File name: Pandora206s1_BuffaloNY_20240323_L2Fit_fout2c1d20220512p1-8.txt File generation date: 20240324T052633.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Kang Sun Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 206 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora206_OF_v3d20211008.txt Instrument calibration file used: Pandora206s1_CF_v1d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20240323_L1_smca1c1d20220512p1-8.txt Full location name: University at Buffalo Short location name: BuffaloNY Country of location: Canada Location latitude [deg]: 43.0015 Location longitude [deg]: -78.7869 Location altitude [m]: 190 Local noon date: 20240323 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: None First and last pixel inside fitting window: 223 365 Nominal wavelengths inside fitting window [nm]: 305.0398 305.1808 305.3218 305.4628 305.6038 305.7447 305.8857 306.0266 306.1675 306.3084 306.4493 306.5902 306.7311 306.8720 307.0128 307.1537 307.2945 307.4353 307.5761 307.7169 307.8577 307.9985 308.1393 308.2800 308.4207 308.5615 308.7022 308.8429 308.9836 309.1243 309.2649 309.4056 309.5462 309.6869 309.8275 309.9681 310.1087 310.2493 310.3899 310.5305 310.6710 310.8116 310.9521 311.0926 311.2331 311.3736 311.5141 311.6546 311.7950 311.9355 312.0759 312.2164 312.3568 312.4972 312.6376 312.7779 312.9183 313.0587 313.1990 313.3394 313.4797 313.6200 313.7603 313.9006 314.0408 314.1811 314.3214 314.4616 314.6018 314.7421 314.8823 315.0225 315.1626 315.3028 315.4430 315.5831 315.7232 315.8634 316.0035 316.1436 316.2837 316.4238 316.5638 316.7039 316.8439 316.9839 317.1240 317.2640 317.4040 317.5439 317.6839 317.8239 317.9638 318.1038 318.2437 318.3836 318.5235 318.6634 318.8033 318.9431 319.0830 319.2228 319.3627 319.5025 319.6423 319.7821 319.9219 320.0616 320.2014 320.3412 320.4809 320.6206 320.7603 320.9000 321.0397 321.1794 321.3191 321.4587 321.5984 321.7380 321.8776 322.0172 322.1568 322.2964 322.4360 322.5755 322.7151 322.8546 322.9941 323.1336 323.2731 323.4126 323.5521 323.6916 323.8310 323.9705 324.1099 324.2493 324.3887 324.5281 324.6675 324.8069 324.9462 --------------------------------------------------------------------------------------- Column 1: Two letter code of measurement routine Column 2: UT date and time for center-time of measurement, yyyymmddThhmmssZ (ISO 8601) Column 3: Fractional days since 1-Jan-2000 midnight for center-time of measurement Column 4: Routine count (1 for the first routine of the day, 2 for the second, etc.) Column 5: Repetition count (1 for the first set in the routine, 2 for the second, etc.) Column 6: Total duration of measurement set in seconds Column 7: Data processing type index Column 8: Solar zenith angle for center-time of measurement in degree Column 9: Solar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 10: Lunar zenith angle for center-time of measurement in degree Column 11: Lunar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 12: Pointing zenith angle in degree, absolute or relative (see next column), 999=tracker not used Column 13: Zenith pointing mode: zenith angle is... 0=absolute, 1=relative to sun, 2=relative to moon Column 14: Pointing azimuth in degree, increases clockwise, absolute (0=north) or relative (see next column), 999=tracker not used Column 15: Azimuth pointing mode: like zenith angle mode but also fixed scattering angles relative to sun (3) or moon (4) Column 16: Fitting result index: 0=no error or warning, 1, 2=warning, >2=error Column 17: Number of function evaluations used, 0=linear fitting or fitting not successful or no fitting done Column 18: rms of unweighted fitting residuals, -9=fitting not successful Column 19: Normalized rms of fitting residuals weighted with independent uncertainty, -9=fitting not successful or no uncertainty used Column 20: Expected rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 21: Expected normalized weighted rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 22: Ozone slant column amount [moles per square meter], -9e99=fitting not successful Column 23: Independent uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 24: Structured uncertainty of ozone slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 25: Common uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 26: rms-based uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 27: Ozone effective temperature [K] Column 28: Independent uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 29: Structured uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 30: Common uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 31: Effective ozone fitting wavelength [nm], -9=fitting not successful Column 32: Diffuse correction applied before fitting at effective fitting wavelength for ozone [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 33: Sulfur dioxide slant column amount [moles per square meter], -9e99=fitting not successful Column 34: Independent uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 35: Structured uncertainty of sulfur dioxide slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 36: Common uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 37: rms-based uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 38: Sulfur dioxide effective temperature [K] Column 39: Independent uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 40: Structured uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 41: Common uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 42: Effective sulfur dioxide fitting wavelength [nm], -9=fitting not successful Column 43: Diffuse correction applied before fitting at effective fitting wavelength for sulfur dioxide [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 44: Molecular scattering air mass factor used for molecular scattering subtraction before the fitting Column 45: Estimated uncertainty of molecular scattering air mass factor, -9=molecular scattering was not subtracted before the fitting Column 46: Lower limit used for wavelength scaling [nm] Column 47: Upper limit used for wavelength scaling [nm] Column 48: Order of smoothing polynomial Column 49: Smoothing polynomial coefficient, order 0 Column 50: Independent uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 51: Structured uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 52: Common uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 53: rms-based uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 54: Smoothing polynomial coefficient, order 1 Column 55: Independent uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 56: Structured uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 57: Common uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 58: rms-based uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 59: Smoothing polynomial coefficient, order 2 Column 60: Independent uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 61: Structured uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 62: Common uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 63: rms-based uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 64: Smoothing polynomial coefficient, order 3 Column 65: Independent uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 66: Structured uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 67: Common uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 68: rms-based uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 69: Mean value of measured data inside fitting window [same units as measurements] Column 70: Wavelength change polynomial coefficient, order 0 Column 71: Independent uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 72: Structured uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 73: Common uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 74: rms-based uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 75: L1 based wavelength change coefficient, order 0, -9=no L1 wavelength change determination Column 76: L1 based wavelength change coefficient, order 1, -9=no L1 wavelength change determination Column 77: L2Fit data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 78: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ1 limit, 0=L1 data quality above 0, 1=Spectral fitting was not successful, 2=Wavelength shift too large, 3=Normalized rms of fitting residuals weighted with independent uncertainty too large Column 79: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 80: L1 data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 81: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ1 limit, 0=Saturated data, 1=Too few dark counts measurements, 2=No temperature given or effective temperature too different from the reference temperature, 3=Dark count too high, 4=Unsuccessful dark background fitting, 5=The dark count differs significantly from the dark map for too many pixels, 6=Absolute value of estimated average residual stray light level too high, 7=Although attempted, no wavelength change could be retrieved, 8=Absolute value of retrieved wavelength shift too large, 9=Retrieved wavelength shift differs too much from the shift predicted by the effective temperature Column 82: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 83: Atmospheric variability [%], 999=no atmospheric variability was determined Column 84: Wavelength effective temperature [°C], 999=no effective temperature given Column 85: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 86: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 87: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 88: Number of bright count cycles Column 89: Number of dark count cycles Column 90: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 91: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 92: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 93: Integration time [ms] Column 94: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Temperature at electronics board 1 [°C], 999=no temperature signal Column 98: Temperature at electronics board 2 [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: Normalized slant column residuals weighted with independent instrumental uncertainty for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting, 0=no independent instrumental uncertainty was given --------------------------------------------------------------------------------------- SS 20240323T144308.4Z 8848.613292 296 1 24.00 2 54.57 128.54 125.05 330.92 0.00 1 0.00 1 0 25 1.093e-01 2.295e-02 1.142e-01 1.633e-02 3.178729e-01 8.021898e-03 3.825099e-03 -6.000000e+00 6.079435e-02 226.53 -2.00 3.55 -2.00 318.41 0.00e+00 3.733048e-03 1.548746e-03 6.445743e-04 -6.000000e+00 2.622236e-03 275.44 -2.00 20.00 -2.00 317.82 0.00e+00 1.720 0.000 302.00 328.00 3 7.6608e+00 2.1607e-02 2.3986e-02 -6.0000e+00 1.5105e-01 9.1016e-02 2.4626e-02 1.7911e-02 -6.0000e+00 1.6467e-01 3.4839e-02 1.6999e-02 8.1924e-03 -6.0000e+00 9.7754e-02 -2.8058e-02 8.9948e-03 4.0573e-03 -6.0000e+00 4.1378e-02 2.8266e-05 -8.6727e-04 4.5438e-04 3.5054e-05 -6.0000e+00 2.7850e-03 2.2370e-02 -2.3160e-05 12 8 8 10 0 0 16.65 17.56 0.16 0.02237 0.01585 6 6 2 8 0 4000.000 15.01 17.56 5.08 21.17 20.96 19.8 946.81 14953 44911 34697 16277 2908 -12139 -15509 25712 37418 18471 43565 25082 28818 44503 34990 10887 16099 15588 -5375 2336 21283 10691 20774 202 -2516 1333 -2581 440 -10762 -886 3001 -1920 -1092 -4760 2004 -7916 -2509 -3140 4916 -8624 -5808 -4712 2998 881 1871 -13478 -8236 -7907 10225 -350 -791 4874 -4151 3981 4065 2556 3936 1791 -1281 -2289 2184 1623 -36 4745 1164 2080 -5800 -16114 789 1822 4820 570 4990 488 2388 810 155 1135 -3756 -1736 -1004 1287 -2859 -811 -879 3985 2548 -165 2168 2816 -974 1421 1468 -4099 -1993 -2375 2117 1239 1188 134 2668 -1275 -1667 -2187 56 -3407 -1878 925 993 814 1667 490 -2009 -156 -1723 -1257 -981 -233 -430 -512 240 -1404 2249 -532 2016 -2348 687 -298 1110 86 -727 1186 -309 -1125 496 1288 246 -67 1149 1090 8 -1146 -1323 684 1707 1533 819 146 -680 -918 1149 1653 1044 1942 1353 1761 2766 2821 1230 1826 1877 -840 352 2711 1484 2656 33 -444 235 -479 75 -1922 -150 523 -385 -241 -1139 412 -1745 -578 -841 1460 -3454 -2471 -2068 1268 387 814 -6914 -3967 -3738 3994 -153 -372 2338 -2303 2159 2269 1466 2268 1045 -751 -1346 1273 1031 -26 3468 882 1433 -4055 -12211 538 1410 3957 507 4211 411 1823 559 101 700 -2587 -1300 -841 1170 -2887 -833 -941 4347 2956 -202 2603 3212 -1090 1418 1343 -3861 -1974 -2633 2508 1607 1633 181 3382 -1534 -1871 -2558 69 -4613 -2616 1277 1442 1272 2744 826 -3338 -237 -2506 -1709 -1333 -328 -651 -800 376 -2181 3386 -784 2738 -3181 882 -392 1514 128 -1147 1891 -509 -1882 871 2350 462 -130 2194 2004 13 -2046 -2305 SS 20240323T164741.8Z 8848.699789 369 1 24.01 2 42.27 167.37 129.59 8.13 0.00 1 0.00 1 0 33 5.209e-02 1.788e-02 3.431e-02 1.020e-02 2.407527e-01 4.995562e-03 2.841585e-03 -6.000000e+00 2.900882e-02 226.54 -2.00 3.55 -2.00 317.41 0.00e+00 2.921723e-03 7.291478e-04 8.426337e-05 -6.000000e+00 1.250475e-03 275.45 -2.00 20.00 -2.00 316.81 0.00e+00 1.350 0.000 302.00 328.00 3 7.5879e+00 1.3190e-02 1.8189e-02 -6.0000e+00 7.2080e-02 3.6443e-02 1.4871e-02 1.2738e-02 -6.0000e+00 7.8555e-02 1.7487e-02 9.0668e-03 6.1812e-03 -6.0000e+00 4.6633e-02 -9.5206e-03 4.5304e-03 2.9478e-03 -6.0000e+00 1.9755e-02 5.1308e-05 1.3189e-03 2.8308e-04 2.4243e-05 -6.0000e+00 1.3273e-03 1.8196e-02 3.8643e-05 12 8 8 10 0 0 -129.75 17.56 1.12 0.01820 0.02811 6 6 2 8 0 4000.000 14.99 17.56 7.31 21.17 20.96 20.1 962.27 339 30639 -2368 28516 -10397 8027 -6951 7915 -12223 1748 7856 -5051 5813 -2486 7232 -4240 13094 -7948 2187 -4164 9219 -1017 7327 -3682 717 -259 92 6303 -9863 3932 -8789 7614 -2984 5742 -3970 -1625 -7826 -579 4736 -2532 -2530 -3528 5737 -1535 7095 -3223 -3285 -6412 2981 -2251 1791 -40 -643 2441 -646 2561 -1305 2759 -1227 1473 -1113 3895 -2271 4846 156 966 -2642 -2393 347 106 3105 -400 3246 -426 1142 -2983 988 -3361 -1729 -2999 -248 -142 -3590 -222 1087 1546 -617 1705 -853 2990 -925 722 -3020 -2405 -2679 -224 1563 1312 1152 302 1607 -2737 -314 -1946 1858 -2478 1330 -26 1231 355 938 1315 746 -229 -1571 -1001 -2875 200 -1056 1665 -927 586 274 377 -20 588 201 -2106 -633 -989 1621 -1071 324 -1553 1825 -868 1458 68 1032 -67 203 -652 -685 36 2743 -294 2489 -1161 714 -756 818 -1706 222 905 -678 802 -431 1309 -952 2559 -1992 515 -1082 2127 -254 1712 -1006 193 -73 26 1603 -2649 950 -2513 2045 -941 1761 -1220 -477 -2704 -208 1932 -1295 -1397 -1974 3126 -908 3843 -1944 -1941 -3803 1573 -1249 1014 -25 -418 1621 -452 1753 -944 1895 -857 999 -805 2896 -1892 4010 133 764 -2014 -1766 266 90 2791 -386 2998 -391 985 -2390 710 -2398 -1285 -2479 -223 -136 -3770 -234 1220 1793 -768 2135 -1097 3639 -1071 749 -3054 -2343 -2797 -245 1863 1691 1559 399 2015 -3291 -359 -2298 2311 -3365 1817 -37 1791 555 1486 2077 1162 -332 -2174 -1295 -3814 270 -1508 2469 -1430 874 401 539 -27 779 253 -2751 -849 -1415 2368 -1643 496 -2442 2958 -1512 2531 119 1846 -117 341 -1065 -1131 SS 20240323T173928.4Z 8848.735745 399 1 38.16 2 41.77 186.75 127.27 23.66 0.00 1 0.00 1 0 25 8.585e-03 5.407e-03 8.004e-04 3.162e-04 2.299854e-01 1.554058e-04 2.806526e-03 -6.000000e+00 4.776512e-03 226.54 -2.00 3.55 -2.00 316.84 0.00e+00 4.037114e-04 1.942275e-05 4.230812e-05 -6.000000e+00 2.060407e-04 275.45 -2.00 20.00 -2.00 316.22 0.00e+00 1.339 0.000 302.00 328.00 3 1.6821e+00 4.0658e-04 1.7745e-02 -6.0000e+00 1.1868e-02 -9.9738e-03 4.5700e-04 1.1821e-02 -6.0000e+00 1.2938e-02 -1.4902e-03 2.6964e-04 5.8559e-03 -6.0000e+00 7.6807e-03 -2.2511e-03 1.2960e-04 1.6810e-03 -6.0000e+00 3.2509e-03 2.0256e-02 3.3292e-04 8.7235e-06 1.8209e-05 -6.0000e+00 2.1885e-04 2.1733e-02 -7.4884e-05 12 1 1 12 1 1 99.99 17.56 0.28 0.02173 0.02424 1724 649 2 8 0 21.800 15.00 17.56 11.26 21.17 20.96 20.6 989.89 -1836 -970 -949 -2469 -3444 -2581 -1108 -163 519 -734 -2110 -1826 -903 -762 295 27 158 242 708 1032 574 346 837 349 -57 627 61 -359 -874 536 999 916 1582 -370 -2269 -1979 -1719 -1144 -193 -248 -854 -696 -589 -604 -216 -353 -406 -251 -652 -19 843 784 910 1040 671 1018 826 609 540 626 1008 1162 1455 1496 153 -244 -538 -742 326 346 393 259 291 440 188 -100 -500 -795 -322 -728 -970 -1026 -1958 -1508 -1137 -720 -375 -16 352 224 426 271 92 297 452 169 532 697 133 -182 -156 -641 -604 10 -638 -684 -603 -565 -221 179 362 214 166 26 -146 153 91 275 184 130 -202 74 260 238 652 361 557 920 548 410 216 18 -243 48 41 -102 31 120 -108 -192 -199 -400 -587 -273 -155 -155 -378 -461 -330 -149 -24 86 -129 -362 -317 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