File name: Pandora132s1_Berlin_20241103_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T232931.1Z 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_20241103_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: 20241103 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 20241103T071904.2Z 9073.304909 87 1 49.71 2 81.56 129.00 99.87 118.93 0.00 1 0.00 1 0 17 5.064e-01 2.867e-02 3.943e-01 2.162e-02 6.981144e-01 1.234113e-02 8.604440e-03 -6.000000e+00 2.973902e-01 222.05 -2.00 3.85 -2.00 321.54 0.00e+00 2.981720e-03 5.649665e-03 1.239093e-03 -6.000000e+00 1.421452e-02 272.63 -2.00 20.00 -2.00 321.10 0.00e+00 6.415 0.006 302.00 328.00 3 2.9482e+00 4.0686e-02 7.4668e-02 -6.0000e+00 7.3453e-01 5.7017e-01 5.4231e-02 4.1297e-02 -6.0000e+00 8.0501e-01 -6.5856e-01 5.4076e-02 2.3204e-02 -6.0000e+00 4.6962e-01 2.6237e-01 2.6336e-02 8.7612e-03 -6.0000e+00 2.0244e-01 2.3973e-05 -1.3125e-03 6.6838e-04 1.1455e-04 -6.0000e+00 1.5061e-02 4.1121e-02 0.0000e+00 12 9 8 11 4 0 93.80 24.20 0.35 0.04112 0.03126 17 4 1 8 0 2923.460 14.21 24.20 10.50 28.51 28.94 29.3 935.45 -88848 900000 900000 900000 -190161 900000 900000 900000 -33663 78243 -77142 -59791 -45781 -136133 26647 -42297 93830 900000 103150 -24307 261909 900000 900000 -37294 -73636 900000 -77274 900000 900000 -7015 161628 -24499 75988 58647 900000 88819 170932 50866 63602 44003 29955 -24857 100037 85286 42128 24502 -1040 71808 -9300 101423 826 27489 8653 37899 38478 18443 16965 32758 41638 18296 2644 13475 3707 10332 -6255 739 11525 1973 -11457 3272 532 11606 6033 10654 -4599 1694 -3984 -16551 -6319 3061 1036 5533 -3635 -2709 -1865 3542 2475 2053 -1553 -544 3048 -2805 0 -2968 -5487 -3011 835 -2071 287 -3594 2301 -4053 4010 -2597 -5300 1491 -544 242 -1130 2058 -2148 -1175 -1142 -1625 385 1341 1923 -532 963 2929 4464 -1451 140 -92 -2014 3544 -278 2081 -734 1469 1024 -96 925 -963 84 -536 2400 -1867 -13 -1531 2022 -1979 900000 -1868 900000 900000 900000 -7662 900000 900000 900000 -708 1645 -1622 -1257 -962 -8846 560 -1455 1972 900000 2168 -836 5506 900000 900000 -1568 -4644 900000 -4873 900000 900000 -241 3398 -1405 1743 1569 900000 1867 3593 1944 2553 2439 2061 -3088 3996 3586 2737 1920 -107 3705 -1138 4904 110 3099 1273 4418 4633 2784 2594 4132 4615 2553 460 2369 815 2310 -1662 178 2511 509 -3853 1063 188 3682 1925 2973 -1336 421 -1028 -5251 -2126 1112 443 2527 -1952 -1527 -1109 2105 1542 1291 -985 -322 1625 -1506 0 -1764 -3869 -2416 744 -2121 298 -3737 2041 -3439 3027 -2203 -4943 1371 -544 262 -1395 2764 -3267 -1822 -1739 -2372 526 1788 2638 -792 1480 4439 6449 -2127 195 -125 -2683 4301 -354 2875 -1194 2611 1971 -198 1996 -2261 207 -1370 6040 -4914 -33 -3689 4379 -4235 900000 SS 20241103T080131.2Z 9073.334389 113 1 33.81 2 76.89 138.28 94.71 126.75 0.00 1 0.00 1 0 17 2.553e-01 1.043e-02 1.813e-01 6.130e-03 5.034532e-01 3.181895e-03 6.431849e-03 -6.000000e+00 1.442502e-01 222.05 -2.00 3.85 -2.00 320.36 0.00e+00 3.253036e-03 1.093095e-03 3.553180e-04 -6.000000e+00 6.227778e-03 272.63 -2.00 20.00 -2.00 319.86 0.00e+00 4.297 0.002 302.00 328.00 3 3.3113e+00 9.3444e-03 5.0752e-02 -6.0000e+00 3.5500e-01 1.0732e-01 1.1484e-02 2.8908e-02 -6.0000e+00 3.8700e-01 -8.1057e-02 1.0734e-02 1.5209e-02 -6.0000e+00 2.3003e-01 2.8341e-02 5.5259e-03 6.0692e-03 -6.0000e+00 9.9105e-02 1.5979e-04 -5.4974e-04 1.8338e-04 6.4276e-05 -6.0000e+00 7.0024e-03 4.0140e-02 0.0000e+00 12 9 9 12 5 1 91.85 24.36 0.11 0.04014 0.03601 22 7 1 8 0 1469.810 14.33 24.36 11.57 28.51 28.94 29.3 939.25 -120144 42741 -58338 173116 -79651 -5214 5724 -69780 -48579 -60523 110881 -38587 7934 -35000 20856 -24102 32437 -1316 -6584 3554 -12456 3366 -16695 11386 -15015 -9976 -116 -17387 12701 -28257 11656 -10939 17276 -9089 15100 1440 2376 3332 -8784 10272 -7387 8912 -6977 2506 1640 4501 1028 -1694 5819 -3507 10514 -3704 6502 -398 3667 565 3221 1402 -1562 5536 305 812 4082 3651 256 3691 -215 -2104 2674 -1883 2563 -2225 1500 -800 2047 -2654 -1280 -2571 -1066 989 -2377 -607 -1311 -1220 -798 387 386 270 1239 360 1900 -2184 -241 -667 -358 -1200 673 560 -807 -38 -1206 1196 -1259 -90 -526 -66 -431 -492 323 -578 768 -1006 797 -849 588 759 843 313 -267 129 -701 459 147 997 231 117 1738 120 525 -868 -251 -313 512 131 52 -92 146 579 -525 176 -942 -54 900000 -3656 307 -1046 1035 -1515 -53 58 -1555 -950 -1381 663 -969 157 -1198 536 -995 911 -51 -283 143 -589 151 -880 538 -889 -575 -6 -1020 615 -2073 671 -909 1183 -800 1001 114 216 364 -1298 1429 -1329 1433 -1357 449 301 814 195 -337 1113 -791 2274 -1011 1724 -120 1098 180 1003 436 -490 1640 102 302 1639 1569 112 1488 -89 -941 1294 -1068 1478 -1359 851 -432 971 -1198 -548 -1176 -551 584 -1651 -456 -1056 -1042 -665 338 351 248 1099 332 1594 -1779 -189 -560 -338 -1198 747 686 -1031 -46 -1344 1187 -1371 -94 -591 -78 -539 -659 471 -931 1292 -1735 1299 -1319 849 1073 1230 486 -442 216 -1164 726 226 1458 326 158 2310 176 852 -1559 -474 -614 1044 286 111 -202 325 1296 -1165 401 -2050 -112 900000 SS 20241103T080801.4Z 9073.338905 116 1 50.37 2 76.24 139.75 93.96 127.97 0.00 1 0.00 1 0 17 1.325e-01 5.545e-03 4.720e-02 2.028e-03 4.891605e-01 1.042625e-03 6.239435e-03 -6.000000e+00 7.484604e-02 222.05 -2.00 3.85 -2.00 320.42 0.00e+00 1.775738e-03 3.682562e-04 3.636274e-04 -6.000000e+00 3.231624e-03 272.63 -2.00 20.00 -2.00 319.94 0.00e+00 4.108 0.001 302.00 328.00 3 1.6329e+00 3.0651e-03 4.8761e-02 -6.0000e+00 1.8420e-01 4.2460e-02 3.8128e-03 2.7991e-02 -6.0000e+00 2.0080e-01 1.8462e-04 3.6510e-03 1.4608e-02 -6.0000e+00 1.1936e-01 -1.2702e-02 1.8768e-03 4.8785e-03 -6.0000e+00 5.1419e-02 1.0584e-03 -8.1988e-04 6.0739e-05 5.5917e-05 -6.0000e+00 3.6336e-03 4.0600e-02 0.0000e+00 11 1 0 11 4 0 95.21 24.31 0.20 0.04060 0.03444 275 58 1 8 0 179.870 14.83 24.31 11.70 28.51 28.94 29.3 939.86 -70627 -32189 -42219 -51304 -19853 -61113 -21305 -59457 -15506 -54574 -25282 -20777 -10154 -2248 -9136 2934 -10244 5230 -11806 1406 -1626 2065 -4954 -3669 -2328 -8438 1965 -9115 -57 -3351 5058 -316 -106 -1895 -2559 -605 -2586 2736 -1623 -923 -2476 359 -848 -1295 2325 -878 2117 -28 1698 229 3044 1431 1848 1176 1016 1903 -308 1097 -1205 1166 1847 2344 2079 1391 479 -513 56 -476 1911 -286 808 173 537 -36 -1106 88 -1491 -106 -793 -287 -1465 -2030 -1691 -847 -665 -535 689 306 921 232 1024 -20 -163 269 -220 305 441 704 -657 78 -523 -122 323 -268 -1347 -950 -560 -541 639 85 288 -1 193 -46 89 899 321 427 -290 -424 -268 132 328 -167 723 -328 1016 621 258 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