File name: Pandora132s1_Berlin_20230607_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T200036.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c13p1-8 Local principal investigator: Thomas Ruhtz Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 132 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora132_OF_v1d20200910.txt Instrument calibration file used: Pandora132s1_CF_v13d20210422.txt Level 1 file used: Pandora132s1_Berlin_20230607_L1_smca1c13d20210422p1-8.txt Full location name: Institute of Space Sciences FU Berlin Short location name: Berlin Country of location: Germany Location latitude [deg]: 52.4600 Location longitude [deg]: 13.3100 Location altitude [m]: 100 Local noon date: 20230607 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: Modification of session 11, but different RefDay (April 2021). First and last pixel inside fitting window: 243 385 Nominal wavelengths inside fitting window [nm]: 305.1071 305.2480 305.3889 305.5298 305.6707 305.8116 305.9524 306.0932 306.2341 306.3749 306.5157 306.6565 306.7973 306.9380 307.0788 307.2195 307.3603 307.5010 307.6417 307.7824 307.9231 308.0638 308.2044 308.3451 308.4857 308.6264 308.7670 308.9076 309.0482 309.1888 309.3293 309.4699 309.6104 309.7510 309.8915 310.0320 310.1725 310.3130 310.4534 310.5939 310.7344 310.8748 311.0152 311.1556 311.2960 311.4364 311.5768 311.7172 311.8575 311.9979 312.1382 312.2785 312.4188 312.5591 312.6994 312.8397 312.9800 313.1202 313.2604 313.4007 313.5409 313.6811 313.8213 313.9615 314.1016 314.2418 314.3819 314.5221 314.6622 314.8023 314.9424 315.0825 315.2225 315.3626 315.5026 315.6427 315.7827 315.9227 316.0627 316.2027 316.3427 316.4827 316.6226 316.7626 316.9025 317.0424 317.1823 317.3222 317.4621 317.6020 317.7418 317.8817 318.0215 318.1613 318.3012 318.4410 318.5807 318.7205 318.8603 319.0000 319.1398 319.2795 319.4192 319.5589 319.6986 319.8383 319.9780 320.1177 320.2573 320.3969 320.5366 320.6762 320.8158 320.9554 321.0949 321.2345 321.3741 321.5136 321.6531 321.7927 321.9322 322.0717 322.2111 322.3506 322.4901 322.6295 322.7689 322.9084 323.0478 323.1872 323.3266 323.4659 323.6053 323.7447 323.8840 324.0233 324.1627 324.3020 324.4413 324.5805 324.7198 324.8591 324.9983 --------------------------------------------------------------------------------------- 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 20230607T042626.5Z 8558.185029 185 1 49.74 2 77.83 68.42 84.80 211.03 0.00 1 0.00 1 0 17 4.499e-01 8.813e-03 2.736e-01 5.841e-03 6.799050e-01 3.230047e-03 8.151731e-03 -6.000000e+00 2.613648e-01 232.86 -2.00 3.85 -2.00 321.52 0.00e+00 3.971580e-03 1.609242e-03 1.622223e-03 -6.000000e+00 1.153907e-02 278.94 -2.00 20.00 -2.00 320.98 0.00e+00 4.604 0.002 302.00 328.00 3 2.6084e+00 1.1092e-02 6.1341e-02 -6.0000e+00 6.5799e-01 6.7749e-02 1.5566e-02 4.1297e-02 -6.0000e+00 7.1399e-01 -1.1719e-01 1.6261e-02 2.2515e-02 -6.0000e+00 4.2313e-01 4.1622e-02 7.6227e-03 8.6453e-03 -6.0000e+00 1.7696e-01 1.9972e-04 3.5462e-05 1.6847e-04 1.1015e-04 -6.0000e+00 1.2382e-02 4.3946e-04 0.0000e+00 11 8 0 10 0 0 60.67 14.88 0.38 0.00044 0.00071 90 19 4 8 0 552.530 15.00 14.88 26.63 21.88 22.29 28.5 1025.92 -125194 900000 900000 -174431 32999 -205202 -23826 -184669 -116668 -179335 -171648 -57527 -109536 -3784 -100170 2777 -87263 -32070 -82985 -30103 10524 -72043 23672 -51843 25157 -37420 -39693 -56855 -43242 -1712 -34302 92474 -20300 6142 -20839 -10404 -20004 -23579 13287 -2241 11813 2917 7573 2633 7863 7950 -3957 7640 -468 9084 5006 11611 4269 10816 1686 2892 6765 -1014 9467 -1582 6102 -273 6314 3074 3901 4185 -379 2025 2471 2971 1801 2569 424 518 -301 1567 1888 -4265 134 -1846 -1400 -1838 -1038 -588 -1135 636 -609 126 879 1458 -272 208 -1595 -665 -1156 -1010 331 333 -87 -78 -816 -1135 -753 -576 -1419 -298 -290 -406 -150 586 184 277 -223 -364 -206 -491 524 -158 653 -243 211 -100 963 618 535 565 -417 1068 -289 188 -236 -211 117 -38 186 -359 386 264 289 -147 47 -760 -256 -713 900000 900000 -1535 188 -2337 -136 -2199 -785 -2414 -2310 -328 -1247 -22 -1711 22 -1762 -457 -1933 -480 114 -1805 243 -1240 301 -874 -949 -1586 -1083 -32 -1094 1000 -774 185 -795 -367 -888 -1329 635 -147 747 216 561 210 609 634 -367 661 -47 900 582 1286 559 1433 258 457 1047 -167 1372 -256 973 -52 1294 721 933 975 -92 512 710 969 642 931 152 173 -92 425 492 -1250 44 -729 -641 -952 -577 -346 -718 420 -427 89 607 952 -169 121 -928 -411 -821 -834 312 353 -98 -86 -831 -1040 -651 -516 -1377 -302 -311 -471 -193 838 288 450 -359 -562 -301 -702 760 -244 1055 -405 342 -156 1429 889 741 751 -555 1515 -473 343 -468 -443 258 -90 427 -862 940 649 698 -372 110 -1707 -569 SS 20230607T043232.9Z 8558.189270 188 1 48.86 2 76.96 69.55 85.26 212.28 0.00 1 0.00 1 0 17 4.009e-01 2.120e-02 3.841e-01 1.756e-02 6.440897e-01 9.620303e-03 7.935228e-03 -6.000000e+00 2.328526e-01 232.86 -2.00 3.85 -2.00 321.28 0.00e+00 8.836633e-03 4.299627e-03 1.038454e-03 -6.000000e+00 1.063011e-02 278.94 -2.00 20.00 -2.00 320.73 0.00e+00 4.319 0.002 302.00 328.00 3 4.2860e+00 3.1694e-02 5.7592e-02 -6.0000e+00 5.8687e-01 2.8272e-01 4.0843e-02 3.9015e-02 -6.0000e+00 6.3711e-01 -3.4925e-01 3.7624e-02 2.0822e-02 -6.0000e+00 3.7669e-01 1.4417e-01 1.8206e-02 1.1382e-02 -6.0000e+00 1.5685e-01 4.6350e-05 -8.3240e-04 5.1410e-04 1.3050e-04 -6.0000e+00 1.1102e-02 1.4643e-03 0.0000e+00 12 8 8 10 0 0 99.87 14.88 0.29 0.00146 -0.00479 34 7 4 8 0 1436.790 15.01 14.88 26.92 21.88 22.29 28.6 1028.01 6025 -128252 900000 -152868 -203390 -96823 -113922 -105019 21820 900000 -191109 -64786 900000 -22772 68531 15052 61473 16492 -17977 -38931 66422 -45077 -24679 8727 -38407 106195 13542 11389 -4378 66128 -71620 -7148 40489 28895 36991 -51282 34962 27068 19609 19470 -7695 7783 -6159 -3821 7017 26070 2140 39576 6178 21734 47477 17031 15570 6885 10633 4074 22030 6008 10950 -2137 -51 4199 9590 17326 643 3889 -1841 5020 8136 3353 5788 5037 2196 613 7522 -12956 3509 -2666 -1432 -3539 2960 -1847 -7410 1525 -2193 -496 -3312 -1438 337 132 727 132 3778 -4887 -2189 -2211 277 -1023 -848 1175 -2656 -25 -1215 -373 -989 43 -2450 -790 1280 357 880 1088 -211 -1496 -979 -1001 90 155 -87 1 851 507 -267 2691 1402 2554 1627 -113 1060 -1375 -662 -26 1659 -471 912 -416 1035 120 -471 280 -283 -1507 -1086 103 -2594 900000 -3806 -7595 -1657 -1950 -1797 373 900000 -8029 -1109 900000 -390 1173 258 1052 339 -554 -1533 1137 -1852 -845 224 -1643 1818 348 292 -135 1132 -5884 -367 1455 1187 1330 -4476 1436 1436 1342 1533 -869 799 -759 -471 793 2499 267 3522 804 2604 4876 2623 2398 1232 1903 799 3997 1140 1925 -429 -11 941 2313 4259 191 1083 -536 1429 2532 1242 2251 2014 875 231 2388 -4556 999 -846 -517 -1547 1405 -1032 -4716 939 -1495 -353 -2536 -1099 249 93 474 81 2175 -3254 -1614 -1896 267 -1127 -989 1315 -2831 -23 -1081 -341 -974 44 -2733 -931 1637 514 1372 1750 -339 -2318 -1427 -1421 129 235 -140 2 1358 779 -398 3756 1904 3287 2083 -159 1658 -2460 -1271 -52 3443 -1062 2157 -1036 2586 306 -1186 668 -635 -3228 -2297 SS 20230607T050022.1Z 8558.208589 199 1 49.45 2 72.93 74.72 87.54 217.86 0.00 1 0.00 1 0 17 1.424e-01 5.440e-03 4.739e-02 2.037e-03 5.111792e-01 1.064811e-03 6.190835e-03 -6.000000e+00 8.270097e-02 232.86 -2.00 3.85 -2.00 320.48 0.00e+00 1.977948e-03 3.889313e-04 3.375969e-04 -6.000000e+00 3.545626e-03 278.94 -2.00 20.00 -2.00 319.88 0.00e+00 3.356 0.001 302.00 328.00 3 2.4398e+00 3.2089e-03 4.4805e-02 -6.0000e+00 2.0820e-01 2.3449e-02 3.9873e-03 2.9845e-02 -6.0000e+00 2.2592e-01 -2.3162e-02 3.6287e-03 1.4876e-02 -6.0000e+00 1.3368e-01 -2.4911e-03 1.8258e-03 5.0348e-03 -6.0000e+00 5.5332e-02 9.0968e-04 7.4333e-05 6.0148e-05 4.8932e-05 -6.0000e+00 3.9010e-03 3.8578e-04 0.0000e+00 10 0 0 10 0 0 89.24 14.94 0.24 0.00039 0.00094 165 35 4 8 0 299.640 15.01 14.94 27.36 21.98 22.40 28.6 1029.54 -45899 -54602 -37915 -54644 -56190 -65471 -36438 -36115 -32368 -49889 -49573 -26325 -16819 -19751 -13471 -5997 -3087 -686 -3491 -4142 -6738 -4233 -5723 2325 -1002 -6028 -7637 -4533 1780 633 -1839 2953 745 -413 -6462 -984 -3749 622 146 516 -1133 -1260 994 -52 909 -189 1262 12 152 685 1708 1706 1233 1047 529 2217 694 -411 -420 -191 2251 1228 1717 1905 1117 135 -536 -457 1459 498 793 694 218 671 -440 -844 -926 -1553 -811 -1034 -1431 -1361 -2282 -1165 -676 -111 319 699 1061 813 1115 807 -185 314 27 -61 215 588 92 -100 -268 -1040 29 -129 -1179 -990 -655 -845 175 483 348 -1 -1 -191 -73 454 338 84 231 -424 -293 -129 397 122 805 -116 37 1036 447 146 -298 -229 -190 194 -24 -304 144 265 -117 -65 236 -560 -72 -529 -770 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