File name: Pandora132s1_Berlin_20210913_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T155330.5Z 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_20210913_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: 20210913 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 20210913T053725.4Z 7926.234321 81 1 49.32 2 81.79 94.64 147.58 33.85 0.00 1 0.00 1 0 17 4.438e-01 2.231e-02 4.231e-01 2.029e-02 6.981828e-01 1.166454e-02 9.182908e-03 -6.000000e+00 2.615584e-01 228.97 -2.00 3.85 -2.00 321.65 0.00e+00 2.455977e-02 5.780407e-03 8.184944e-04 -6.000000e+00 1.145909e-02 279.89 -2.00 20.00 -2.00 321.16 0.00e+00 6.565 0.006 302.00 328.00 3 2.3984e+00 4.0651e-02 8.0764e-02 -6.0000e+00 6.5447e-01 6.1121e-01 5.2331e-02 5.9843e-02 -6.0000e+00 7.0997e-01 -6.7495e-01 4.8302e-02 2.6406e-02 -6.0000e+00 4.1962e-01 2.7487e-01 2.3276e-02 2.7701e-02 -6.0000e+00 1.7980e-01 3.2673e-05 -1.2612e-03 5.9790e-04 3.2123e-04 -6.0000e+00 1.2476e-02 1.4541e-02 0.0000e+00 12 8 8 10 0 0 51.07 16.61 0.42 0.01454 0.00506 24 5 4 8 0 2054.670 15.01 16.61 21.93 20.87 21.38 23.6 978.41 900000 -40515 -129773 -116504 -190788 -131958 -76318 900000 -11114 -153408 -121323 -99203 900000 -111672 75061 -101548 900000 -60462 38504 29379 7485 29981 -25980 900000 -19152 27575 40232 42220 -48939 -72731 17132 30037 -14241 -17678 -13664 -22294 180684 -10089 83189 100857 46623 15035 -14691 22693 16678 34912 10181 47639 20570 37036 34000 31742 28335 6958 24642 5455 18375 7138 7882 15773 30058 6155 -254 15484 -2643 13876 11478 5922 -1183 232 11786 6576 16901 -3289 5519 -8467 -6802 3876 -3561 3282 -5514 4149 -5783 2665 -2231 -1452 -535 -54 -418 2694 338 -3935 -2878 -4451 667 -3442 -3119 -1019 -1164 1325 -1396 -30 -2583 3564 -3482 -3083 -932 -1572 -242 -2097 801 990 827 -1220 -1599 -467 -1137 1757 -595 2296 -1241 1824 1554 1260 1586 1636 1190 651 1147 -929 845 1176 1244 395 -872 413 -464 1126 -1700 -643 -135 -854 900000 900000 -801 -3498 -2512 -7542 -2608 -1508 900000 -220 -3308 -2398 -1961 900000 -4013 1484 -5109 900000 -2499 761 581 161 593 -700 900000 -492 545 795 834 -1838 -3790 508 950 -788 -1013 -702 -1234 3571 -618 2302 2591 2212 1040 -1320 1615 1319 2415 946 3201 1911 3148 3293 3450 3416 988 3263 794 2542 1072 1153 2182 3921 1062 -54 3116 -655 2842 2392 1373 -332 72 3473 2056 4555 -999 1378 -2206 -1699 1034 -1100 1138 -2427 1856 -3065 1369 -1279 -874 -334 -34 -260 1549 185 -2114 -1510 -2567 424 -2696 -2847 -1035 -1257 1362 -1345 -25 -2116 2843 -3191 -2975 -938 -1732 -295 -2938 1193 1526 1262 -1818 -2278 -647 -1638 2607 -956 3643 -1987 2707 2231 1755 2123 2107 1540 926 1863 -1734 1683 2467 2761 944 -2239 1085 -1250 3005 -4585 -1630 -318 -1906 900000 SS 20210913T054530.9Z 7926.239941 85 1 49.78 2 80.56 96.27 146.92 36.87 0.00 1 0.00 1 0 17 4.453e-01 1.754e-02 3.562e-01 1.263e-02 6.419963e-01 7.037033e-03 8.499837e-03 -6.000000e+00 2.592322e-01 228.97 -2.00 3.85 -2.00 321.40 0.00e+00 7.457781e-03 3.303996e-03 4.315626e-03 -6.000000e+00 1.119474e-02 279.89 -2.00 20.00 -2.00 320.89 0.00e+00 5.805 0.004 302.00 328.00 3 2.6158e+00 2.3893e-02 7.0538e-02 -6.0000e+00 6.4664e-01 2.7322e-01 3.1561e-02 4.3055e-02 -6.0000e+00 6.9971e-01 -3.1047e-01 3.0093e-02 2.5209e-02 -6.0000e+00 4.1540e-01 1.2764e-01 1.4468e-02 9.6563e-03 -6.0000e+00 1.7817e-01 6.4382e-05 -3.0400e-04 3.7466e-04 1.6172e-04 -6.0000e+00 1.2227e-02 1.4675e-02 0.0000e+00 12 8 8 10 0 0 27.71 16.62 0.33 0.01468 0.01239 35 7 4 8 0 1419.940 15.01 16.62 22.40 20.96 21.38 23.5 979.52 -218629 -68537 -111516 -98994 -197239 -145750 -207654 -135617 -3358 -69396 -85804 -16434 10085 -79162 98044 -31375 -66978 -17461 -40152 41408 24402 -52943 -68648 26042 -42047 -25029 -65327 54074 -24784 -7798 -39332 17113 68969 3266 7489 -34979 10433 4616 32040 28383 11078 -9745 16753 -5640 6278 11492 26806 9579 7800 36902 12422 1087 13301 -639 9496 12446 6409 8406 -2543 9477 11422 18966 2300 12452 1033 12359 5424 1905 7193 4951 6094 3085 1593 -2738 2654 174 28 369 -3400 4039 -2391 -911 -5585 -1126 930 -422 1883 579 -897 591 262 -3369 -3616 -3339 -751 -575 -1250 326 -1869 -76 -1073 -1557 -3010 -246 -3462 -1251 -1453 -2977 1219 -563 418 -402 932 -107 489 227 -467 38 845 1240 1 255 2997 1689 587 455 265 445 1356 857 356 390 102 -37 -443 -775 -40 550 -503 239 -495 -998 900000 -6855 -844 -1374 -1219 -4859 -2122 -6046 -2126 -41 -855 -1057 -202 124 -1684 1208 -657 -2025 -387 -1187 561 391 -1826 -2875 449 -1502 -771 -2977 733 -763 -231 -1938 569 1529 141 295 -2154 463 262 1658 1748 887 -1020 1403 -604 611 1090 2245 991 865 3318 1591 157 2032 -109 1521 2192 1098 1522 -456 1669 2110 3668 544 2914 275 2851 1336 516 2102 1674 2184 1157 585 -975 808 49 8 107 -1195 1565 -1143 -480 -3321 -680 587 -287 1307 413 -638 393 163 -2041 -2166 -2147 -539 -480 -1210 349 -2151 -83 -1086 -1425 -2676 -223 -3470 -1294 -1600 -3598 1573 -825 658 -657 1477 -162 704 321 -684 59 1367 2036 1 396 4382 2418 817 609 354 647 2215 1570 705 813 226 -87 -1116 -2029 -107 1459 -1324 594 -1162 -2234 900000 SS 20210913T055550.2Z 7926.247109 90 1 49.36 2 79.01 98.35 146.01 40.60 0.00 1 0.00 1 0 25 3.150e-01 7.485e-03 1.854e-01 4.723e-03 5.868471e-01 2.602395e-03 7.355850e-03 -6.000000e+00 1.833808e-01 228.97 -2.00 3.85 -2.00 321.15 0.00e+00 2.710938e-03 1.155409e-03 1.226255e-03 -6.000000e+00 7.919007e-03 279.89 -2.00 20.00 -2.00 320.62 0.00e+00 5.054 0.003 302.00 328.00 3 1.9442e+00 8.5474e-03 6.0751e-02 -6.0000e+00 4.5743e-01 7.2543e-02 1.1334e-02 3.5472e-02 -6.0000e+00 4.9497e-01 -6.7141e-02 1.1229e-02 1.9219e-02 -6.0000e+00 2.9385e-01 2.3509e-02 5.4594e-03 6.6828e-03 -6.0000e+00 1.2604e-01 2.8269e-04 -3.4677e-04 1.4217e-04 8.3682e-05 -6.0000e+00 8.6491e-03 1.4394e-02 0.0000e+00 11 8 0 10 0 0 41.67 16.63 0.26 0.01439 0.01179 114 24 4 8 0 432.860 15.00 16.63 22.76 20.96 21.38 23.5 981.48 -120106 -38799 -139177 -96258 81654 -100756 -99192 -123864 -91827 -125244 -57123 -58512 -59912 -53396 -18432 -20774 -4791 -26275 -19264 -31168 -29652 -31492 -10727 -10784 -17971 -14121 9043 -37970 -17403 -33863 -15979 -18095 -7529 -10583 -22900 2338 -3158 110 -468 7325 1157 -2227 -1065 2964 2446 4242 1809 3250 6517 91 3367 2064 5305 5310 1916 5213 1848 1272 1468 196 2647 4191 6080 4425 3756 260 1892 -793 2943 487 1053 977 1544 1075 -1064 1273 -504 -4422 -1093 -78 -692 -2082 -2100 -1698 -741 -983 -273 655 250 169 540 875 -985 -157 -790 390 -508 549 -700 -230 315 -1180 -187 -495 -1255 -1442 127 -693 345 402 820 162 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