File name: Pandora132s1_Berlin_20230314_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T192241.4Z Data description: Level 2 spectral fitting results file Data file version: fout2c13p1-8 Local principal investigator: Thomas Ruhtz Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 132 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora132_OF_v1d20200910.txt Instrument calibration file used: Pandora132s1_CF_v13d20210422.txt Level 1 file used: Pandora132s1_Berlin_20230314_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: 20230314 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 20230314T070301.9Z 8473.293772 213 1 49.40 2 76.24 113.29 86.23 214.97 0.00 1 0.00 1 0 17 4.625e-01 1.542e-02 3.251e-01 1.150e-02 6.532833e-01 6.268072e-03 7.932009e-03 -6.000000e+00 2.662542e-01 224.99 -2.00 3.85 -2.00 321.24 0.00e+00 6.163780e-03 2.631382e-03 9.683857e-04 -6.000000e+00 1.217046e-02 268.34 -2.00 20.00 -2.00 320.82 0.00e+00 4.110 0.001 302.00 328.00 3 3.5160e+00 1.9414e-02 5.5829e-02 -6.0000e+00 6.6425e-01 1.5612e-01 2.6258e-02 3.9835e-02 -6.0000e+00 7.2796e-01 -1.9599e-01 2.8559e-02 2.0485e-02 -6.0000e+00 4.2643e-01 8.6795e-02 1.4056e-02 9.2212e-03 -6.0000e+00 1.7685e-01 1.2596e-04 -1.0748e-03 3.3888e-04 9.4396e-05 -6.0000e+00 1.2957e-02 -2.7468e-02 0.0000e+00 12 8 8 10 0 0 99.99 16.51 0.19 -0.02747 -0.03554 201 43 4 8 0 245.710 15.01 16.51 18.79 20.87 21.27 27.3 1034.74 -217642 -22902 -134487 -89837 -85503 -73380 900000 -181411 900000 -156331 900000 -119866 900000 -73084 -43204 252111 -40004 900000 -47558 900000 -41303 16738 -46182 -24697 95603 -39156 68073 -49688 12377 16769 86528 -12430 -3234 17696 -9187 84993 -24857 58621 -2507 10512 1124 -5506 3735 -2066 15306 -5282 19603 3289 15073 6994 5786 -3797 222 13276 -7290 20395 -9282 9525 3217 4350 8009 3587 4609 2266 12917 -3616 8566 609 2784 5819 -2967 5335 1143 4645 -3328 7911 -1643 -497 -3382 -1282 -143 -4251 1014 -4571 1464 -2591 901 298 -174 2118 -1622 225 -3191 845 -2730 16 -1561 1753 -756 -546 1106 -3146 1507 -488 -117 -1526 205 -1205 -494 839 -612 977 -1363 1073 -518 567 657 -89 408 -1777 1364 -414 1683 91 1905 -723 -521 1174 -153 1517 54 425 -433 239 -550 -349 346 310 571 -1046 914 -1323 -254 -5318 -256 -1780 -1006 -958 -822 900000 -3878 900000 -3024 900000 -1952 900000 -1265 -704 2823 -855 900000 -1307 900000 -1135 256 -1363 -629 1071 -1276 839 -1770 263 376 1163 -494 -135 631 -412 1618 -1417 1904 -166 717 94 -527 342 -206 1309 -570 1696 348 1488 805 748 -603 37 2095 -1484 3260 -2032 1707 596 788 1459 760 1103 621 3327 -1075 2215 177 881 2044 -1242 2123 464 1707 -1203 2295 -494 -152 -1205 -531 -69 -2402 591 -2987 958 -1875 662 225 -131 1490 -1105 141 -1988 528 -1990 13 -1509 1861 -888 -636 1174 -3113 1316 -441 -112 -1576 219 -1399 -628 1178 -958 1577 -2240 1650 -764 796 931 -133 642 -2943 2157 -639 2443 129 2562 -957 -671 1566 -233 2560 100 833 -899 524 -1292 -853 856 776 1409 -2514 2016 -2798 -519 SS 20230314T071353.6Z 8473.301315 215 1 49.37 2 74.74 115.62 87.18 217.12 0.00 1 0.00 1 0 17 2.497e-01 6.248e-03 1.189e-01 3.259e-03 5.906467e-01 1.702105e-03 7.256096e-03 -6.000000e+00 1.413391e-01 224.99 -2.00 3.85 -2.00 320.82 0.00e+00 2.513420e-03 6.505716e-04 5.158624e-04 -6.000000e+00 5.954053e-03 268.34 -2.00 20.00 -2.00 320.39 0.00e+00 3.729 0.001 302.00 328.00 3 2.6131e+00 5.0793e-03 4.9866e-02 -6.0000e+00 3.5048e-01 7.4303e-02 6.6019e-03 3.4032e-02 -6.0000e+00 3.8270e-01 -2.5196e-02 6.9451e-03 1.8057e-02 -6.0000e+00 2.2655e-01 -4.1349e-05 3.4964e-03 6.5145e-03 -6.0000e+00 9.4943e-02 4.8059e-04 -3.2601e-04 9.4493e-05 7.2647e-05 -6.0000e+00 6.8128e-03 -3.0116e-02 0.0000e+00 10 0 0 10 0 0 99.91 16.52 0.24 -0.03012 -0.03257 153 32 1 8 0 322.610 15.01 16.52 18.92 20.87 21.38 27.4 1035.77 -102171 -14521 -74161 -119274 -66475 -89889 -87326 -127096 -43723 -83020 -31049 -51827 -28794 -11446 -29063 -20078 -29002 -1831 -14033 -13250 -19553 4751 13660 3535 -3021 -10860 -8390 -19578 -3246 -20285 -11639 1083 6984 1448 -14169 1129 -2781 2112 -7305 6283 402 2075 -982 -1195 2592 -438 465 2155 1443 531 1906 4455 2744 4830 -1032 2737 -461 1965 -434 1353 725 2957 2592 2583 1945 23 63 -486 1682 1524 477 1376 -484 271 -213 -495 -1223 -1356 -1479 81 -486 -1677 -1661 -2267 -937 -1197 -66 395 673 665 891 1384 -422 621 -45 13 -306 835 402 -429 35 -915 153 -529 -624 -1338 -546 -668 130 270 174 234 63 72 -209 30 373 81 508 39 -205 -68 581 -314 645 130 -163 1199 118 -245 -199 -138 -39 50 14 -334 -54 497 -127 -282 286 -316 -41 -1007 -69 -684 -1668 -507 -857 -888 -2222 -375 -1135 -266 -626 -348 -149 -563 -421 -747 -40 -370 -366 -590 113 313 98 -97 -397 -301 -765 -107 -858 -533 52 362 83 -919 63 -179 156 -727 645 45 266 -124 -154 327 -58 63 293 206 82 321 813 557 1036 -247 657 -117 483 -106 322 181 796 793 876 687 8 21 -172 648 672 232 687 -241 126 -91 -190 -443 -501 -613 39 -272 -1072 -1152 -1674 -728 -990 -57 345 580 549 683 982 -292 440 -36 12 -322 979 508 -540 41 -961 149 -526 -666 -1518 -647 -844 178 410 288 402 107 117 -320 44 549 126 827 66 -344 -110 896 -471 920 179 -218 1657 184 -429 -377 -274 -80 111 29 -750 -123 1143 -290 -622 645 -676 -86 SS 20230314T072010.3Z 8473.305674 219 1 1.92 2 73.88 116.98 87.76 218.36 0.00 1 0.00 1 0 17 2.529e-01 1.897e-02 2.581e-01 1.542e-02 5.574019e-01 7.881290e-03 7.006205e-03 -6.000000e+00 1.441191e-01 224.99 -2.00 3.85 -2.00 319.81 0.00e+00 4.853204e-03 2.307012e-03 9.120316e-04 -6.000000e+00 6.163550e-03 268.34 -2.00 20.00 -2.00 319.38 0.00e+00 3.542 0.001 302.00 328.00 3 3.0915e+00 2.2125e-02 4.7274e-02 -6.0000e+00 3.5797e-01 1.2179e-01 2.6286e-02 3.2740e-02 -6.0000e+00 3.9132e-01 -9.7036e-02 2.3292e-02 1.6000e-02 -6.0000e+00 2.3063e-01 3.5442e-02 1.2262e-02 6.9950e-03 -6.0000e+00 9.7603e-02 3.6249e-04 -4.3927e-04 4.3176e-04 6.1505e-05 -6.0000e+00 7.0732e-03 -3.1635e-02 0.0000e+00 12 9 9 12 1 1 999.00 16.52 0.27 -0.03164 -0.03494 1 12 2 8 0 873.450 15.01 16.52 19.15 20.96 21.38 27.1 1035.51 900000 -139965 900000 -83383 22839 -31327 -14281 900000 -118946 72077 -103337 18718 -17488 18976 -11720 -46594 50421 -4595 83544 -33282 14783 -26214 52185 -1799 -15766 28760 -26961 26248 -21982 44552 -24795 6254 23861 -3284 3627 -6062 40967 2371 6937 -1680 12848 2600 -2573 10638 -2312 10175 -7472 11488 -1742 1731 9254 -3758 6377 7099 1667 -3528 5709 1898 6130 -1316 2481 7043 1239 4772 -2537 -1104 -2596 361 144 -2602 -31 2416 -508 -376 2744 -2250 4886 -2905 324 3902 -2130 177 -6079 -1186 -3487 881 -2720 -503 550 1262 2415 -23 711 1635 14 -2671 2202 1586 -188 1465 21 -1245 -2585 2361 -1719 -2360 -1543 344 -440 -1569 634 146 -651 -1653 348 735 2083 610 31 -648 -1127 1506 1389 1317 -276 101 908 456 2586 -408 1314 -521 577 -1351 54 964 -145 -200 -1619 926 785 -735 -1383 900000 -5786 900000 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