 900000 -11969 900000 -4960 1881 -967 900000 723 1220 900000 1492 -463 -218 900000 -3165 534 -55 1606 1807 1908 2224 1606 2701 -270 2855 -2674 1443 -625 1858 1039 1822 2364 -293 3881 981 1478 -1326 4644 773 2566 3770 -2773 4322 3031 3565 -4150 4417 -684 1352 -989 1468 2688 1244 2399 -201 4824 -158 5255 -770 808 875 2522 985 -987 4485 937 2333 -3637 -2944 -2598 -2703 865 -2900 -365 -2386 111 -2592 1397 -1805 -1758 1678 -1962 -2385 337 242 -5534 2626 -3708 -1738 -896 -359 641 -1998 2698 -3375 3884 -1727 2651 -1854 -1465 -440 2833 703 -4029 1172 -685 3927 274 6073 -4557 3159 -3631 1506 1244 1102 3906 -317 6511 -3825 258 1016 -2336 2206 -464 2922 -1380 5237 -5147 350 -2997 399 -1307 -714 900000 SS 20240414T061713.8Z 8870.261965 165 1 49.32 2 71.73 98.12 95.06 28.50 0.00 1 0.00 1 0 17 1.174e-01 7.615e-03 6.093e-02 4.085e-03 4.308100e-01 2.100269e-03 5.380716e-03 -6.000000e+00 6.691408e-02 227.62 -2.00 3.85 -2.00 319.96 0.00e+00 1.064529e-03 6.172912e-04 2.425721e-04 -6.000000e+00 2.863391e-03 272.28 -2.00 20.00 -2.00 319.42 0.00e+00 3.149 0.001 302.00 328.00 3 3.8079e+00 5.9814e-03 3.9540e-02 -6.0000e+00 1.6669e-01 7.5786e-02 7.0846e-03 2.4374e-02 -6.0000e+00 1.8183e-01 -2.0300e-02 5.9176e-03 1.2239e-02 -6.0000e+00 1.0766e-01 -1.6237e-03 3.0793e-03 3.7755e-03 -6.0000e+00 4.5140e-02 3.0762e-04 -9.5416e-05 1.2429e-04 4.1614e-05 -6.0000e+00 3.2262e-03 1.3646e-01 0.0000e+00 11 9 0 11 4 0 99.98 27.05 0.30 0.13646 0.13575 74 16 1 8 0 666.430 15.11 27.05 23.26 35.42 35.78 30.6 1005.84 -24464 -17458 -17334 -41227 -1845 -62478 -4522 -34638 83386 -33338 10064 -28544 -1766 6768 -1355 500 -17313 19138 3198 7614 -2973 8984 -3874 -10802 -1315 -16004 -3129 5 8240 2034 1575 -2458 1556 -3141 -1528 6763 -2327 2082 -3070 4927 2384 2060 -1347 -1938 -2829 2728 700 1361 2476 679 2499 -1200 2707 -103 -102 907 -1522 1587 665 1859 801 3115 955 -867 995 1398 1921 1310 46 -317 793 -1252 633 -875 308 -1326 -1132 -599 -1751 -229 -2193 -2738 -1297 -640 -850 888 53 334 502 130 1234 125 1608 -368 262 950 114 -298 -427 -243 -384 1427 -403 -1018 -1273 57 -242 867 222 -787 -122 -586 525 267 1575 791 411 266 -782 -459 609 -359 -100 424 371 1004 870 -190 -371 -569 -241 346 92 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