File name: Pandora159s1_Wakkerstroom_20210312_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T024453.2Z 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_20210312_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: 20210312 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 20210312T042302.0Z 7741.182661 42 1 49.90 2 85.44 91.30 71.53 95.49 0.00 1 0.00 1 0 17 6.205e-01 3.282e-02 4.756e-01 2.769e-02 9.932223e-01 1.798573e-02 9.371881e-03 -6.000000e+00 3.810010e-01 227.39 -2.00 3.06 -2.00 322.57 0.00e+00 4.956506e-03 1.174618e-02 1.212802e-02 -6.000000e+00 2.384345e-02 282.17 -2.00 20.00 -2.00 322.15 0.00e+00 10.547 0.007 302.00 328.00 3 3.5109e-01 7.7661e-02 1.2637e-01 -6.0000e+00 9.7016e-01 1.1435e+00 1.0673e-01 1.1711e-01 -6.0000e+00 1.0751e+00 -1.4179e+00 1.0183e-01 3.6692e-02 -6.0000e+00 6.0497e-01 5.4949e-01 4.6896e-02 1.3257e-02 -6.0000e+00 2.6906e-01 2.6215e-05 -2.4141e-03 8.2001e-04 1.2515e-04 -6.0000e+00 1.9439e-02 2.1983e-03 12 8 8 10 0 0 21.83 19.62 0.78 0.00220 -0.01594 41 9 4 8 0 1216.810 14.99 19.62 17.49 21.88 21.79 15.9 892.00 900000 900000 900000 245838 900000 900000 900000 900000 900000 900000 900000 900000 900000 900000 -178285 900000 900000 900000 -117949 -58888 900000 -106587 -90831 118503 -44789 -71706 3906 900000 18208 900000 33795 900000 900000 -2437 900000 -61720 295843 900000 900000 -34192 900000 900000 900000 900000 36947 245338 122995 900000 -28829 900000 -42765 73464 120583 28483 81141 -6781 65741 128007 131767 -300 55118 -23411 75942 -13994 6751 -22584 -4028 -5711 34955 53415 28480 21914 139 8440 -3368 20859 3872 11779 -9029 2004 22028 10494 26572 759 14444 -7128 -2720 -3289 13188 -4754 18542 -946 -5736 7349 -3860 1599 3531 -1449 -1808 1907 -2963 1795 1641 3405 -7024 -2837 -6786 -3306 -2920 667 -2255 -2069 -1010 -2099 662 -4076 4223 -344 4467 -5109 2022 49 2874 4576 2464 885 9 7993 -3883 2525 -2635 1585 188 -532 946 -48 2131 -1761 18 -734 1147 -2228 287 900000 900000 900000 6593 900000 900000 900000 900000 900000 900000 900000 900000 900000 900000 -8411 900000 900000 900000 -4538 -1579 900000 -3290 -2436 3178 -1201 -1923 105 900000 488 900000 906 900000 900000 -65 900000 -2164 7934 900000 900000 -1546 900000 900000 900000 900000 991 6579 3298 900000 -1691 900000 -3521 2190 3234 1567 2820 -575 2784 3433 3534 -21 2271 -2268 3250 -1663 709 -3187 -482 -739 3409 5028 3720 3151 24 1231 -489 2138 442 1317 -1453 354 3859 2381 5770 225 3975 -2536 -973 -1210 4099 -1684 4931 -291 -1841 2242 -1539 724 1879 -949 -1321 1369 -2109 1082 884 1765 -4292 -1777 -4663 -2396 -2397 617 -2476 -2503 -1259 -2641 791 -4977 4817 -433 5661 -7271 2612 61 3317 5096 2728 969 10 8596 -5499 3975 -4944 3132 403 -1245 2354 -128 5630 -4883 48 -1900 2696 -4987 596 SS 20210312T043644.4Z 7741.192180 45 1 50.75 2 82.40 89.72 68.59 94.01 0.00 1 0.00 1 0 25 5.536e-01 7.212e-03 2.470e-01 2.996e-03 7.501364e-01 1.657746e-03 7.202259e-03 -6.000000e+00 3.138641e-01 227.39 -2.00 3.06 -2.00 321.79 0.00e+00 6.190631e-03 9.163375e-04 2.067053e-03 -6.000000e+00 1.390369e-02 282.17 -2.00 20.00 -2.00 321.28 0.00e+00 7.040 0.002 302.00 328.00 3 1.9671e-01 6.1965e-03 6.9341e-02 -6.0000e+00 7.7940e-01 1.2261e-01 9.3661e-03 4.4437e-02 -6.0000e+00 8.4721e-01 -1.1657e-01 1.0287e-02 1.9800e-02 -6.0000e+00 5.0463e-01 3.4537e-02 4.7201e-03 1.0242e-02 -6.0000e+00 2.1436e-01 6.6639e-04 -1.0179e-03 8.3799e-05 9.1930e-05 -6.0000e+00 1.4804e-02 1.5436e-03 11 8 0 10 0 0 -8.58 19.62 0.24 0.00154 -0.00611 258 55 2 8 0 190.790 14.99 19.62 18.53 21.79 21.79 16.0 898.75 -176034 -230151 -195534 -132031 -272938 -79394 -205595 51931 -213203 -98169 -184189 -104439 -118146 -4000 -92919 -74400 -22861 -67884 -39299 -20291 -43477 -52685 28798 -28996 -23262 -49338 -33416 -29905 -27644 -15441 -40722 2331 -30579 -7451 -7935 13093 -19747 4857 -4619 4986 2260 3247 506 -1602 6478 3055 10594 321 8791 6352 9468 1748 8456 5341 3846 1111 -86 428 522 -2468 -339 3432 3656 4200 1301 4037 2379 2487 2279 943 2660 -1546 859 -587 977 -474 72 -2519 2344 -419 619 -429 -1898 -1234 -1070 -675 -510 -111 -347 653 -185 1101 454 1568 429 -253 653 396 -577 -597 199 -464 848 132 -1650 -1270 -1171 -866 -512 -14 -536 -19 -112 129 354 1254 893 594 -216 -714 -695 122 259 -43 700 52 1286 1300 257 -132 64 67 263 321 -374 -372 28 99 -613 78 42 46 214 -669 -1650 -1200 -424 -3044 -232 -1381 152 -1993 -315 -1507 -458 -794 -12 -869 -717 -154 -813 -390 -178 -495 -662 168 -330 -272 -793 -469 -402 -371 -208 -880 41 -804 -168 -175 256 -540 125 -162 191 101 156 27 -89 342 174 582 21 558 452 739 168 842 601 469 146 -12 58 69 -330 -46 504 621 813 277 832 498 545 562 273 837 -484 282 -183 272 -120 17 -638 649 -144 250 -185 -914 -628 -580 -388 -308 -68 -214 384 -102 617 249 892 282 -180 540 379 -612 -636 197 -410 671 105 -1440 -1170 -1138 -904 -590 -18 -787 -30 -177 197 515 1736 1251 876 -340 -1172 -1119 185 379 -61 951 69 1621 1725 394 -234 125 142 582 758 -955 -1000 78 273 -1702 205 104 107 474 SS 20210312T044304.0Z 7741.196573 48 1 51.90 2 81.00 88.99 67.23 93.32 0.00 1 0.00 1 0 25 3.575e-01 6.504e-03 9.307e-02 1.644e-03 6.625610e-01 8.830732e-04 6.534473e-03 -6.000000e+00 2.026566e-01 227.39 -2.00 3.06 -2.00 321.31 0.00e+00 3.343486e-03 4.337681e-04 2.031364e-03 -6.000000e+00 8.977326e-03 282.17 -2.00 20.00 -2.00 320.74 0.00e+00 6.066 0.001 302.00 328.00 3 1.3188e-01 3.0382e-03 5.9622e-02 -6.0000e+00 5.0325e-01 5.1591e-02 4.2872e-03 3.6884e-02 -6.0000e+00 5.4702e-01 -3.5098e-02 4.5136e-03 1.6502e-02 -6.0000e+00 3.2583e-01 2.6575e-03 2.1371e-03 7.0652e-03 -6.0000e+00 1.3841e-01 1.6615e-03 -8.5819e-04 4.6297e-05 6.2480e-05 -6.0000e+00 9.5584e-03 1.4569e-03 11 8 0 10 0 0 9.00 19.61 0.25 0.00146 -0.00499 426 92 2 8 0 115.070 15.00 19.61 19.31 21.79 21.79 16.1 903.24 -155040 -118469 -126791 -98969 -121954 -113307 -118970 -112295 -85396 -107027 -88929 -108740 -55614 -62465 -25828 -49992 -26518 -33996 -14694 -7136 -18392 -9857 -21012 -24734 -22954 -7898 -24397 -9422 -29446 -10169 -20826 1672 -3285 -2948 -7406 -8970 2286 -5189 -395 -6979 -1525 -3809 -2180 -2366 2438 2146 3132 3643 -640 4521 548 4180 2678 3236 621 2252 -130 852 -694 498 2818 2016 2835 1794 1049 1387 1676 1364 2709 211 961 -620 -211 -210 -180 -244 -3 783 128 -58 -822 -820 -2063 -689 -1317 -606 -566 -384 -35 215 914 941 1231 1204 1260 415 607 279 -371 -386 -39 33 1110 603 -1608 -1060 -1892 -516 -511 -90 -442 -189 -189 327 516 1301 899 478 -35 -945 -697 -205 -98 -162 680 234 1241 1523 350 205 136 43 17 332 -407 -433 -28 98 -662 -94 -47 125 414 -994 -627 -793 -460 -665 -563 -687 -702 -466 -789 -585 -1011 -392 -621 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