File name: Pandora132s1_Berlin_20230701_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T201528.5Z 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_20230701_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: 20230701 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 20230701T040522.0Z 8582.170393 135 1 50.11 2 81.14 63.30 121.06 268.23 0.00 1 0.00 1 0 25 5.492e-01 3.154e-02 4.889e-01 2.713e-02 7.985431e-01 1.604799e-02 1.040750e-02 -6.000000e+00 3.311519e-01 233.76 -2.00 3.85 -2.00 321.75 0.00e+00 1.275781e-02 7.739282e-03 4.544434e-03 -6.000000e+00 1.436035e-02 281.39 -2.00 20.00 -2.00 321.26 0.00e+00 6.136 0.005 302.00 328.00 3 2.9999e+00 5.6511e-02 7.9309e-02 -6.0000e+00 8.3609e-01 8.7384e-01 7.2089e-02 5.0970e-02 -6.0000e+00 9.0279e-01 -1.0444e+00 5.9279e-02 2.9674e-02 -6.0000e+00 5.3192e-01 4.2072e-01 2.8327e-02 1.2635e-02 -6.0000e+00 2.2434e-01 2.2558e-05 -2.2009e-03 7.7017e-04 2.1985e-04 -6.0000e+00 1.5361e-02 1.9268e-03 0.0000e+00 12 8 8 10 0 0 99.97 17.45 0.52 0.00193 -0.01461 22 5 4 8 0 2277.140 14.99 17.45 23.96 21.69 22.09 28.3 993.21 -20644 -80235 98763 -126199 72619 -150928 900000 -161649 -96885 -168291 -62278 38072 -147029 132723 -53148 60323 900000 146180 39622 149414 900000 -76772 108296 86293 900000 50628 11368 -25805 -54040 4805 25779 72910 4561 96816 26374 10967 71543 7579 75926 -21924 132124 -1899 129323 17348 57283 107224 126524 121849 14282 78336 -4076 131974 21167 60468 7706 23025 36439 32934 18220 14889 14151 13611 19529 7973 19223 9852 10683 -761 12037 28594 -1706 17437 -3895 13776 5364 759 4501 -5095 4094 -1705 14181 -8222 2972 -2360 652 3813 -4489 1890 -6964 -7948 -6104 4087 -152 2131 4055 -5553 914 -5066 836 -2556 2721 -7641 -1377 -5271 -5563 7 -1948 1455 -3690 -568 -1214 477 -314 -1269 -395 1367 -32 -474 3742 -1040 2295 893 2050 2837 5315 1735 2575 1499 -392 -117 195 1132 349 -1511 764 162 -526 -231 1376 -658 -385 -2714 900000 -546 -2314 2611 -5155 1919 -6165 900000 -7380 -2561 -8088 -1646 1006 -8832 3508 -2043 1594 900000 3864 1047 3949 900000 -4796 2862 2281 900000 1338 300 -955 -2467 152 818 1927 241 2559 1046 493 1891 441 2609 -2055 3492 -181 3418 1421 3180 3684 3679 3865 1397 4348 -571 5232 2742 5594 1243 3226 4431 4004 2456 2046 2057 2231 3458 1609 3963 1988 2344 -179 2806 6390 -553 4735 -1254 3409 1418 189 1035 -1374 1180 -569 4736 -3892 1364 -1208 343 2053 -2740 1099 -4351 -4775 -3359 1915 -73 1086 2348 -4190 757 -5100 854 -2665 2472 -6831 -1072 -4357 -4932 7 -1872 1468 -4416 -751 -1794 732 -486 -1920 -566 1886 -46 -721 5755 -1707 3540 1329 2897 3852 6795 2213 3230 2067 -635 -216 394 2415 798 -3764 1983 439 -1460 -641 3697 -1710 -924 -6208 900000 SS 20230701T045042.2Z 8582.201878 155 1 50.46 2 74.76 71.73 127.69 276.99 0.00 1 0.00 1 0 25 1.448e-01 5.341e-03 6.086e-02 1.948e-03 5.286436e-01 1.025983e-03 6.405954e-03 -6.000000e+00 8.436895e-02 233.76 -2.00 3.85 -2.00 320.61 0.00e+00 1.562433e-03 3.988946e-04 5.192043e-04 -6.000000e+00 3.641867e-03 281.39 -2.00 20.00 -2.00 319.99 0.00e+00 3.733 0.001 302.00 328.00 3 1.8196e+00 3.1698e-03 4.8381e-02 -6.0000e+00 2.1271e-01 3.4821e-02 4.0106e-03 3.0985e-02 -6.0000e+00 2.3056e-01 -6.1080e-03 3.7072e-03 1.5477e-02 -6.0000e+00 1.3651e-01 -9.9881e-03 1.8412e-03 4.8167e-03 -6.0000e+00 5.6523e-02 1.1519e-03 -7.3648e-05 5.7487e-05 4.9745e-05 -6.0000e+00 3.9675e-03 2.8370e-04 0.0000e+00 10 0 0 10 0 0 99.94 17.47 0.20 0.00028 -0.00027 271 57 2 8 0 182.120 15.01 17.47 24.90 21.69 22.09 28.5 997.97 -28319 -67388 -33462 -70886 -25376 -21321 -45061 -43985 -64210 -28339 -66435 -13973 -29750 -3097 -6974 -16632 -5563 -15029 -2807 -11636 406 -8135 -12 -5436 -3084 -4462 -12713 -3082 -14299 -1398 -9031 4065 453 -1631 41 -7951 1163 -2717 2301 -1792 677 -1588 2459 1421 1081 1621 -384 3239 -1143 3010 2382 2341 1444 781 674 252 1207 -403 1441 342 1492 2374 2328 2225 235 695 -1831 -332 789 849 205 283 28 235 445 -1324 -525 -1759 -128 -1069 -1389 -1033 -2317 -921 -946 -398 323 602 479 747 620 672 113 -84 269 27 349 698 247 -85 -352 -908 -196 124 -1487 -1005 -683 -452 434 408 458 63 299 -191 203 285 687 -80 99 -444 -473 45 286 91 301 42 166 1001 300 -128 -287 -459 -83 -10 -96 -354 208 364 -104 -59 140 -168 -95 -210 -832 -305 -889 -188 -154 -462 -518 -1037 -339 -1224 -175 -543 -54 -154 -464 -153 -497 -88 -420 13 -294 0 -222 -133 -203 -626 -133 -687 -64 -522 240 31 -117 3 -595 91 -268 264 -227 92 -235 363 215 167 253 -62 515 -196 531 467 508 343 200 181 71 341 -115 394 94 430 754 829 860 93 262 -692 -129 342 417 110 155 15 119 203 -556 -207 -720 -58 -573 -858 -708 -1729 -719 -791 -352 298 563 442 654 504 507 83 -64 229 27 386 858 321 -108 -411 -967 -199 131 -1714 -1216 -868 -610 635 602 724 102 471 -285 308 420 1029 -127 154 -713 -752 75 458 141 445 59 231 1461 491 -213 -509 -851 -161 -21 -210 -805 480 850 -243 -131 295 -337 -189 SS 20230701T050102.8Z 8582.209060 162 1 1.30 2 73.26 73.65 129.19 279.10 0.00 1 0.00 1 0 17 1.884e-01 1.212e-02 1.765e-01 1.106e-02 4.966931e-01 5.734149e-03 6.178954e-03 -6.000000e+00 1.098217e-01 233.76 -2.00 3.85 -2.00 319.52 0.00e+00 2.867341e-05 1.578735e-03 2.786098e-04 -6.000000e+00 4.739287e-03 281.39 -2.00 20.00 -2.00 318.83 0.00e+00 3.417 0.001 302.00 328.00 3 2.4446e+00 1.6282e-02 4.4740e-02 -6.0000e+00 2.7689e-01 7.0359e-02 1.9113e-02 2.8841e-02 -6.0000e+00 3.0009e-01 -5.8848e-02 1.4963e-02 1.3961e-02 -6.0000e+00 1.7768e-01 1.6620e-02 7.7423e-03 3.7870e-03 -6.0000e+00 7.3591e-02 8.5567e-04 -6.9874e-04 3.1518e-04 3.9685e-05 -6.0000e+00 5.1626e-03 -1.5709e-03 0.0000e+00 12 9 9 12 1 1 999.00 17.48 0.31 -0.00157 -0.00682 2 28 2 8 0 374.550 15.00 17.48 25.15 21.69 22.09 28.4 998.11 -35168 -37689 -30704 -66862 38143 -111770 100613 -86005 -23561 -31811 -34370 -2779 32454 26234 -27011 18385 14025 8516 -17995 268 9576 -17886 7077 -19650 6785 -9810 21115 -2072 -11767 3834 1579 16726 609 9459 -5888 12340 5865 4156 4652 2429 575 916 5529 -2541 2709 -4543 1114 3248 3233 -2222 1936 3581 1836 4615 -3944 4647 35 1983 4596 -2742 3850 -178 3022 -3661 2904 -638 99 462 586 252 -1081 -743 -2832 -798 -2484 -1013 736 -1479 1394 698 -688 -3666 339 -2205 653 -2 1206 128 -452 812 483 441 -1320 1759 -2873 802 757 -545 1999 -145 -541 -1709 792 484 -1052 -1034 -589 489 503 624 260 373 -606 347 -66 137 -34 -784 -308 -384 143 -127 1093 335 832 893 58 674 -757 -1072 -110 592 48 132 259 453 88 -578 555 -327 -40 -282 -516 -724 -887 -692 -2032 411 -4931 1085 -3794 -686 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