File name: Pandora272s1_Lauder_20260530_L2Fit_fout2c6d20241202p1-8.txt File generation date: 20260704T073524.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 Local principal investigator: Richard Querel Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 272 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora272_OF_v3d20240829.txt Instrument calibration file used: Pandora272s1_CF_v6d20241202.txt Level 1 file used: Pandora272s1_Lauder_20260530_L1_smca1c6d20241202p1-8.txt Full location name: Lauder Atmospheric Research Station Short location name: Lauder Country of location: New Zealand Location latitude [deg]: -45.0380 Location longitude [deg]: 169.6840 Location altitude [m]: 370 Local noon date: 20260530 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: 196 338 Nominal wavelengths inside fitting window [nm]: 305.0455 305.1861 305.3267 305.4672 305.6077 305.7483 305.8888 306.0293 306.1697 306.3102 306.4507 306.5911 306.7315 306.8720 307.0124 307.1528 307.2931 307.4335 307.5739 307.7142 307.8545 307.9949 308.1352 308.2755 308.4158 308.5560 308.6963 308.8365 308.9768 309.1170 309.2572 309.3974 309.5376 309.6778 309.8179 309.9581 310.0982 310.2383 310.3784 310.5185 310.6586 310.7987 310.9388 311.0788 311.2189 311.3589 311.4989 311.6389 311.7789 311.9189 312.0589 312.1988 312.3388 312.4787 312.6186 312.7585 312.8984 313.0383 313.1782 313.3180 313.4579 313.5977 313.7375 313.8773 314.0171 314.1569 314.2967 314.4364 314.5762 314.7159 314.8556 314.9954 315.1351 315.2747 315.4144 315.5541 315.6937 315.8334 315.9730 316.1126 316.2522 316.3918 316.5314 316.6710 316.8105 316.9501 317.0896 317.2291 317.3686 317.5081 317.6476 317.7871 317.9265 318.0660 318.2054 318.3448 318.4842 318.6236 318.7630 318.9024 319.0417 319.1811 319.3204 319.4598 319.5991 319.7384 319.8777 320.0169 320.1562 320.2955 320.4347 320.5739 320.7131 320.8523 320.9915 321.1307 321.2699 321.4090 321.5482 321.6873 321.8264 321.9655 322.1046 322.2437 322.3828 322.5219 322.6609 322.7999 322.9390 323.0780 323.2170 323.3560 323.4949 323.6339 323.7729 323.9118 324.0507 324.1896 324.3285 324.4674 324.6063 324.7452 324.8840 --------------------------------------------------------------------------------------- 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 20260529T220512.8Z 9645.920287 617 1 54.96 2 75.37 36.60 110.13 199.95 0.00 1 0.00 1 0 17 1.429e-01 1.488e-02 2.467e-02 2.378e-03 4.235304e-01 1.186806e-03 5.213238e-03 -6.000000e+00 8.031360e-02 220.67 -2.00 3.69 -2.00 319.11 0.00e+00 1.453209e-03 2.910997e-04 4.456989e-04 -6.000000e+00 3.579601e-03 275.07 -2.00 20.00 -2.00 318.55 0.00e+00 3.880 0.001 302.00 328.00 3 4.0907e+00 3.2488e-03 4.2811e-02 -6.0000e+00 1.9680e-01 4.2470e-02 3.7605e-03 2.2271e-02 -6.0000e+00 2.1456e-01 -5.5703e-02 2.8551e-03 1.1483e-02 -6.0000e+00 1.2780e-01 2.7353e-02 1.5214e-03 3.8828e-03 -6.0000e+00 5.5198e-02 1.3901e-04 6.3894e-04 6.8672e-05 4.2055e-05 -6.0000e+00 3.9619e-03 1.4119e-02 0.0000e+00 12 9 8 11 32 0 99.63 24.91 -0.01 0.01412 0.01892 37 4 2 8 0 1485.230 20.00 24.91 7.79 35.00 33.75 1.4 911.53 31201 2044 -9231 35021 900000 -52835 -61155 -84905 1997 -28256 -49914 -42109 39556 -13902 -20814 2790 -27837 -930 -13717 564 -722 12682 -18884 2452 6124 14626 -3948 22700 12594 -9224 -16026 9822 72 12056 -15202 16792 -6104 -2432 1714 5558 -2454 11545 728 2641 3796 10068 3389 7729 -4798 6601 5774 1815 1245 916 1881 -849 1117 -1852 -3276 4575 6099 3770 143 2823 -2359 -478 5081 -3857 1709 427 447 -2 -1028 2071 -436 -1084 332 -1764 -3183 -1435 -3386 -665 -2102 -2920 -1471 -307 -563 -14 751 -1609 92 -693 -966 -328 -1308 -243 -772 2022 -6 2093 316 -917 -2089 1161 1333 -797 -401 357 -765 41 842 -34 -611 946 185 -171 -554 954 -433 986 97 13 1374 758 255 221 -477 260 -50 -206 898 -281 -82 -570 -183 25 -478 617 152 7 18 -247 -958 557 55 -291 674 900000 -2156 -2907 -5709 63 -1291 -2882 -2421 1192 -861 -1646 200 -2937 -80 -1425 53 -70 1070 -2268 255 650 1495 -493 2074 1209 -1136 -2359 1253 11 1775 -2791 2204 -1107 -494 403 1360 -725 3139 230 836 1192 3001 1081 2362 -1680 2127 2026 724 536 425 907 -433 572 -976 -1710 2182 2949 2018 81 1700 -1541 -292 2805 -2323 1035 298 345 -1 -783 1588 -318 -716 198 -1039 -2020 -1026 -2612 -562 -1965 -2900 -1429 -316 -612 -16 842 -1793 94 -707 -926 -306 -1315 -252 -912 2453 -8 2755 401 -1087 -2467 1322 1637 -990 -521 489 -1059 62 1350 -54 -967 1493 274 -239 -817 1347 -658 1569 160 21 2131 1142 366 325 -677 365 -71 -323 1499 -472 -143 -1030 -330 48 -944 1230 309 14 34 -447 -1788 SS 20260529T222912.5Z 9645.936950 633 1 54.17 2 73.01 31.36 111.28 194.41 0.00 1 0.00 1 0 17 1.328e-01 1.300e-02 2.128e-02 2.341e-03 3.730848e-01 1.161016e-03 4.646909e-03 -6.000000e+00 7.449862e-02 220.67 -2.00 3.69 -2.00 318.57 0.00e+00 1.359702e-03 2.409667e-04 3.491655e-04 -6.000000e+00 3.267914e-03 275.07 -2.00 20.00 -2.00 318.02 0.00e+00 3.371 0.000 302.00 328.00 3 4.5243e+00 3.1088e-03 3.7307e-02 -6.0000e+00 1.8266e-01 5.5332e-02 3.5520e-03 1.9537e-02 -6.0000e+00 1.9913e-01 -3.8096e-02 2.4694e-03 9.9915e-03 -6.0000e+00 1.1871e-01 1.7031e-02 1.3116e-03 3.2790e-03 -6.0000e+00 5.1224e-02 1.5068e-04 4.1516e-04 6.7440e-05 3.4706e-05 -6.0000e+00 3.6432e-03 1.5550e-02 0.0000e+00 12 8 8 10 0 0 99.96 24.91 0.15 0.01555 0.01867 51 5 2 8 0 1061.950 20.00 24.91 8.49 34.75 33.75 1.3 915.29 -1465 -5851 -23159 5100 117866 -23994 -26752 -49451 -11061 -48185 -30529 -19550 13335 -12288 -9902 3803 -13314 29 -8042 4996 -3382 11558 -9815 3607 3583 10034 -1500 8425 5083 -3411 -8218 4959 -1526 10061 -12311 8464 -5945 -3150 1918 4402 -1787 7384 -413 1437 2234 5874 1997 4054 -4114 2462 2908 2196 2298 546 1487 24 1284 -1716 -2051 2493 4658 1932 1056 2076 209 -725 3201 -3445 1504 271 964 125 -949 1808 -1093 -994 -254 -1640 -2301 -1732 -2696 -1032 -1987 -2886 -1761 -140 -566 21 919 -983 352 -978 -217 -461 -1175 -245 -651 1588 506 2011 12 -591 -2992 399 953 -660 -405 403 -456 -81 656 230 -188 968 -162 -36 -346 790 -172 808 94 -82 985 527 1543 427 -297 124 143 -406 837 -294 -28 -746 87 217 -305 354 409 -193 -301 -688 -647 -61 -282 -1380 217 1453 -1189 -1454 -3749 -636 -4280 -2293 -1397 801 -1131 -1047 398 -1772 4 -1135 643 -482 1409 -1531 525 549 1505 -256 1235 727 -540 -1503 880 -320 1971 -2853 1563 -1390 -829 524 1391 -666 2647 -167 579 894 2282 803 1585 -1748 1001 1261 1040 1162 300 846 13 702 -966 -1132 1418 2668 1123 682 1445 151 -501 2016 -2294 1006 208 750 103 -793 1412 -884 -723 -167 -1050 -1559 -1327 -2193 -926 -1952 -3006 -1799 -151 -646 24 1080 -1142 375 -1046 -214 -443 -1202 -257 -773 1936 674 2635 16 -745 -3562 458 1178 -822 -526 550 -667 -118 1031 376 -305 1471 -246 -51 -485 1133 -266 1230 147 -127 1477 817 2245 601 -403 167 206 -637 1304 -487 -47 -1320 153 401 -584 688 763 -373 -557 -1230 -1116 SS 20260529T225737.5Z 9645.956684 652 1 54.16 2 70.64 24.87 112.14 187.72 0.00 1 0.00 1 0 17 5.283e-02 1.036e-02 7.496e-03 1.713e-03 3.358525e-01 8.472899e-04 4.230503e-03 -6.000000e+00 2.964532e-02 220.67 -2.00 3.69 -2.00 317.83 0.00e+00 1.146018e-03 1.424196e-04 2.205881e-04 -6.000000e+00 1.300389e-03 275.07 -2.00 20.00 -2.00 317.26 0.00e+00 2.983 0.000 302.00 328.00 3 4.4439e+00 2.2291e-03 3.3173e-02 -6.0000e+00 7.2687e-02 4.7230e-02 2.5242e-03 1.7565e-02 -6.0000e+00 7.9241e-02 -2.6720e-02 1.6255e-03 8.8921e-03 -6.0000e+00 4.7237e-02 1.1266e-02 8.4335e-04 2.7917e-03 -6.0000e+00 2.0384e-02 2.4506e-04 8.5811e-05 4.9060e-05 3.0412e-05 -6.0000e+00 1.4497e-03 1.5447e-02 0.0000e+00 12 9 8 11 32 0 99.92 24.92 0.19 0.01545 0.01609 38 4 1 8 0 1425.090 20.00 24.92 9.99 34.75 33.75 1.3 920.95 -233 54 -2119 2714 25541 -12548 -16811 -28461 -6282 -27093 -15714 -15262 4314 -5624 -5923 3845 -6913 -153 -4851 3540 -322 8704 -3802 -746 2798 5850 -791 3018 3204 -1660 -3845 4569 1568 4807 -7285 3174 -3785 -2976 475 1623 -1467 3943 -123 1140 1024 3159 435 2231 -3327 1274 1950 885 1683 1014 492 63 943 -786 -1612 1427 2673 1707 709 2131 -501 -421 1625 -2351 603 398 472 918 -505 1198 18 -928 -348 -1441 -1697 -764 -2309 -859 -2325 -2859 -987 -441 -170 144 883 -139 536 -282 -234 -588 -493 -217 -21 1481 633 -151 91 -634 -2499 194 492 -729 -428 -507 -349 -24 765 412 217 816 127 -113 -216 512 155 808 64 16 890 599 1185 326 -580 174 320 -160 681 -211 -407 -659 -73 203 -227 692 133 -127 -310 -499 -769 -16 4 -172 198 1323 -920 -1368 -2886 -568 -3205 -1664 -1688 452 -763 -939 623 -1206 -26 -917 638 -61 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