File name: Pandora257s1_AustinTX_20241104_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20241105T125902.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Paul Walter Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 257 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora257_OF_v3d20221216.txt Instrument calibration file used: Pandora257s1_CF_v2d20230110.txt Level 1 file used: Pandora257s1_AustinTX_20241104_L1_smca1c2d20230110p1-8.txt Full location name: St. Edward's University Short location name: AustinTX Country of location: United States Location latitude [deg]: 30.2285 Location longitude [deg]: -97.7544 Location altitude [m]: 205 Local noon date: 20241104 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are latency correction, matrix method stray light correction (replaced by simple method) Data caveats: OOB session based on clearance session 1 First and last pixel inside fitting window: 228 370 Nominal wavelengths inside fitting window [nm]: 305.0779 305.2183 305.3587 305.4991 305.6395 305.7799 305.9203 306.0607 306.2010 306.3413 306.4817 306.6220 306.7623 306.9026 307.0429 307.1832 307.3234 307.4637 307.6039 307.7442 307.8844 308.0246 308.1648 308.3050 308.4452 308.5854 308.7255 308.8657 309.0058 309.1459 309.2860 309.4261 309.5662 309.7063 309.8464 309.9865 310.1265 310.2665 310.4066 310.5466 310.6866 310.8266 310.9666 311.1065 311.2465 311.3865 311.5264 311.6663 311.8062 311.9461 312.0860 312.2259 312.3658 312.5057 312.6455 312.7854 312.9252 313.0650 313.2048 313.3446 313.4844 313.6242 313.7639 313.9037 314.0434 314.1832 314.3229 314.4626 314.6023 314.7420 314.8816 315.0213 315.1610 315.3006 315.4402 315.5799 315.7195 315.8591 315.9986 316.1382 316.2778 316.4173 316.5569 316.6964 316.8359 316.9754 317.1149 317.2544 317.3939 317.5334 317.6728 317.8123 317.9517 318.0911 318.2305 318.3699 318.5093 318.6487 318.7880 318.9274 319.0667 319.2061 319.3454 319.4847 319.6240 319.7633 319.9025 320.0418 320.1810 320.3203 320.4595 320.5987 320.7379 320.8771 321.0163 321.1555 321.2946 321.4338 321.5729 321.7121 321.8512 321.9903 322.1294 322.2685 322.4075 322.5466 322.6856 322.8247 322.9637 323.1027 323.2417 323.3807 323.5197 323.6587 323.7976 323.9366 324.0755 324.2144 324.3533 324.4922 324.6311 324.7700 324.9089 --------------------------------------------------------------------------------------- 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: Temperature at electronics board [°C], 999=no temperature signal Column 95: Spectrometer control temperature [°C], 999=no temperature signal Column 96: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 97: Temperature in head sensor [°C], 999=no temperature signal Column 98: Humidity in head sensor [%], -9=no humidity signal Column 99: Pressure in head sensor [hPa], -9=no pressure signal Columns 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: 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 20241104T151107.0Z 9074.632720 115 1 54.50 2 63.68 129.54 97.82 118.15 0.00 1 0.00 1 0 17 2.144e-01 3.525e-02 5.108e-02 7.964e-03 2.204375e-01 4.272873e-03 2.428515e-03 -6.000000e+00 1.353558e-01 225.52 -2.00 3.25 -2.00 318.17 0.00e+00 -1.727973e-04 8.385215e-04 1.180204e-04 -6.000000e+00 6.309640e-03 288.11 -2.00 20.00 -2.00 317.30 0.00e+00 2.242 0.000 302.00 328.00 3 7.1785e+00 1.1527e-02 2.4142e-02 -6.0000e+00 3.3326e-01 -7.6627e-02 1.3165e-02 1.0612e-02 -6.0000e+00 3.6058e-01 7.3808e-02 8.2110e-03 5.1439e-03 -6.0000e+00 2.1606e-01 -2.6655e-02 4.0507e-03 1.4619e-03 -6.0000e+00 9.0292e-02 3.6588e-05 2.4404e-03 2.9315e-04 2.1572e-05 -6.0000e+00 7.7389e-03 1.9328e-02 2.2890e-04 12 8 8 10 0 0 99.99 28.00 1.68 0.01933 0.03767 47 5 2 5 0 1159.460 36.00 19.99 28.00 28.17 0.0 950.53 -14991 -5348 21978 130229 -47891 -26524 -33258 4029 14357 -18360 47124 -1804 15744 56482 81735 -12013 15162 -20201 46131 34229 72153 -1226 40949 20673 7621 -17561 -5991 11883 -12605 12088 9192 6348 -12603 12926 -11133 110935 -19295 2542 -4344 -2500 8688 -205 9046 -8128 -2923 -8014 -7013 13398 902 3856 -983 16982 -4222 15292 -8351 -3404 -1084 11186 2329 1727 -4598 648 12176 -3421 9142 -5560 10576 3458 -4865 758 -883 3079 -3144 -237 -22 2326 5188 -10457 -226 -1586 -3743 -2868 -5663 -1889 3231 -1547 -725 1780 2666 2434 -6697 -1959 2114 -409 -1294 7310 272 104 -903 -2760 1568 -3971 5338 1897 2442 -1441 -537 1628 -390 2555 -223 1294 -1068 3200 384 -1479 157 -1022 -289 -2821 -331 -1818 1306 3809 -3116 -1194 929 -531 2737 -769 -1930 -1274 3273 977 -2005 234 -1778 1773 2254 2516 -2122 -1611 -279 -1249 -427 1334 2575 -5376 -2397 -3405 310 1074 -1996 2762 -183 1478 3948 4905 -1985 2012 -3979 5338 4599 6781 -245 5534 3580 1568 -4733 -1419 2270 -2976 2225 1806 1356 -3397 2731 -2983 9047 -6369 778 -1653 -1056 3570 -97 4012 -4330 -1480 -4238 -3611 5525 418 1764 -492 7518 -2436 7589 -5422 -2152 -678 6194 1407 1064 -3135 445 7896 -2678 6234 -4184 6464 2261 -3650 585 -745 2595 -2823 -200 -18 1644 3304 -7561 -153 -1190 -3168 -2629 -5726 -1957 3393 -1813 -884 2175 3220 2842 -8020 -2067 2004 -389 -1293 7267 318 132 -1204 -3717 1933 -4898 5829 2194 2970 -1928 -749 2333 -600 4005 -339 1941 -1587 4714 543 -2025 210 -1431 -426 -4490 -528 -2940 2002 5484 -4583 -1646 1213 -706 3669 -1125 -2988 -2026 5110 1621 -3592 429 -3125 3072 4297 4709 -4052 -2981 -503 SS 20241104T160418.4Z 9074.669658 152 1 7.26 2 55.59 141.06 88.39 124.45 0.00 1 0.00 1 0 17 4.261e-02 1.740e-02 2.309e-02 1.002e-02 1.912093e-01 5.418376e-03 2.199058e-03 -6.000000e+00 2.686781e-02 225.52 -2.00 3.25 -2.00 316.63 0.00e+00 9.921941e-04 7.126518e-04 2.794940e-04 -6.000000e+00 1.253444e-03 288.11 -2.00 20.00 -2.00 315.84 0.00e+00 1.764 0.000 302.00 328.00 3 6.4106e+00 1.4096e-02 1.9439e-02 -6.0000e+00 6.6152e-02 9.2218e-03 1.5810e-02 9.4733e-03 -6.0000e+00 7.1600e-02 3.7511e-02 9.1274e-03 4.4812e-03 -6.0000e+00 4.2898e-02 -2.1795e-02 4.1888e-03 1.6655e-03 -6.0000e+00 1.7909e-02 1.2740e-04 6.3082e-04 3.5852e-04 2.4667e-05 -6.0000e+00 1.5378e-03 2.0516e-02 1.1099e-05 12 9 9 12 1 1 999.00 28.04 0.45 0.02052 0.02526 2 2 1 5 0 2418.150 36.00 20.00 28.04 30.15 0.0 964.66 379 -12092 5016 9842 -19753 -6731 -2404 -13667 5615 1500 -6907 -5478 2779 11434 13009 3462 -1355 10015 4032 9014 7967 -2841 6853 4084 -4236 -4425 -1101 24 -3526 -6929 -1110 1906 -8596 -7298 -4316 14281 -4445 -2430 627 -2139 2705 4544 4618 -895 -727 -4129 -3179 4326 2336 -1107 -602 5974 -96 4627 -2284 -889 -3050 1134 1294 1501 -1507 1511 1189 295 -3551 -911 2615 -1165 -557 995 260 1958 -66 955 -1164 2287 125 -3591 -177 -501 -1700 -2376 -3120 -433 1330 -701 -527 595 1234 539 -675 14 1129 -110 803 1979 1695 260 -84 -585 1609 -2566 1377 1079 -1005 -823 -2896 818 -90 1642 1090 -357 -567 961 -275 -804 -821 -714 -51 -883 -149 -864 -577 1114 -96 1791 1448 1209 329 675 -1220 -1052 739 1065 -558 -592 -354 663 1724 -31 -342 -2261 498 61 -2327 809 1442 -3686 -1085 -387 -2657 960 277 -1424 -1172 597 2502 3076 964 -414 2828 1245 2712 2460 -988 2209 1401 -1631 -1725 -408 9 -1237 -2491 -387 676 -3511 -2959 -1682 4730 -1937 -1187 311 -1227 1600 2769 2883 -596 -483 -2809 -2098 2586 1402 -693 -388 3788 -68 3238 -1758 -687 -2427 864 982 1149 -1233 1268 1057 272 -3350 -793 2081 -951 -474 903 254 1959 -67 933 -1087 1893 97 -2804 -137 -424 -1599 -2448 -3463 -455 1461 -836 -658 754 1550 657 -779 16 1195 -115 855 2245 1930 324 -110 -760 1952 -3071 1537 1233 -1239 -1071 -4039 1151 -134 2509 1596 -531 -884 1383 -373 -1036 -1047 -940 -71 -1301 -224 -1312 -854 1562 -130 2263 1770 1478 420 902 -1734 -1537 1087 1615 -900 -924 -570 1079 2791 -50 -544 -3566 818 SS 20241104T180004.3Z 9074.750050 232 1 4.45 2 46.05 175.13 70.80 142.14 0.00 1 0.00 1 0 17 7.780e-03 6.451e-03 2.496e-03 1.824e-03 1.650833e-01 1.014645e-03 1.865299e-03 -6.000000e+00 4.905745e-03 225.52 -2.00 3.25 -2.00 314.63 0.00e+00 3.684930e-04 8.723661e-05 1.734042e-05 -6.000000e+00 2.288797e-04 288.10 -2.00 20.00 -2.00 314.00 0.00e+00 1.439 0.000 302.00 328.00 3 3.8509e+00 2.5735e-03 1.5992e-02 -6.0000e+00 1.2078e-02 7.7186e-03 2.8538e-03 7.7924e-03 -6.0000e+00 1.3074e-02 9.6769e-03 1.6348e-03 3.8149e-03 -6.0000e+00 7.8328e-03 -7.3941e-03 6.9552e-04 1.0920e-03 -6.0000e+00 3.2698e-03 2.3945e-03 3.7070e-04 6.4431e-05 1.9122e-05 -6.0000e+00 2.8081e-04 2.0828e-02 3.8587e-06 12 9 1 12 1 1 99.92 28.35 0.30 0.02083 0.02361 10 13 1 5 0 403.900 36.25 20.00 28.35 34.01 0.0 992.83 -643 -1648 -1789 -1404 -1922 4 545 193 576 -565 -860 -983 24 819 1356 -241 -354 840 564 1528 699 451 1039 1211 723 197 -168 -768 -151 1561 1633 598 562 -976 -2055 -640 -1369 -888 -229 -67 -983 -931 -933 -770 -711 -467 -741 -150 -222 -202 544 1082 743 1140 221 616 913 402 515 840 1066 1477 1325 1117 -131 -1086 -38 -88 742 848 249 339 111 275 98 -200 -220 -897 196 -118 -1121 -1544 -1991 -1869 -1164 -622 -282 -105 282 360 106 117 -221 29 780 706 99 640 372 -464 -490 -604 -736 -109 -75 -773 -661 -101 -420 208 440 459 110 240 -128 146 369 49 421 411 -58 -16 315 419 406 393 240 521 1145 696 73 -268 -143 -135 -113 289 -279 190 53 -422 -312 -258 -865 -236 -635 -681 -505 -654 2 198 70 222 -227 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