File name: Pandora132s1_Berlin_20221118_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T183741.1Z 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_20221118_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: 20221118 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 20221118T133324.5Z 8357.564867 456 1 50.76 2 79.86 218.39 91.97 285.33 0.00 1 0.00 1 0 17 3.724e-01 7.869e-03 1.188e-01 2.842e-03 6.068328e-01 1.499663e-03 7.356188e-03 -6.000000e+00 2.073778e-01 220.70 -2.00 3.85 -2.00 321.34 0.00e+00 3.835306e-03 6.707817e-04 1.145355e-03 -6.000000e+00 8.961393e-03 270.68 -2.00 20.00 -2.00 320.89 0.00e+00 5.445 0.003 302.00 328.00 3 6.3098e-01 4.7853e-03 6.3181e-02 -6.0000e+00 5.0907e-01 7.0706e-02 6.5290e-03 3.4857e-02 -6.0000e+00 5.5736e-01 -6.6967e-02 7.0936e-03 2.0018e-02 -6.0000e+00 3.3141e-01 2.2972e-02 3.4684e-03 8.5096e-03 -6.0000e+00 1.4036e-01 7.4627e-04 5.7912e-05 8.4469e-05 1.0200e-04 -6.0000e+00 1.0153e-02 -2.7796e-02 0.0000e+00 11 8 0 10 0 0 53.10 15.60 0.29 -0.02780 -0.02736 371 79 2 8 0 132.850 15.00 15.60 6.72 20.14 20.56 24.9 966.08 -158766 -150872 -86363 -167327 -84455 -124428 -55572 -95226 -96627 -92837 -119401 -69176 -119713 -37525 -67609 -32534 -20481 -32363 -12575 -33513 -9597 -48586 -2682 -43945 -11750 -34694 -19380 -20439 -35288 -6336 -20137 10891 -5595 5465 -15747 2299 -5681 -3133 2377 -5833 5343 -3000 4287 -1543 4937 3977 486 7621 -370 8169 1085 6615 4288 6122 4292 1551 2465 -499 3652 -1937 3613 1808 4963 4681 3035 2404 -786 1356 1124 3474 978 2221 296 1151 1319 -1657 -395 -3522 -1115 -928 -966 -1572 -2038 -2175 -1588 -356 -293 698 523 1223 1022 -252 -636 -757 -117 -839 115 462 563 -180 -409 -1604 -1160 200 -1134 -820 -698 -519 120 617 543 97 229 -410 -238 -586 169 69 408 106 -96 528 550 638 597 74 -708 712 601 -344 -11 -540 -231 -264 157 -139 158 834 86 64 35 -499 -684 -1600 -1634 -522 -2192 -491 -1069 -262 -765 -884 -875 -1555 -633 -2322 -416 -1274 -514 -324 -637 -220 -762 -176 -1319 -48 -1303 -274 -1067 -516 -538 -1085 -160 -698 332 -231 212 -729 89 -266 -173 152 -478 438 -288 402 -157 482 402 52 792 -44 953 151 975 709 1074 735 284 458 -95 649 -362 669 380 1152 1212 830 645 -214 376 350 1211 381 884 118 427 446 -520 -116 -1095 -384 -378 -458 -848 -1201 -1363 -1056 -249 -215 520 387 861 673 -157 -385 -480 -83 -694 108 491 641 -205 -432 -1537 -1035 181 -1114 -850 -763 -607 154 878 846 158 371 -637 -348 -831 241 104 646 174 -155 821 826 925 835 99 -941 988 941 -609 -22 -1097 -491 -597 377 -351 406 2151 222 158 81 -1105 -1496 SS 20221118T134316.3Z 8357.571716 460 1 50.17 2 80.81 220.54 93.40 287.22 0.00 1 0.00 1 0 17 4.454e-01 1.042e-02 2.381e-01 4.225e-03 6.543305e-01 2.254828e-03 7.875668e-03 -6.000000e+00 2.480598e-01 220.70 -2.00 3.85 -2.00 321.56 0.00e+00 3.771574e-03 1.057953e-03 1.364150e-03 -6.000000e+00 1.071947e-02 270.68 -2.00 20.00 -2.00 321.11 0.00e+00 5.953 0.005 302.00 328.00 3 7.2646e-01 7.4145e-03 6.9018e-02 -6.0000e+00 6.0894e-01 1.3683e-01 1.0401e-02 3.8078e-02 -6.0000e+00 6.6671e-01 -1.7051e-01 1.1458e-02 2.1911e-02 -6.0000e+00 3.9643e-01 6.8499e-02 5.5218e-03 8.8281e-03 -6.0000e+00 1.6789e-01 4.0296e-04 -1.3929e-04 1.2508e-04 1.1238e-04 -6.0000e+00 1.2145e-02 -2.7453e-02 0.0000e+00 12 8 8 10 0 0 91.37 15.59 0.28 -0.02745 -0.02850 249 53 4 8 0 198.260 15.00 15.59 7.19 20.14 20.56 25.1 968.97 -244087 58122 -184421 -78576 -147451 -47735 -61663 -167724 -37169 -171618 -103372 -168108 -36971 -76521 -79566 14780 -68456 42379 -52541 12786 -54794 62382 3527 -34108 8961 -44501 -15154 -54609 -6192 -29508 -10666 -3537 -8251 1419 -23832 14935 -21465 -2667 -14060 1978 2269 1772 19152 1436 19388 -2112 15499 -2935 6689 3310 10182 12271 -1480 11473 2367 8049 2588 5155 839 3256 3720 2938 8231 3495 6792 1303 4413 -145 4068 3617 1743 4681 -191 3741 -1297 231 -2538 -1346 -832 -927 -676 -1933 -36 -3023 -368 -2659 649 -469 -98 1702 -3 712 -1886 403 -1121 -918 -827 -17 334 -785 111 -1992 -12 -519 -391 -1662 -824 -829 92 767 9 537 -176 58 -591 -580 579 -268 650 -255 704 20 1398 477 311 303 -657 1031 -52 528 -71 104 -149 -98 26 -343 108 359 279 -112 289 -820 -518 -4845 239 -2487 -353 -1215 -197 -254 -2073 -153 -2635 -937 -3394 -259 -1040 -1410 122 -1467 332 -1147 153 -1309 463 49 -759 140 -1247 -318 -1665 -117 -778 -281 -105 -296 49 -1011 431 -990 -123 -892 126 162 137 1302 119 1374 -191 1207 -287 626 346 1112 1471 -224 1650 394 1320 459 881 146 546 650 577 1757 796 1565 311 1010 -36 1099 1124 603 1625 -68 1204 -399 63 -742 -404 -258 -342 -291 -959 -19 -1757 -223 -1749 434 -325 -67 1094 -2 405 -1072 236 -756 -719 -749 -17 365 -862 112 -1838 -10 -449 -362 -1654 -860 -931 113 1057 14 855 -282 88 -863 -819 820 -403 1024 -417 1124 30 2053 686 432 404 -868 1426 -82 939 -139 215 -324 -228 65 -890 285 955 738 -286 685 -1854 -1149 SS 20221118T140115.5Z 8357.584208 468 1 49.26 2 82.67 224.40 95.96 290.70 0.00 1 0.00 1 0 17 4.958e-01 1.865e-02 3.658e-01 1.193e-02 7.730370e-01 6.676807e-03 9.097621e-03 -6.000000e+00 2.796636e-01 220.70 -2.00 3.85 -2.00 322.00 0.00e+00 9.014497e-03 3.431607e-03 1.695938e-03 -6.000000e+00 1.255187e-02 270.68 -2.00 20.00 -2.00 321.56 0.00e+00 7.249 0.008 302.00 328.00 3 8.2974e-01 2.3304e-02 8.5589e-02 -6.0000e+00 6.8539e-01 5.3227e-01 3.2528e-02 5.2769e-02 -6.0000e+00 7.5118e-01 -7.2216e-01 3.4538e-02 2.4925e-02 -6.0000e+00 4.4435e-01 2.9909e-01 1.6346e-02 1.2749e-02 -6.0000e+00 1.8753e-01 9.1929e-05 -4.2981e-04 3.5086e-04 1.4935e-04 -6.0000e+00 1.3857e-02 -2.7542e-02 0.0000e+00 12 8 8 10 0 0 31.31 15.58 0.51 -0.02754 -0.03077 112 24 4 8 0 439.700 15.00 15.58 7.89 20.14 20.56 24.8 970.94 -186038 -57639 -69783 -208378 900000 -96524 900000 -226773 1699 -126290 -122899 -62098 -117370 900000 -76245 -17907 -90924 2674 -32360 -30310 900000 -64545 900000 -19316 900000 -86969 191927 -63343 -48747 41941 -1043 49470 -31064 74581 -40813 128648 -53814 -16359 -15276 -672 52986 15311 56841 11076 42661 21326 38328 17599 7849 24384 10679 51954 9814 33913 7006 18842 17551 13161 24429 650 28242 4851 23658 1563 22550 7493 15321 9541 7104 15765 2272 10766 3008 4371 4186 4029 -1575 -12115 -1891 -7291 4632 -125 435 -2982 -1169 -354 69 638 333 3753 -3204 3506 -2094 -5073 -4222 -4067 -705 -2187 620 -355 -1150 -2294 -2858 -95 -2623 1316 -2158 -118 -1322 1378 -806 -724 676 -1015 108 -2439 720 -1009 541 620 1288 870 64 3125 -791 1732 522 2222 265 595 -69 -37 261 231 385 -419 356 406 616 -502 -625 -373 -1522 -3735 -670 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