File name: Pandora132s1_Berlin_20221228_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T185441.5Z 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_20221228_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: 20221228 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 20221228T122040.2Z 8397.514355 211 1 43.27 2 77.36 197.00 77.82 124.41 0.00 1 0.00 1 0 25 2.520e-01 5.723e-03 5.151e-02 1.659e-03 5.723178e-01 8.538881e-04 7.020360e-03 -6.000000e+00 1.404052e-01 220.69 -2.00 3.85 -2.00 320.83 0.00e+00 2.792224e-03 3.281662e-04 5.149864e-04 -6.000000e+00 5.977169e-03 266.96 -2.00 20.00 -2.00 320.41 0.00e+00 4.447 0.002 302.00 328.00 3 7.7943e-01 2.5375e-03 5.3799e-02 -6.0000e+00 3.4508e-01 5.9230e-02 3.2899e-03 3.2374e-02 -6.0000e+00 3.7794e-01 -2.7241e-02 3.4873e-03 1.7500e-02 -6.0000e+00 2.2425e-01 3.0843e-04 1.7670e-03 6.5724e-03 -6.0000e+00 9.4789e-02 1.6586e-03 -4.1251e-04 4.8347e-05 6.9197e-05 -6.0000e+00 6.8683e-03 -3.3577e-02 0.0000e+00 12 1 1 12 1 1 99.38 16.07 0.20 -0.03358 -0.03668 410 104 2 8 0 100.690 15.02 16.07 14.86 20.56 20.96 26.5 1027.96 -100376 -100158 -88050 -83719 -91720 -83316 -99563 -62458 -71928 -51384 -74995 -45303 -52666 -29788 -14546 -19747 -16280 -17391 -9069 -18441 -5509 -15951 -14668 -9730 -9750 -9136 -12637 -11748 -13673 -8708 -6121 -1058 -2180 -1971 -1374 -6673 -3386 -2660 1287 -1504 516 664 980 3425 131 2764 545 3455 1008 2173 2596 2119 2780 2224 2481 1359 2206 458 357 -59 1688 2816 2550 3091 960 798 -133 -467 1189 700 1022 648 196 -207 -416 -1271 -1303 -2289 -1011 -911 -1556 -1166 -2103 -1437 -1164 -511 476 266 841 625 941 113 -499 -187 155 223 116 740 331 139 -160 -746 -363 117 -972 -1462 -502 -728 215 401 547 133 270 -78 -118 152 330 0 67 -284 -229 47 566 201 552 32 -293 859 378 -13 -34 -307 -349 55 -82 -193 -78 523 -102 -77 228 -326 -153 -1007 -1167 -969 -854 -935 -769 -1176 -586 -838 -524 -1020 -521 -818 -472 -247 -419 -374 -445 -230 -543 -146 -472 -449 -309 -336 -330 -477 -428 -505 -328 -264 -52 -123 -117 -79 -401 -218 -204 116 -166 62 86 121 463 19 391 80 510 159 328 431 393 561 486 570 329 542 114 86 -14 415 757 779 1042 343 277 -45 -165 458 310 493 326 97 -98 -179 -497 -476 -858 -418 -443 -883 -744 -1472 -1060 -913 -424 411 235 735 525 735 83 -352 -135 125 207 123 883 390 163 -191 -803 -362 119 -1068 -1708 -612 -949 279 575 855 217 435 -120 -171 212 461 1 105 -459 -368 72 838 315 829 46 -413 1253 619 -22 -62 -589 -702 116 -187 -458 -189 1275 -250 -180 503 -683 -314 SS 20221228T122804.8Z 8397.519500 215 1 49.64 2 77.70 198.70 76.89 125.97 0.00 1 0.00 1 0 17 3.531e-01 1.206e-02 2.244e-01 7.016e-03 5.848648e-01 3.679500e-03 7.210056e-03 -6.000000e+00 1.978643e-01 220.69 -2.00 3.85 -2.00 321.02 0.00e+00 3.906936e-03 1.454713e-03 5.586667e-04 -6.000000e+00 8.635297e-03 266.96 -2.00 20.00 -2.00 320.61 0.00e+00 4.563 0.002 302.00 328.00 3 2.9434e+00 1.1090e-02 5.5250e-02 -6.0000e+00 4.8582e-01 1.1539e-01 1.4436e-02 3.3306e-02 -6.0000e+00 5.3231e-01 -1.0447e-01 1.5170e-02 1.8068e-02 -6.0000e+00 3.1502e-01 4.1608e-02 7.6447e-03 7.2179e-03 -6.0000e+00 1.3324e-01 1.6558e-04 -6.8979e-04 2.0798e-04 8.2094e-05 -6.0000e+00 9.7659e-03 -3.2715e-02 0.0000e+00 12 8 8 10 0 0 99.97 16.08 0.21 -0.03272 -0.03790 98 21 2 8 0 506.390 15.00 16.08 15.51 20.56 20.96 26.5 1031.26 -151735 -55728 -123124 900000 -182684 900000 -122831 -16213 -62729 -145553 -4909 -117463 122516 -82488 37859 -57290 -12671 -25046 1018 28996 -26571 38497 -36691 28261 -25235 12285 -14686 -31142 -6015 -4713 24264 -13240 23286 -15368 12350 5990 -9467 -3446 956 14206 -2989 19781 -5523 1585 -7891 5371 4837 4737 11731 -4489 17696 735 9902 3606 3472 6586 2969 5186 -106 2776 -2932 10366 2580 6633 854 1619 4449 -2756 5122 -1138 3061 693 604 709 -925 1627 -3275 -365 -2807 2926 -1641 -1406 -2734 -2437 -1569 -2409 818 -1518 898 448 1472 -809 349 1279 -1675 -469 -1364 1481 -1136 9 194 -743 460 -795 338 -2320 63 -1852 1320 -46 -32 258 -153 399 -587 879 354 547 -165 -143 292 -204 1133 78 1009 -274 -99 357 1066 579 108 87 -579 375 -618 -56 -351 825 107 -508 358 -880 -62 -2547 -416 -1914 900000 -4543 900000 -1932 -111 -686 -3530 -34 -2812 838 -2257 388 -1802 -286 -702 24 535 -872 658 -1380 599 -984 344 -542 -1321 -197 -164 747 -706 987 -1009 591 303 -615 -252 82 1253 -350 1975 -677 204 -1030 691 638 645 1548 -675 2590 129 1730 722 732 1396 666 1129 -24 595 -693 2372 723 1984 281 514 1339 -917 1748 -473 1332 320 274 303 -367 565 -1118 -123 -1086 1259 -859 -830 -1776 -1673 -1137 -1874 648 -1261 722 347 1053 -551 225 844 -1271 -405 -1366 1628 -1379 10 214 -743 423 -754 340 -2533 71 -2262 1710 -68 -52 429 -252 625 -873 1238 505 815 -263 -235 474 -322 1696 114 1405 -370 -130 488 1617 988 201 170 -1192 810 -1435 -136 -869 2040 265 -1218 799 -1877 -128 SS 20221228T124744.3Z 8397.533152 226 1 13.46 2 78.77 203.18 74.53 130.18 0.00 1 0.00 1 0 25 3.881e-01 1.422e-02 3.298e-01 1.144e-02 6.110080e-01 5.943299e-03 7.548712e-03 -6.000000e+00 2.177681e-01 220.69 -2.00 3.85 -2.00 320.90 0.00e+00 8.784405e-03 2.316339e-03 7.965753e-04 -6.000000e+00 9.262941e-03 266.96 -2.00 20.00 -2.00 320.48 0.00e+00 4.963 0.003 302.00 328.00 3 3.0371e+00 1.7492e-02 5.9917e-02 -6.0000e+00 5.3618e-01 1.7242e-01 2.2971e-02 3.7286e-02 -6.0000e+00 5.8803e-01 -1.3813e-01 2.4858e-02 1.9633e-02 -6.0000e+00 3.4737e-01 4.7183e-02 1.2542e-02 1.1295e-02 -6.0000e+00 1.4731e-01 9.8312e-05 -8.5763e-04 3.2526e-04 1.0307e-04 -6.0000e+00 1.0858e-02 -3.3161e-02 0.0000e+00 12 9 9 12 1 1 97.94 16.11 0.40 -0.03316 -0.03961 8 7 2 8 0 1475.730 15.03 16.11 15.86 20.56 20.96 26.3 1031.39 900000 -138925 -94337 -65672 -130540 -119221 -199393 900000 -26641 157276 -86971 -54377 -28051 -87068 900000 -47784 3527 -46251 65268 10526 12239 6369 -65593 47292 9842 -2647 -57214 55857 -15003 158990 16691 -13350 -4913 -15437 560 -42536 -3161 -16699 13383 -5478 13877 3417 11737 2309 -941 17163 6208 7615 8992 619 12652 -5924 16423 285 8562 -1430 4785 -3983 3756 5029 836 13305 -3320 6869 2651 3779 -2062 -1746 6972 260 2462 -1678 2687 -740 -2228 -2311 1414 -506 -1769 2388 -2793 489 -3031 315 -2114 915 -720 -2232 2152 -1918 3319 -2365 1437 237 -510 -1406 -733 1523 -2287 242 250 975 -83 -1804 864 -3111 442 -1668 169 293 849 -278 736 -54 247 397 -918 1119 -453 703 -810 107 709 -370 1126 721 -734 807 1955 35 -64 380 249 -540 -382 -506 -478 1219 -127 -387 -56 148 -644 900000 -2253 -1052 -732 -1853 -1450 -5660 900000 -297 1754 -1058 -606 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