File name: Pandora159s1_Wakkerstroom_20210721_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T031327.4Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: B. Scholes Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 159 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora159_OF_v5d20191004.txt Instrument calibration file used: Pandora159s1_CF_v3d20201207.txt Level 1 file used: Pandora159s1_Wakkerstroom_20210721_L1_smca1c3d20201207p1-8.txt Full location name: Global Change Institute, University of Witwatersrand field site in Wakkerstroom Short location name: Wakkerstroom Country of location: South Africa Location latitude [deg]: -27.3493 Location longitude [deg]: 30.1438 Location altitude [m]: 1760 Local noon date: 20210721 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: None First and last pixel inside fitting window: 222 364 Nominal wavelengths inside fitting window [nm]: 305.0731 305.2139 305.3547 305.4955 305.6363 305.7770 305.9178 306.0585 306.1992 306.3399 306.4806 306.6213 306.7620 306.9026 307.0433 307.1839 307.3246 307.4652 307.6058 307.7464 307.8869 308.0275 308.1681 308.3086 308.4492 308.5897 308.7302 308.8707 309.0112 309.1517 309.2921 309.4326 309.5730 309.7135 309.8539 309.9943 310.1347 310.2751 310.4155 310.5558 310.6962 310.8365 310.9769 311.1172 311.2575 311.3978 311.5381 311.6784 311.8186 311.9589 312.0991 312.2393 312.3795 312.5198 312.6599 312.8001 312.9403 313.0805 313.2206 313.3607 313.5009 313.6410 313.7811 313.9212 314.0612 314.2013 314.3414 314.4814 314.6214 314.7615 314.9015 315.0415 315.1814 315.3214 315.4614 315.6013 315.7413 315.8812 316.0211 316.1610 316.3009 316.4408 316.5807 316.7205 316.8604 317.0002 317.1400 317.2798 317.4196 317.5594 317.6992 317.8389 317.9787 318.1184 318.2582 318.3979 318.5376 318.6773 318.8170 318.9566 319.0963 319.2359 319.3756 319.5152 319.6548 319.7944 319.9340 320.0736 320.2131 320.3527 320.4922 320.6318 320.7713 320.9108 321.0503 321.1898 321.3292 321.4687 321.6081 321.7476 321.8870 322.0264 322.1658 322.3052 322.4446 322.5839 322.7233 322.8626 323.0019 323.1413 323.2806 323.4199 323.5591 323.6984 323.8377 323.9769 324.1162 324.2554 324.3946 324.5338 324.6730 324.8121 324.9513 --------------------------------------------------------------------------------------- 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: 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 77: 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 78: 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 79: 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 80: 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 81: 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 82: Atmospheric variability [%], 999=no atmospheric variability was determined Column 83: Wavelength effective temperature [°C], 999=no effective temperature given Column 84: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 85: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 86: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 87: Number of bright count cycles Column 88: Number of dark count cycles Column 89: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 90: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 91: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 92: Integration time [ms] Column 93: Spectrometer control temperature [°C], 999=no temperature signal Column 94: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 95: Temperature in head sensor [°C], 999=no temperature signal Column 96: Temperature at electronics board 1 [°C], 999=no temperature signal Column 97: Temperature at electronics board 2 [°C], 999=no temperature signal Column 98: Humidity in head sensor [%], -9=no humidity signal Column 99: Pressure in head sensor [hPa], -9=no pressure signal Columns 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: 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 20210721T051215.9Z 7872.216851 128 1 48.58 2 85.56 64.27 121.52 213.25 0.00 1 0.00 1 0 25 6.558e-01 6.050e-02 5.297e-01 5.480e-02 1.012128e+00 3.187368e-02 1.037584e-02 -6.000000e+00 3.777746e-01 225.65 -2.00 3.06 -2.00 322.20 0.00e+00 -1.466343e-02 1.282512e-02 7.410565e-04 -6.000000e+00 1.850455e-02 276.75 -2.00 20.00 -2.00 321.71 0.00e+00 10.759 0.007 302.00 328.00 3 7.0695e-01 1.0666e-01 9.9974e-02 -6.0000e+00 9.3585e-01 1.9608e+00 1.2422e-01 5.7737e-02 -6.0000e+00 1.0212e+00 -2.1963e+00 8.0311e-02 2.2682e-02 -6.0000e+00 6.0610e-01 7.9022e-01 4.4831e-02 1.6459e-02 -6.0000e+00 2.5919e-01 1.2783e-05 -3.3661e-03 1.4351e-03 2.3875e-04 -6.0000e+00 1.8670e-02 3.8908e-03 12 8 8 10 0 0 13.60 18.35 0.98 0.00389 -0.02140 21 5 4 8 0 2313.120 14.99 18.35 9.05 20.87 20.87 16.6 842.85 115517 85521 129579 -24629 24932 -26229 -47775 30181 900000 -59795 900000 -6948 117663 900000 53799 900000 146945 94915 7950 153664 110721 -37633 -54465 900000 40956 900000 73540 -11770 134308 109343 900000 -18699 26771 -28489 -10108 146745 23937 900000 900000 79221 234805 900000 25598 900000 -77181 900000 -33343 246710 -42151 15764 70413 -11176 242238 220445 900000 68704 121238 88433 -2288 56224 -40621 7911 99494 27887 15782 11884 -31527 138108 -8379 112794 9431 59857 44734 24932 11286 -18458 19617 -23050 993 -16337 7620 -16121 1942 5717 18377 -6114 14116 -15199 3297 10217 2821 7293 -13150 34379 28125 5958 275 17654 -11274 1479 -8101 6405 -10469 -15457 18108 -11525 7495 -586 6929 -12549 5070 148 3691 3238 -4122 -4870 10521 1754 -3916 433 -1251 4752 3581 4312 -4586 48 -1091 -418 -4542 -210 815 4667 2070 -1527 -1033 -1148 -13 -2046 2016 -701 -589 257 1702 6158 4559 6907 -2532 1329 -2044 -4702 1609 900000 -7846 900000 -541 6272 900000 3088 900000 7833 5060 750 8191 5902 -4321 -7370 900000 2519 900000 3920 -965 7159 5829 900000 -1763 1756 -3271 -870 7822 1374 900000 900000 4223 12517 900000 2519 900000 -18039 900000 -4512 13151 -6395 1422 4379 -1604 12913 11751 900000 6104 6463 6285 -338 4496 -7496 1019 5746 3716 2524 1953 -7369 7362 -1821 9019 2127 9041 7551 4652 2106 -4018 2701 -5017 194 -4572 1997 -5751 645 1946 6286 -2582 5455 -7354 1406 3858 1065 2495 -5491 9621 9745 3070 164 10280 -9755 1146 -6477 4240 -7255 -10986 9814 -8908 5061 -466 5787 -13790 5426 184 4647 4103 -5460 -6311 12759 2244 -5589 608 -1729 6291 4565 5325 -6030 59 -1313 -533 -7123 -375 1640 9952 4516 -3745 -2728 -3212 -36 -5932 5563 -1890 -1575 622 3847 SS 20210721T052707.9Z 7872.227174 131 1 49.35 2 82.61 62.41 123.14 209.95 0.00 1 0.00 1 0 25 4.899e-01 8.820e-03 3.267e-01 4.694e-03 7.741175e-01 2.631194e-03 7.444616e-03 -6.000000e+00 2.792937e-01 225.65 -2.00 3.06 -2.00 321.86 0.00e+00 4.341178e-03 1.434232e-03 4.823714e-03 -6.000000e+00 1.235217e-02 276.75 -2.00 20.00 -2.00 321.40 0.00e+00 7.215 0.002 302.00 328.00 3 7.4100e-01 9.6205e-03 7.5099e-02 -6.0000e+00 6.9420e-01 1.2910e-01 1.5321e-02 5.6587e-02 -6.0000e+00 7.5799e-01 -1.4926e-01 1.7690e-02 2.4025e-02 -6.0000e+00 4.4890e-01 4.7653e-02 8.0763e-03 7.9469e-03 -6.0000e+00 1.9141e-01 3.3638e-04 -1.0704e-03 1.3380e-04 8.6608e-05 -6.0000e+00 1.3487e-02 3.8534e-03 11 8 0 10 0 0 3.13 18.35 0.37 0.00385 -0.00419 149 32 4 8 0 331.170 15.00 18.35 10.48 20.87 20.87 16.5 849.99 900000 -230851 900000 -195167 -70714 -218203 -88514 900000 -63293 85964 -204553 14442 -187781 900000 -122400 -42902 -55834 900000 -54227 71940 5492 -36427 900000 -75314 61461 -105588 -9403 -86455 11322 -28898 31154 -28971 12746 26069 -23483 72872 -28755 -193 -12565 15435 -24304 22944 -15127 9109 -1836 -5506 18969 2976 11968 -5787 14813 -6154 19808 -1398 7804 -4135 5899 -253 245 10299 782 6605 2074 8624 712 8244 -2828 3661 3429 3098 1023 396 1602 2918 573 -3208 5613 -2341 361 -2101 1581 -2015 -1645 -1242 -1405 -47 -1293 -15 -883 687 415 1437 -1269 1957 -206 470 259 401 -742 -400 349 -513 1371 -336 -1013 -1646 2547 -1940 -74 -574 -539 -314 357 279 82 1665 458 599 -753 -541 -1336 605 -889 71 395 3 1798 1250 897 -534 454 -61 307 34 -157 -484 209 -75 -216 -44 56 181 -171 900000 -1434 900000 -921 -323 -1204 -405 900000 -289 393 -1671 66 -2053 900000 -1246 -249 -427 900000 -510 329 32 -319 900000 -1123 281 -2448 -88 -1683 87 -374 280 -574 200 387 -549 671 -780 -5 -433 488 -1267 827 -831 411 -94 -303 858 167 658 -412 981 -565 1572 -149 816 -508 677 -31 29 1084 94 834 315 1405 134 1439 -550 707 743 777 289 117 460 779 142 -743 1135 -534 92 -659 564 -854 -767 -614 -738 -26 -759 -9 -527 390 222 717 -635 1007 -123 328 211 374 -765 -412 336 -444 1061 -265 -865 -1498 2348 -2005 -83 -734 -770 -477 548 419 118 2268 637 874 -1172 -867 -2116 905 -1296 100 535 3 2277 1672 1378 -946 879 -126 668 80 -389 -1264 553 -202 -577 -113 135 411 -375 SS 20210721T053324.8Z 7872.231537 134 1 50.67 2 81.38 61.60 123.78 208.51 0.00 1 0.00 1 0 25 4.266e-01 7.742e-03 2.197e-01 2.532e-03 6.869530e-01 1.369538e-03 6.703789e-03 -6.000000e+00 2.401770e-01 225.65 -2.00 3.06 -2.00 321.46 0.00e+00 4.488433e-03 6.776150e-04 2.851734e-03 -6.000000e+00 1.057376e-02 276.75 -2.00 20.00 -2.00 320.96 0.00e+00 6.307 0.001 302.00 328.00 3 6.0509e-01 4.6777e-03 6.2802e-02 -6.0000e+00 5.9513e-01 6.8750e-02 6.7891e-03 4.1005e-02 -6.0000e+00 6.4839e-01 -6.1801e-02 7.5512e-03 1.7868e-02 -6.0000e+00 3.8580e-01 1.2621e-02 3.5657e-03 7.5675e-03 -6.0000e+00 1.6458e-01 8.4039e-04 -1.1205e-03 7.2093e-05 6.7538e-05 -6.0000e+00 1.1404e-02 3.7636e-03 11 8 0 10 0 0 45.94 18.35 0.35 0.00376 -0.00466 245 53 2 8 0 201.060 15.00 18.35 10.98 20.87 20.87 16.6 852.39 -226907 900000 -167727 173959 -155064 -13239 -191719 -110958 -103230 -73797 -13958 -104670 39137 -93130 35867 -79514 42890 -65722 -5368 -55709 -13421 -24045 -17154 -9736 -24887 -24461 -38376 7173 -46465 8123 -19182 8635 -23855 -1284 -3632 -4786 8662 -7410 5608 -11913 8579 -11215 9996 -5963 6456 -3284 3607 1004 2253 5517 3245 8145 177 5318 -1283 5245 -1503 1718 -826 3171 2419 3968 2403 1728 2502 642 4575 -580 4846 34 1101 -775 838 -270 -10 688 -539 2673 -1345 1046 -1087 131 -2595 -473 -2227 -541 -762 -11 -481 -769 1221 233 1903 722 1963 -159 1157 -73 -181 -413 141 82 1015 831 -2050 -958 -1509 -315 -732 134 -588 -90 -28 485 671 1143 839 46 -80 -1086 -661 -180 43 -387 838 77 1470 1650 29 329 -7 152 -74 588 -426 -325 -77 36 -597 -100 55 47 418 -2190 900000 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