File name: Pandora159s1_Wakkerstroom_20210626_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T031146.8Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: B. Scholes Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 159 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora159_OF_v5d20191004.txt Instrument calibration file used: Pandora159s1_CF_v3d20201207.txt Level 1 file used: Pandora159s1_Wakkerstroom_20210626_L1_smca1c3d20201207p1-8.txt Full location name: Global Change Institute, University of Witwatersrand field site in Wakkerstroom Short location name: Wakkerstroom Country of location: South Africa Location latitude [deg]: -27.3493 Location longitude [deg]: 30.1438 Location altitude [m]: 1760 Local noon date: 20210626 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: None First and last pixel inside fitting window: 222 364 Nominal wavelengths inside fitting window [nm]: 305.0731 305.2139 305.3547 305.4955 305.6363 305.7770 305.9178 306.0585 306.1992 306.3399 306.4806 306.6213 306.7620 306.9026 307.0433 307.1839 307.3246 307.4652 307.6058 307.7464 307.8869 308.0275 308.1681 308.3086 308.4492 308.5897 308.7302 308.8707 309.0112 309.1517 309.2921 309.4326 309.5730 309.7135 309.8539 309.9943 310.1347 310.2751 310.4155 310.5558 310.6962 310.8365 310.9769 311.1172 311.2575 311.3978 311.5381 311.6784 311.8186 311.9589 312.0991 312.2393 312.3795 312.5198 312.6599 312.8001 312.9403 313.0805 313.2206 313.3607 313.5009 313.6410 313.7811 313.9212 314.0612 314.2013 314.3414 314.4814 314.6214 314.7615 314.9015 315.0415 315.1814 315.3214 315.4614 315.6013 315.7413 315.8812 316.0211 316.1610 316.3009 316.4408 316.5807 316.7205 316.8604 317.0002 317.1400 317.2798 317.4196 317.5594 317.6992 317.8389 317.9787 318.1184 318.2582 318.3979 318.5376 318.6773 318.8170 318.9566 319.0963 319.2359 319.3756 319.5152 319.6548 319.7944 319.9340 320.0736 320.2131 320.3527 320.4922 320.6318 320.7713 320.9108 321.0503 321.1898 321.3292 321.4687 321.6081 321.7476 321.8870 322.0264 322.1658 322.3052 322.4446 322.5839 322.7233 322.8626 323.0019 323.1413 323.2806 323.4199 323.5591 323.6984 323.8377 323.9769 324.1162 324.2554 324.3946 324.5338 324.6730 324.8121 324.9513 --------------------------------------------------------------------------------------- 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: 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 77: 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 78: 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 79: 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 80: 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 81: 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 82: Atmospheric variability [%], 999=no atmospheric variability was determined Column 83: Wavelength effective temperature [°C], 999=no effective temperature given Column 84: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 85: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 86: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 87: Number of bright count cycles Column 88: Number of dark count cycles Column 89: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 90: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 91: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 92: Integration time [ms] Column 93: Spectrometer control temperature [°C], 999=no temperature signal Column 94: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 95: Temperature in head sensor [°C], 999=no temperature signal Column 96: Temperature at electronics board 1 [°C], 999=no temperature signal Column 97: Temperature at electronics board 2 [°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 20210626T051621.2Z 7847.219689 184 1 49.54 2 85.60 60.83 76.95 249.09 0.00 1 0.00 1 0 25 7.331e-01 4.211e-02 4.532e-01 2.778e-02 1.014550e+00 1.680252e-02 1.159916e-02 -6.000000e+00 4.203869e-01 224.93 -2.00 3.06 -2.00 322.46 0.00e+00 -2.657478e-02 8.543875e-03 1.735277e-03 -6.000000e+00 2.226393e-02 277.11 -2.00 20.00 -2.00 322.02 0.00e+00 10.820 0.008 302.00 328.00 3 -7.2945e-02 6.3199e-02 1.0211e-01 -6.0000e+00 1.0354e+00 1.6086e+00 8.0173e-02 6.6359e-02 -6.0000e+00 1.1277e+00 -2.0162e+00 6.0950e-02 2.8068e-02 -6.0000e+00 6.7528e-01 7.6815e-01 3.0661e-02 2.7636e-02 -6.0000e+00 2.9500e-01 3.2025e-05 -2.5433e-03 7.7292e-04 3.8368e-04 -6.0000e+00 2.0779e-02 2.6698e-03 12 8 8 10 0 0 41.70 18.47 0.75 0.00267 -0.01644 48 10 4 8 0 1031.700 15.02 18.47 11.33 20.96 20.87 16.8 856.87 18241 900000 17423 900000 -8850 -43714 110806 -63150 900000 -71169 900000 -72773 900000 -7030 900000 14385 106705 313435 32750 64291 39976 900000 -30874 900000 -30072 900000 65780 900000 -35544 280767 41051 71364 241379 -34618 46275 -50616 900000 468 179519 29883 209611 40093 230766 34744 24436 900000 7817 900000 3465 900000 -18168 190019 31694 192357 57836 64361 127529 33128 78903 40621 61034 -23775 182045 -15480 137210 6414 124600 -3067 39366 36313 41947 18471 17836 64345 -8347 142680 -29328 60021 -10318 36842 -10396 26705 -2258 3951 1901 6999 17137 -9769 10601 -19795 16775 -18054 20520 -6737 6086 1132 -7162 398 -5734 3165 -10191 5928 -3063 2812 -7766 7767 -11251 1522 -7812 1818 -1334 -1150 2600 -3220 6638 -1703 3381 -5097 3505 -3960 3512 2577 1778 2987 1303 3488 -1580 5959 -1833 1682 -2388 2799 949 605 -1280 3 716 56 -351 -2674 1821 -1173 467 698 900000 642 900000 -283 -1825 2993 -3838 900000 -5767 900000 -6225 900000 -380 900000 706 2882 8467 1287 1737 1276 900000 -1971 900000 -2585 900000 2100 900000 -2182 7584 1210 1928 6520 -2720 1477 -3978 900000 28 4849 1981 5662 2757 6234 2218 1560 900000 518 900000 247 900000 -1918 5133 2491 5196 4119 4583 5011 3254 4456 2993 3447 -3269 4917 -2471 5560 866 5722 -490 4640 5083 6078 3493 3285 6794 -1599 5781 -5618 4864 -1926 5157 -2783 5771 -732 1290 672 2475 5681 -4294 3723 -8944 4902 -7138 5543 -2597 2406 559 -4520 271 -4604 2363 -8158 3581 -1805 1540 -5073 4616 -8565 1110 -7098 1764 -1553 -1482 3384 -4459 8101 -2195 4177 -7172 4768 -5951 4744 3304 2192 3558 1539 3923 -1824 6819 -2679 2809 -4732 5794 2162 1502 -3508 8 2071 163 -1023 -7559 4508 -2732 1016 SS 20210626T053032.8Z 7847.229547 187 1 50.68 2 82.87 59.04 79.78 247.80 0.00 1 0.00 1 0 25 6.036e-01 8.204e-03 2.511e-01 3.314e-03 7.947806e-01 1.863060e-03 7.587233e-03 -6.000000e+00 3.435358e-01 224.93 -2.00 3.06 -2.00 321.90 0.00e+00 6.183268e-03 1.017491e-03 4.397213e-03 -6.000000e+00 1.545649e-02 277.11 -2.00 20.00 -2.00 321.43 0.00e+00 7.438 0.002 302.00 328.00 3 -5.7103e-02 6.8340e-03 7.6760e-02 -6.0000e+00 8.5207e-01 1.6582e-01 1.0782e-02 5.6573e-02 -6.0000e+00 9.3064e-01 -1.3543e-01 1.2514e-02 2.3005e-02 -6.0000e+00 5.4825e-01 4.0621e-02 5.7330e-03 9.5878e-03 -6.0000e+00 2.3124e-01 5.9595e-04 -1.3721e-03 9.3915e-05 8.8388e-05 -6.0000e+00 1.6508e-02 2.5637e-03 11 8 0 10 0 0 32.21 18.49 0.30 0.00256 -0.00775 249 54 2 8 0 197.920 15.00 18.49 13.30 20.96 20.96 16.8 866.83 -242196 -249691 -129847 -282624 900000 -227057 900000 -247919 900000 -226917 37718 -145355 -23341 -111586 -101281 -17373 -105700 -49040 -67651 900000 -64202 -5488 -84320 26227 -46305 18443 -62336 -80661 9289 -66525 -1589 -19871 22145 -30478 19223 -38380 9874 -10886 1743 -6524 3317 -3936 4506 9737 -14197 7854 -4973 10402 -6801 10919 4891 11397 3157 6220 4412 2589 4343 1061 7147 -1095 5886 191 5759 2907 5176 2974 3658 3006 2416 2568 402 1459 -1884 2143 -2450 716 -1445 2524 -13 612 276 -1087 -1870 -1119 48 -1298 -100 -1335 381 -1606 1030 157 935 51 158 403 -173 625 -632 110 -356 349 313 764 -2602 -979 2830 -1311 -396 -1026 -496 -1066 199 48 952 1045 1369 319 -23 -807 -535 -74 18 -165 208 400 881 1664 51 342 -123 317 219 372 -272 -538 190 -281 -422 -214 339 14 322 -1138 -1539 -419 -2655 900000 -1133 900000 -1892 900000 -1732 122 -704 -75 -721 -785 -73 -1148 -380 -636 900000 -705 -34 -1089 136 -538 119 -842 -1302 69 -1094 -19 -327 315 -725 298 -958 185 -275 48 -236 124 -172 193 412 -784 362 -273 522 -437 648 350 873 293 615 475 298 506 127 781 -128 665 26 852 510 957 562 691 602 547 675 119 446 -585 597 -646 164 -320 560 -3 195 105 -443 -849 -536 24 -706 -56 -784 219 -904 527 83 481 28 91 274 -139 577 -650 113 -343 296 239 580 -2189 -858 2520 -1313 -438 -1305 -707 -1643 307 72 1356 1432 1886 465 -36 -1300 -840 -110 26 -227 276 511 1087 2151 77 596 -240 663 486 882 -695 -1452 518 -781 -1168 -566 829 31 704 SS 20210626T053645.5Z 7847.233860 190 1 51.38 2 81.69 58.23 81.01 247.21 0.00 1 0.00 1 0 25 3.772e-01 6.324e-03 1.885e-01 1.944e-03 7.083334e-01 1.050180e-03 6.939283e-03 -6.000000e+00 2.117942e-01 224.93 -2.00 3.06 -2.00 321.47 0.00e+00 3.179676e-03 5.217150e-04 2.797526e-03 -6.000000e+00 9.273796e-03 277.11 -2.00 20.00 -2.00 320.96 0.00e+00 6.517 0.002 302.00 328.00 3 -6.7850e-02 3.5977e-03 6.4471e-02 -6.0000e+00 5.2388e-01 8.1649e-02 5.2957e-03 4.1290e-02 -6.0000e+00 5.7097e-01 -4.8531e-02 5.9431e-03 1.8717e-02 -6.0000e+00 3.3973e-01 7.1391e-03 2.7952e-03 6.9602e-03 -6.0000e+00 1.4439e-01 1.3591e-03 -8.0808e-04 5.4238e-05 6.9921e-05 -6.0000e+00 1.0077e-02 2.1065e-03 10 0 0 10 0 0 4.07 18.48 0.28 0.00211 -0.00397 385 83 2 8 0 127.780 14.99 18.48 14.18 20.96 20.96 16.9 870.71 -120293 -161853 -87148 -127006 14376 -129283 -45351 -178516 -116198 -170690 -47265 -106391 -56420 -44721 -61625 -30579 -43816 5356 -39739 29004 -41064 3179 -23182 -14390 -34427 -10647 -27945 -26350 -31703 -27176 8668 -16221 3777 -1749 -1429 -10409 -1053 -6808 -3346 -2861 -3768 -2388 -2051 103 -2647 3661 -600 5532 -769 5142 1364 4566 3053 1924 3393 286 1969 -1124 878 334 5378 2581 2950 842 743 1838 1339 2200 1812 1163 -612 420 -1064 634 -659 969 -500 773 528 -421 -424 -1050 -2155 -1235 -751 -1032 -339 -468 173 -149 987 593 1172 1510 943 649 732 489 -607 -110 -88 327 1019 460 -1703 -1041 -1342 -874 -193 -212 -273 -389 107 164 791 1052 953 290 -275 -887 -774 15 -138 -148 361 131 1186 1749 49 358 47 103 71 231 -389 -486 120 -100 -356 -145 154 -124 479 -365 -890 -248 -530 27 -515 -86 -1489 -595 -1650 -143 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