File name: Pandora75s1_EssexMD_20241218_L2Fit_fout2c1d20221230p1-8.txt File generation date: 20241219T051045.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 75 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora75_OF_v3d20220127.txt Instrument calibration file used: Pandora75s1_CF_v104d20221230.txt Level 1 file used: Pandora75s1_EssexMD_20241218_L1_smca1c1d20221230p1-8.txt Full location name: MDE Essex Monitoring Site Short location name: EssexMD Country of location: United States Location latitude [deg]: 39.3109 Location longitude [deg]: -76.4745 Location altitude [m]: 12 Local noon date: 20241218 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-data based on session 103 First and last pixel inside fitting window: 196 337 Nominal wavelengths inside fitting window [nm]: 305.0663 305.2078 305.3493 305.4908 305.6322 305.7737 305.9151 306.0566 306.1980 306.3394 306.4807 306.6221 306.7635 306.9048 307.0461 307.1874 307.3287 307.4700 307.6112 307.7524 307.8937 308.0349 308.1761 308.3172 308.4584 308.5996 308.7407 308.8818 309.0229 309.1640 309.3051 309.4461 309.5872 309.7282 309.8692 310.0102 310.1512 310.2921 310.4331 310.5740 310.7149 310.8558 310.9967 311.1376 311.2784 311.4193 311.5601 311.7009 311.8417 311.9825 312.1233 312.2640 312.4048 312.5455 312.6862 312.8269 312.9676 313.1083 313.2489 313.3896 313.5302 313.6708 313.8114 313.9520 314.0925 314.2331 314.3736 314.5141 314.6547 314.7951 314.9356 315.0761 315.2165 315.3570 315.4974 315.6378 315.7782 315.9186 316.0590 316.1993 316.3397 316.4800 316.6203 316.7606 316.9009 317.0411 317.1814 317.3216 317.4619 317.6021 317.7423 317.8825 318.0227 318.1628 318.3030 318.4431 318.5832 318.7233 318.8634 319.0035 319.1436 319.2836 319.4237 319.5637 319.7037 319.8437 319.9837 320.1237 320.2636 320.4036 320.5435 320.6834 320.8233 320.9632 321.1031 321.2430 321.3828 321.5227 321.6625 321.8023 321.9421 322.0819 322.2217 322.3615 322.5012 322.6409 322.7807 322.9204 323.0601 323.1998 323.3395 323.4791 323.6188 323.7584 323.8980 324.0376 324.1772 324.3168 324.4564 324.5960 324.7355 324.8750 --------------------------------------------------------------------------------------- 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 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: 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 20241218T141011.3Z 9118.590408 329 1 50.55 2 74.55 139.37 78.68 288.78 0.00 1 0.00 1 0 17 1.432e-01 1.075e-02 1.341e-01 6.638e-03 4.360966e-01 3.585703e-03 5.357233e-03 -6.000000e+00 8.543641e-02 223.19 -2.00 3.48 -2.00 320.13 0.00e+00 3.003883e-03 1.173847e-03 2.086177e-03 -6.000000e+00 3.750764e-03 278.27 -2.00 20.00 -2.00 319.57 0.00e+00 3.686 0.001 302.00 328.00 3 4.1150e+00 1.0436e-02 4.3493e-02 -6.0000e+00 2.1022e-01 9.0249e-02 1.2553e-02 2.4358e-02 -6.0000e+00 2.2785e-01 -5.1030e-02 1.0740e-02 1.3204e-02 -6.0000e+00 1.3584e-01 5.5930e-03 5.5362e-03 4.4211e-03 -6.0000e+00 5.8673e-02 1.2944e-04 -1.1633e-03 2.1985e-04 7.0209e-05 -6.0000e+00 4.4284e-03 -2.7828e-02 1.4986e-04 12 9 8 11 16 0 -16.58 23.01 0.36 -0.02783 -0.03657 15 2 1 5 0 3369.480 25.90 20.00 23.01 16.05 5.6 934.82 900000 51079 -11406 -37915 -30465 25322 -54042 -101695 -20692 -34603 -6354 -51886 -7507 -31876 5043 -25399 -2782 16070 -136 -4698 -21781 -4662 -19334 4551 -3769 8191 24 -17031 -5494 -8791 -2088 7730 -753 -7952 1891 -15623 -2005 -594 2712 1479 3492 -4314 952 4612 2205 4507 -1870 -437 862 898 2344 4132 1186 1869 2884 1041 3000 -1292 2420 -2621 3346 515 6225 2646 2309 751 -644 -100 1822 365 -550 2076 -66 2019 1240 -1697 -3105 -4597 -326 -220 -761 -2606 -1387 -832 75 -978 1081 475 1514 2269 137 -341 -2136 -648 -2205 -1748 -282 -263 -556 -311 -213 -1500 -1679 -1247 -798 -1955 -336 -658 1301 1112 1651 1323 75 -186 -923 -893 34 167 280 222 547 1158 1699 137 -504 -85 -531 -1105 -98 219 -416 -206 228 328 162 180 -1 206 419 72 -746 -805 900000 386 -172 -736 -556 253 -1240 -4128 -414 -855 -123 -1709 -185 -1219 160 -1270 -123 633 -7 -254 -1435 -261 -1285 252 -239 482 2 -1272 -356 -605 -149 564 -66 -795 168 -1645 -199 -67 356 230 596 -850 186 890 441 891 -436 -101 200 216 598 1126 358 599 957 362 1042 -467 830 -943 1176 202 2538 1209 1082 345 -290 -45 868 197 -328 1257 -41 1162 664 -849 -1463 -2175 -159 -123 -485 -1889 -1074 -680 65 -911 1035 469 1477 2112 122 -282 -1707 -514 -1919 -1702 -306 -318 -711 -392 -254 -1665 -1770 -1333 -903 -2370 -423 -884 1842 1708 2691 2217 125 -295 -1378 -1280 49 248 441 364 898 1853 2625 207 -729 -118 -723 -1564 -148 360 -736 -382 437 661 345 401 -1 479 967 162 -1613 -1677 SS 20241218T141554.0Z 9118.594375 332 1 52.39 2 73.84 140.51 79.70 289.57 0.00 1 0.00 1 0 17 2.542e-01 9.429e-03 1.229e-01 5.250e-03 4.239314e-01 2.785214e-03 5.019806e-03 -6.000000e+00 1.516738e-01 223.19 -2.00 3.48 -2.00 319.87 0.00e+00 1.214404e-03 8.613257e-04 1.060573e-03 -6.000000e+00 6.635742e-03 278.27 -2.00 20.00 -2.00 319.31 0.00e+00 3.534 0.001 302.00 328.00 3 4.1090e+00 7.9503e-03 4.1372e-02 -6.0000e+00 3.7322e-01 5.9689e-02 9.5194e-03 2.2377e-02 -6.0000e+00 4.0432e-01 -1.6336e-02 8.0759e-03 1.1546e-02 -6.0000e+00 2.4115e-01 -8.7371e-03 4.2124e-03 3.4981e-03 -6.0000e+00 1.0351e-01 1.5438e-04 -1.2299e-03 1.6980e-04 4.7749e-05 -6.0000e+00 7.8152e-03 -2.7649e-02 1.6909e-04 12 9 8 11 16 0 37.80 23.02 0.57 -0.02765 -0.03689 17 3 1 5 0 3081.320 25.90 20.00 23.02 16.49 5.7 938.57 -25372 -8322 17786 -16687 -56530 -16983 273794 -33495 -42855 -3195 -26883 -8736 263 -41035 -3147 -510 9252 -8790 -723 14049 15919 -12028 2670 -5974 -11964 -8960 -3094 -4098 1137 -16483 -11739 3338 -9129 -9514 5811 -1895 -7867 -2967 5996 -1003 -2752 2531 1805 -3210 1233 2693 -3491 3234 -2625 2288 -1819 4464 2056 269 1183 1306 2107 1596 -675 2458 806 3126 658 2157 1630 1698 -2799 874 3205 -575 990 2459 716 624 -541 -1557 -2824 -1358 -4797 -708 -1910 -1229 -229 -1517 19 -622 -230 1251 1876 2486 120 -944 -13 -2041 -1988 -627 822 757 423 -252 -1106 -1010 -919 -1014 -1241 -1327 -664 -373 741 887 577 538 40 -383 -725 -370 -698 59 1002 385 215 410 809 1076 192 278 124 -283 259 -1000 -367 -236 165 219 -13 264 605 496 87 48 -916 -872 -413 -132 232 -303 -1421 -277 1402 -748 -1177 -64 -713 -207 7 -1871 -117 -21 387 -475 -38 673 770 -778 154 -400 -908 -692 -229 -297 76 -1335 -994 273 -939 -1140 586 -206 -983 -410 909 -192 -600 560 420 -802 297 645 -892 775 -676 582 -518 1298 660 94 429 489 798 607 -258 908 313 1282 304 1060 822 825 -1373 416 1602 -334 619 1583 467 390 -316 -833 -1418 -662 -2600 -419 -1301 -928 -185 -1320 17 -611 -236 1298 1931 2444 112 -831 -11 -1728 -1813 -632 922 943 559 -331 -1384 -1166 -1005 -1132 -1478 -1674 -878 -521 1100 1421 899 858 62 -629 -1120 -546 -1036 90 1615 652 367 684 1308 1664 286 398 173 -410 403 -1713 -668 -448 325 412 -26 549 1287 1073 189 100 -1854 -1698 SS 20241218T142119.6Z 9118.598143 335 1 50.77 2 73.18 141.61 80.67 290.32 0.00 1 0.00 1 0 17 1.175e-01 1.083e-02 2.778e-02 2.823e-03 4.025735e-01 1.480737e-03 4.802303e-03 -6.000000e+00 7.013037e-02 223.19 -2.00 3.48 -2.00 319.00 0.00e+00 1.206949e-03 3.565536e-04 8.960273e-04 -6.000000e+00 3.067492e-03 278.26 -2.00 20.00 -2.00 318.41 0.00e+00 3.404 0.001 302.00 328.00 3 4.1093e+00 4.0501e-03 3.9536e-02 -6.0000e+00 1.7257e-01 3.0893e-02 4.6709e-03 2.0770e-02 -6.0000e+00 1.8693e-01 -1.3281e-02 3.4769e-03 1.0531e-02 -6.0000e+00 1.1149e-01 -3.9675e-03 1.8359e-03 3.1443e-03 -6.0000e+00 4.7871e-02 1.8214e-04 -1.1199e-03 8.9551e-05 4.1522e-05 -6.0000e+00 3.6123e-03 -2.8880e-02 2.1539e-04 12 9 8 11 32 0 41.83 23.03 0.59 -0.02888 -0.03730 18 3 1 5 0 2819.970 25.90 20.00 23.03 16.96 5.7 941.68 -81322 -10869 -19664 12210 -52340 -34364 11539 -29520 -30341 -18646 -32277 -9403 25130 40470 -9027 3027 -10969 -3673 20231 13617 8512 16092 -4208 -3162 -6493 -3979 12764 7765 -2957 -2904 2304 -1993 -553 250 3225 -2448 -9352 1146 129 170 -2774 1526 852 -24 2048 3317 3535 -1525 -877 1954 -188 1416 3711 2593 -1292 663 666 1505 -200 -934 -1678 1539 1633 1143 584 662 -745 -1986 2875 3764 466 767 716 -882 9 -563 -2062 -3662 -2308 -2587 -1068 -2268 -1848 -664 -536 -421 850 1493 740 1627 -217 -906 120 -2348 -1364 -43 627 1247 708 -42 -1635 -1353 -189 -323 -1132 -1292 -392 524 467 1091 971 481 179 -193 -500 -198 124 133 65 315 440 749 1364 547 590 -1100 83 -674 -466 -67 -267 -914 78 -257 -293 62 656 669 15 223 -148 -909 -3907 -326 -687 306 -2319 -1220 270 -1154 -1336 -790 -1635 -404 878 1448 -629 215 -984 -329 1515 1139 771 1364 -450 -356 -804 -504 1388 861 -352 -350 287 -290 -88 41 509 -406 -1799 230 31 49 -831 468 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