File name: Pandora132s1_Berlin_20250126_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20250127T001055.0Z 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 v1.8.70 Instrument operation file used: Pandora132_OF_v1d20200910.txt Instrument calibration file used: Pandora132s1_CF_v13d20210422.txt Level 1 file used: Pandora132s1_Berlin_20250126_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: 20250126 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 20250126T091040.9Z 9157.382418 134 1 50.28 2 76.36 148.72 82.35 188.60 0.00 1 0.00 1 0 17 4.344e-01 1.556e-02 2.364e-01 8.045e-03 6.544520e-01 4.383990e-03 8.167216e-03 -6.000000e+00 2.475430e-01 222.25 -2.00 3.85 -2.00 321.09 0.00e+00 2.646462e-03 1.720241e-03 1.396016e-03 -6.000000e+00 1.110155e-02 265.94 -2.00 20.00 -2.00 320.71 0.00e+00 4.142 0.002 302.00 328.00 3 3.8294e+00 1.3309e-02 5.5155e-02 -6.0000e+00 6.1350e-01 2.0374e-01 1.7660e-02 3.7930e-02 -6.0000e+00 6.7054e-01 -2.3648e-01 1.8927e-02 2.1828e-02 -6.0000e+00 3.9477e-01 1.0195e-01 9.5138e-03 8.0364e-03 -6.0000e+00 1.6937e-01 8.9739e-05 -5.0772e-04 2.3817e-04 9.9639e-05 -6.0000e+00 1.2169e-02 3.0347e-02 0.0000e+00 12 9 8 11 4 0 97.08 23.75 0.37 0.03035 0.02653 25 5 1 8 0 2010.750 14.80 23.75 14.48 27.78 28.21 30.5 969.45 -78902 -155754 900000 180442 -152910 -73795 -175680 900000 -186226 900000 -149829 -163140 -87044 -2130 58513 -15521 67319 -10058 900000 -40893 43531 -36179 2504 30419 -53403 63410 -10105 78491 -1299 -8571 -12868 17157 -14723 -2142 3417 -10957 28377 1388 17419 -3011 11550 9251 16517 10070 7562 22278 19184 38472 207 -1420 6951 6446 7788 -345 10117 3855 12678 -2683 9963 721 3181 4062 3253 9863 -2578 2572 3524 6185 -1640 2123 2515 -1598 4516 2877 3832 -1522 -1580 -4099 2986 -5759 -959 -502 -3881 -644 -1426 147 -3351 744 190 561 141 -380 -982 -2607 -259 -1391 -149 30 1155 -846 -2108 -127 -696 114 -2085 -244 -1232 -710 474 362 32 -756 1094 552 -615 -328 1713 268 908 -251 509 465 -464 1240 -47 669 1477 1589 -80 37 -535 313 657 -667 6 -1074 573 325 263 -736 -176 -388 900000 -670 -3154 900000 1414 -2597 -631 -4246 900000 -6203 900000 -3915 -5861 -2047 -27 500 -321 672 -236 900000 -1428 651 -1212 61 607 -2626 994 -324 1007 -38 -305 -578 672 -881 -113 163 -625 1254 98 1266 -309 1119 969 1659 1091 851 2207 2009 3454 29 -200 1008 1040 1348 -69 1910 801 2426 -584 1848 147 675 963 882 2725 -813 748 1017 1862 -608 853 1071 -715 1820 1086 1287 -490 -495 -1414 1117 -2780 -508 -295 -2533 -431 -1023 109 -2688 576 144 400 94 -240 -621 -1817 -202 -1273 -154 34 1369 -982 -2243 -119 -630 107 -2143 -259 -1400 -868 639 544 51 -1269 1762 848 -906 -471 2483 415 1467 -414 807 705 -685 1734 -64 866 1902 2238 -130 66 -1039 632 1396 -1527 14 -2691 1433 815 644 -1719 -381 -799 900000 SS 20250126T091723.2Z 9157.387074 138 1 49.41 2 75.84 150.27 82.51 190.02 0.00 1 0.00 1 0 17 4.356e-01 1.756e-02 2.631e-01 1.027e-02 6.423739e-01 5.493148e-03 8.073476e-03 -6.000000e+00 2.466200e-01 222.25 -2.00 3.85 -2.00 320.90 0.00e+00 5.749340e-03 2.068592e-03 8.666701e-04 -6.000000e+00 1.167897e-02 265.94 -2.00 20.00 -2.00 320.51 0.00e+00 4.000 0.001 302.00 328.00 3 4.2471e+00 1.6402e-02 5.3603e-02 -6.0000e+00 6.0884e-01 2.7633e-01 2.1001e-02 3.7017e-02 -6.0000e+00 6.6440e-01 -2.7820e-01 2.1714e-02 2.0997e-02 -6.0000e+00 3.9378e-01 1.0988e-01 1.1010e-02 9.6062e-03 -6.0000e+00 1.7266e-01 6.5646e-05 -9.4980e-04 2.9641e-04 1.0346e-04 -6.0000e+00 1.2104e-02 3.0073e-02 0.0000e+00 12 9 8 11 4 0 89.96 23.73 0.21 0.03007 0.02294 20 4 1 8 0 2470.220 14.77 23.73 14.96 27.88 28.21 30.4 970.94 900000 900000 -174722 -46978 -134495 -33655 -37214 -14908 -160942 900000 900000 -123723 -44601 -45628 -48872 -48553 325220 44460 -16716 -84583 -11829 40809 61378 73855 -24673 21151 6511 64731 -45683 23127 33186 -4290 -1884 -38998 23289 -6067 -7359 -3300 -9 19387 -4013 44301 -6559 31159 745 39978 4731 23489 19901 9602 7971 10837 19248 4811 8084 -5860 6382 -1748 9820 11093 -3013 -68 5152 9760 5955 -449 3725 9364 9005 -4780 4869 1300 999 -2267 6552 -348 -3950 -1105 -2442 -6205 315 -867 -3828 -2655 -3668 -510 40 1718 -1247 480 -2071 -3837 113 -1017 -1780 -2072 478 -487 -588 -78 1316 637 -1793 1231 -991 289 -1263 578 260 660 -300 -239 -174 -1037 1058 -232 346 822 626 421 291 -57 1523 540 227 17 15 1143 -44 -139 -608 126 525 -98 1019 -243 133 -532 -782 -529 206 -159 900000 900000 900000 -6201 -470 -2693 -337 -373 -149 -5419 900000 900000 -3828 -812 -1080 -1468 -1679 3255 728 -532 -5465 -366 743 1044 1183 -1010 558 196 1166 -2328 673 1057 -234 -111 -3336 1017 -364 -509 -264 -1 1694 -482 3467 -883 2921 96 3565 616 2629 2427 1407 1320 1923 3398 1042 1758 -1504 1452 -420 2038 2281 -762 -19 1533 3020 1929 -150 1190 3008 3294 -2253 2215 618 455 -984 2337 -121 -1377 -400 -1042 -3247 178 -551 -2679 -1940 -2877 -410 33 1410 -1028 367 -1508 -2671 75 -736 -1485 -2010 519 -544 -686 -95 1430 624 -1727 1203 -1057 320 -1502 729 367 944 -468 -381 -271 -1538 1586 -346 526 1309 1049 715 480 -90 2287 789 320 23 20 1667 -73 -259 -1217 263 1051 -211 2283 -567 313 -1268 -1824 -1163 459 -336 900000 SS 20250126T102821.3Z 9157.436358 172 1 10.68 2 71.91 167.29 85.64 204.79 0.00 1 0.00 1 0 25 2.043e-01 9.197e-03 1.614e-01 5.026e-03 5.415310e-01 2.565783e-03 6.969858e-03 -6.000000e+00 1.156304e-01 222.25 -2.00 3.85 -2.00 319.81 0.00e+00 2.382426e-03 7.410899e-04 6.011386e-04 -6.000000e+00 4.848828e-03 265.95 -2.00 20.00 -2.00 319.44 0.00e+00 3.179 0.001 302.00 328.00 3 3.4292e+00 7.1437e-03 4.3588e-02 -6.0000e+00 2.8535e-01 9.4014e-02 8.5522e-03 3.0698e-02 -6.0000e+00 3.1124e-01 -5.3010e-02 7.9297e-03 1.5845e-02 -6.0000e+00 1.8427e-01 1.3772e-02 4.2185e-03 5.4876e-03 -6.0000e+00 7.9052e-02 3.7494e-04 -6.2141e-04 1.4137e-04 5.5709e-05 -6.0000e+00 5.6019e-03 3.0710e-02 0.0000e+00 12 9 1 12 5 1 64.54 23.83 0.24 0.03071 0.02604 11 12 1 8 0 888.940 15.05 23.83 15.90 27.88 28.29 30.6 974.85 -91281 96012 -92465 79161 -82645 21234 -53025 52051 9080 -37503 15956 -64881 19505 -43396 21859 3183 24075 -14743 1097 -5902 -16013 11619 -16960 11044 -14806 8158 7924 -3753 -476 -6021 9733 -1124 2546 -3889 1709 -7111 3938 -372 1211 1916 -4365 5535 -4613 3930 -3338 2031 1941 -59 1867 2326 6038 130 2926 577 3189 633 761 -152 -688 1726 -1912 4242 22 2618 -898 977 -1559 417 943 -11 366 -798 1507 -863 -181 300 -945 -99 43 -618 -2583 -1378 -2854 73 -1593 299 207 133 1347 -126 2058 -375 19 -671 51 188 735 661 -352 12 -1003 193 606 354 -1763 -810 -927 -1275 551 56 1123 -150 212 -170 729 660 147 311 -568 -537 -498 683 -465 600 326 -6 1407 1193 190 -508 -445 222 388 45 -375 -359 332 94 -558 46 -415 243 900000 -2155 471 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