File name: Pandora75s1_EssexMD_20240628_L2Fit_fout2c1d20221230p1-8.txt File generation date: 20240708T143851.6Z 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 v1.8.59 Instrument operation file used: Pandora75_OF_v3d20220127.txt Instrument calibration file used: Pandora75s1_CF_v104d20221230.txt Level 1 file used: Pandora75s1_EssexMD_20240628_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: 20240628 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 20240628T112152.2Z 8945.473521 215 1 11.00 2 73.21 73.41 41.11 194.50 0.00 1 0.00 1 0 17 1.664e-01 1.402e-02 1.801e-01 1.093e-02 4.366254e-01 6.004184e-03 5.167076e-03 -6.000000e+00 1.030559e-01 232.83 -2.00 3.48 -2.00 319.66 0.00e+00 4.273349e-03 1.764836e-03 1.081623e-03 -6.000000e+00 4.542865e-03 288.93 -2.00 20.00 -2.00 318.90 0.00e+00 3.408 0.001 302.00 328.00 3 4.3133e+00 1.7196e-02 4.1348e-02 -6.0000e+00 2.5848e-01 6.7953e-02 2.0307e-02 2.3313e-02 -6.0000e+00 2.7749e-01 -6.1455e-02 1.5665e-02 1.2411e-02 -6.0000e+00 1.6532e-01 1.9475e-02 8.1608e-03 4.9248e-03 -6.0000e+00 7.0386e-02 1.3542e-04 -8.0733e-04 3.4729e-04 6.1684e-05 -6.0000e+00 5.1316e-03 -3.5029e-02 1.5509e-04 12 9 9 12 17 1 999.00 23.54 0.39 -0.03503 -0.04110 2 2 1 5 0 3664.790 26.32 19.99 23.54 27.62 4.4 1013.61 -37366 -54638 40854 -55042 -65612 -12771 -64152 31457 -95529 10089 -31784 51359 -35647 13442 -35529 12585 -6471 -9084 -13307 -4010 6800 4177 4844 6595 15 25255 -8675 5707 -16095 1887 -11882 9433 -4534 15688 -12016 -3345 7920 12703 1935 -3132 5902 -129 11747 8486 -259 2306 536 -2021 -909 7157 -20 2951 -2352 135 -4648 3726 4198 -582 348 -2994 -2490 3084 1402 5735 2699 -191 3725 -799 3470 2577 842 -1786 -889 1180 -1389 -57 -3544 -4977 -5459 -24 -1482 -3326 -3075 -2452 -327 711 -1045 -176 2985 2018 1804 833 -1688 1530 -2124 305 1328 859 -245 336 -985 -1290 -1411 -210 -1824 -667 -937 -313 119 929 2300 409 1054 -1213 -951 11 864 -842 402 -826 1378 447 -108 -726 1959 204 336 -241 67 -676 -455 -604 -61 217 663 -29 541 296 197 -223 -396 -924 -760 -1536 475 -1654 -2035 -223 -1927 396 -4722 204 -1016 767 -1482 416 -2159 550 -379 -591 -965 -278 435 276 325 457 1 1588 -777 432 -1476 149 -1191 865 -532 1589 -1576 -399 912 1611 326 -651 1252 -31 2630 2017 -68 600 143 -556 -251 1892 -6 950 -860 51 -1942 1474 1683 -245 143 -1270 -1091 1384 706 2990 1485 -104 1890 -427 1905 1599 529 -1205 -593 811 -908 -34 -1991 -2796 -3311 -16 -1121 -2604 -2601 -2191 -306 701 -1103 -190 3112 2047 1711 740 -1456 1281 -1988 314 1527 1105 -309 456 -1281 -1556 -1615 -242 -2270 -868 -1293 -418 170 1423 3704 688 1728 -1930 -1417 16 1216 -1259 630 -1368 2249 723 -170 -1106 2772 308 494 -367 101 -1113 -799 -1113 -117 433 1286 -59 1131 631 419 -460 -784 -1769 SS 20240628T112627.2Z 8945.476703 220 1 51.71 2 72.36 74.06 41.32 196.18 0.00 1 0.00 1 0 17 6.947e-02 8.243e-03 5.895e-03 7.215e-04 4.305239e-01 3.929983e-04 5.133230e-03 -6.000000e+00 4.300363e-02 232.83 -2.00 3.48 -2.00 318.69 0.00e+00 1.544366e-03 8.528391e-05 1.044691e-03 -6.000000e+00 1.896062e-03 288.93 -2.00 20.00 -2.00 317.88 0.00e+00 3.253 0.001 302.00 328.00 3 1.6775e+00 1.0795e-03 3.9923e-02 -6.0000e+00 1.0786e-01 1.8396e-02 1.2310e-03 2.3160e-02 -6.0000e+00 1.1580e-01 -3.6011e-02 8.4638e-04 1.1204e-02 -6.0000e+00 6.8992e-02 7.7136e-03 4.4148e-04 3.0494e-03 -6.0000e+00 2.9364e-02 2.2710e-03 -1.4839e-03 2.2382e-05 3.7857e-05 -6.0000e+00 2.1421e-03 -3.3985e-02 1.0802e-04 11 9 0 11 8 0 99.77 23.53 0.42 -0.03398 -0.04514 215 35 1 5 0 240.490 26.21 20.00 23.53 27.92 4.4 1015.68 -29457 -20084 -15316 -17953 -25116 -23488 -27360 -25239 -21596 -17783 -17712 -18310 -14187 -14289 -7374 -1262 -2316 -1854 1402 -487 1454 586 689 -164 -437 -786 -619 -2196 -3597 -4622 -1981 -1870 182 -1674 -3291 -4390 -4940 -2062 -445 -604 220 210 665 1352 1260 1781 965 482 73 474 927 1469 1592 2203 1308 1305 899 506 230 613 990 1775 2338 2322 1264 424 -25 -269 598 1299 1044 990 831 344 -123 -1181 -2078 -2640 -2306 -1895 -1779 -2132 -2024 -1619 -652 -295 403 827 844 622 191 -173 -846 -706 -557 -94 372 634 220 -306 -1044 -1687 -1083 -731 -900 -1082 -693 -169 541 871 940 649 375 -81 -82 117 233 466 605 461 475 657 762 635 415 -26 -79 137 148 -119 -286 -623 -404 -67 -75 83 373 457 20 -124 -504 -806 -1024 -735 -573 -683 -956 -844 -1066 -1067 -985 -846 -880 -978 -839 -1015 -583 -109 -222 -191 149 -55 168 69 84 -21 -61 -115 -92 -322 -517 -683 -312 -331 35 -316 -621 -834 -1021 -481 -122 -197 73 75 246 508 479 680 373 187 29 194 405 695 749 1103 694 716 506 286 129 341 567 1088 1455 1562 879 287 -16 -178 420 950 839 834 701 280 -93 -880 -1447 -1815 -1691 -1468 -1567 -1976 -1913 -1621 -692 -314 449 944 963 686 209 -176 -821 -685 -580 -103 435 822 289 -401 -1373 -2066 -1319 -902 -1122 -1433 -917 -236 766 1330 1459 1038 590 -122 -120 165 329 684 940 717 745 1011 1192 955 597 -37 -112 200 221 -186 -477 -1045 -702 -117 -138 155 711 885 40 -233 -950 -1467 SS 20240628T113613.7Z 8945.483492 223 1 51.61 2 70.54 75.44 41.84 199.70 0.00 1 0.00 1 0 17 4.851e-02 7.632e-03 4.699e-03 6.168e-04 3.973218e-01 3.352722e-04 4.728637e-03 -6.000000e+00 3.002831e-02 232.83 -2.00 3.48 -2.00 318.62 0.00e+00 1.395152e-03 7.099958e-05 8.708701e-04 -6.000000e+00 1.323980e-03 288.93 -2.00 20.00 -2.00 317.80 0.00e+00 2.967 0.000 302.00 328.00 3 1.5633e+00 9.2110e-04 3.6536e-02 -6.0000e+00 7.5315e-02 2.1407e-02 1.0482e-03 2.1278e-02 -6.0000e+00 8.0861e-02 -2.6433e-02 7.0721e-04 1.0292e-02 -6.0000e+00 4.8175e-02 2.1850e-03 3.6837e-04 2.8062e-03 -6.0000e+00 2.0504e-02 3.4814e-03 -1.5834e-03 1.9357e-05 3.4688e-05 -6.0000e+00 1.4958e-03 -3.3901e-02 1.0941e-04 11 8 0 10 0 0 99.99 23.54 0.43 -0.03390 -0.04580 625 102 1 5 0 82.570 26.32 20.00 23.54 28.82 4.4 1022.65 -17090 -15143 -10476 -15619 -17530 -16379 -15584 -17116 -14909 -12663 -15190 -13909 -10539 -7695 -5094 -1901 -1306 -273 1283 490 2205 21 1237 -195 -794 -225 -531 -1524 -2008 -3877 -1293 -355 233 -1879 -3798 -4085 -4405 -2454 -916 -786 -118 194 335 807 880 1155 1056 -135 224 324 688 1140 1497 1771 1079 1313 906 487 123 380 850 1780 2371 2200 1296 258 -225 -518 816 1283 1074 1001 979 357 -145 -1178 -1930 -2306 -2209 -1753 -1901 -1966 -1912 -1646 -806 -233 384 879 835 641 399 -185 -541 -688 -596 -135 443 636 242 -372 -999 -1526 -942 -610 -904 -1112 -609 -278 480 905 836 572 352 -13 -88 -67 217 390 590 462 443 604 582 510 333 -58 -59 101 73 -98 -302 -479 -367 -9 -30 41 297 386 111 -79 -416 -814 -619 -617 -435 -674 -716 -632 -620 -765 -727 -653 -835 -800 -669 -564 -430 -178 -134 -30 146 59 268 3 157 -27 -116 -34 -82 -231 -294 -585 -206 -63 45 -391 -790 -845 -987 -625 -250 -252 -42 73 132 324 357 470 430 -55 93 138 311 509 717 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