File name: Pandora75s1_EssexMD_20240628_L2Fit_fout2c3d20230525p1-8.txt File generation date: 20250116T072953.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 75 Spectrometer number: 1 Processing software version used: BlickP v1.8.70 Instrument operation file used: Pandora75_OF_v3d20220127.txt Instrument calibration file used: Pandora75s1_CF_v3d20230525.txt Level 1 file used: Pandora75s1_EssexMD_20240628_L1_smca1c3d20230525p1-8.txt Full location name: MDE Essex Monitoring Site Short location name: EssexMD Country of location: United States Location latitude [deg]: 39.3109 Location longitude [deg]: -76.4745 Location altitude [m]: 12 Local noon date: 20240628 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: OoB session based on session 2 First and last pixel inside fitting window: 196 338 Nominal wavelengths inside fitting window [nm]: 305.0305 305.1717 305.3128 305.4540 305.5951 305.7363 305.8774 306.0185 306.1596 306.3007 306.4418 306.5828 306.7239 306.8649 307.0060 307.1470 307.2880 307.4290 307.5700 307.7110 307.8519 307.9929 308.1338 308.2747 308.4157 308.5566 308.6975 308.8384 308.9792 309.1201 309.2610 309.4018 309.5426 309.6834 309.8243 309.9651 310.1058 310.2466 310.3874 310.5281 310.6689 310.8096 310.9503 311.0910 311.2317 311.3724 311.5131 311.6537 311.7944 311.9350 312.0757 312.2163 312.3569 312.4975 312.6381 312.7786 312.9192 313.0598 313.2003 313.3408 313.4813 313.6218 313.7623 313.9028 314.0433 314.1838 314.3242 314.4646 314.6051 314.7455 314.8859 315.0263 315.1667 315.3070 315.4474 315.5877 315.7281 315.8684 316.0087 316.1490 316.2893 316.4296 316.5699 316.7101 316.8504 316.9906 317.1308 317.2710 317.4112 317.5514 317.6916 317.8318 317.9719 318.1121 318.2522 318.3923 318.5324 318.6725 318.8126 318.9527 319.0927 319.2328 319.3728 319.5129 319.6529 319.7929 319.9329 320.0729 320.2128 320.3528 320.4927 320.6327 320.7726 320.9125 321.0524 321.1923 321.3322 321.4721 321.6119 321.7518 321.8916 322.0314 322.1712 322.3110 322.4508 322.5906 322.7304 322.8701 323.0099 323.1496 323.2893 323.4290 323.5687 323.7084 323.8481 323.9877 324.1274 324.2670 324.4067 324.5463 324.6859 324.8255 324.9650 --------------------------------------------------------------------------------------- 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: Temperature at electronics board [°C], 999=no temperature signal Column 95: Spectrometer control temperature [°C], 999=no temperature signal Column 96: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 97: Temperature in head sensor [°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 20240628T112152.2Z 8945.473521 215 1 11.00 2 73.21 73.41 41.11 194.50 0.00 1 0.00 1 0 17 1.922e-01 1.464e-02 1.570e-01 9.282e-03 4.422066e-01 4.966056e-03 5.196177e-03 -6.000000e+00 1.171965e-01 232.83 -2.00 3.48 -2.00 319.52 0.00e+00 2.230879e-03 1.420108e-03 1.404060e-03 -6.000000e+00 5.305231e-03 288.93 -2.00 20.00 -2.00 318.72 0.00e+00 3.408 0.001 302.00 328.00 3 4.5891e+00 1.4260e-02 4.1588e-02 -6.0000e+00 2.9378e-01 2.7721e-02 1.6808e-02 2.3990e-02 -6.0000e+00 3.1722e-01 -8.5125e-03 1.2573e-02 1.1771e-02 -6.0000e+00 1.8917e-01 -3.2776e-03 6.4741e-03 3.3415e-03 -6.0000e+00 7.8620e-02 1.0438e-04 2.2036e-05 2.9357e-04 4.7326e-05 -6.0000e+00 5.9643e-03 2.2073e-03 -2.8941e-05 12 9 9 12 1 1 999.00 23.54 0.61 0.00221 0.00237 2 2 1 5 0 3664.790 26.32 19.99 23.54 27.62 4.4 1013.61 -16559 -41242 900000 -28621 -80673 -81157 52897 -55058 -88295 -18315 -13539 63902 -20999 105488 -9541 -8946 -30778 -11568 -7470 -6270 11703 10295 -14405 -6152 3452 13917 -2109 -8478 -9962 31574 -2780 7770 2580 12664 -8419 -13 -5772 29 6974 4287 -660 1383 10407 8777 -2683 5340 -290 -6347 580 1114 -880 711 -183 1959 -2500 7483 -57 -890 -1429 172 333 4571 -62 3922 3384 716 1316 -2419 6519 1942 876 2031 -1675 -1208 -2720 -342 -3954 -1437 -3761 -1889 -1705 -2000 -3326 -1353 -1068 -1041 -134 781 1752 2740 2069 988 -1152 -766 -2682 688 1380 -2 897 819 -1164 -2310 -1047 -454 -2085 -1286 -1792 244 118 930 3318 562 848 -1124 -425 215 598 -526 675 -613 325 539 -148 58 903 857 -269 1429 186 -717 -658 -454 -531 636 -98 -699 234 775 358 34 -76 -1158 49 -259 -950 900000 -612 -2721 -2671 527 -1794 -4475 -497 -368 868 -779 1337 -458 -494 -2340 -785 -521 -454 731 662 -1226 -512 278 1058 -191 -798 -929 2000 -274 781 304 1421 -1151 -2 -836 5 1244 923 -167 368 2647 2328 -809 1503 -87 -2034 176 351 -277 240 -67 754 -1057 2961 -25 -392 -625 74 148 2106 -33 2165 1924 405 714 -1376 3647 1275 583 1400 -1196 -822 -1902 -212 -2359 -824 -2370 -1331 -1252 -1648 -3010 -1278 -1075 -1031 -139 823 1825 2724 2096 939 -1059 -704 -2707 753 1566 -3 1207 1096 -1501 -2784 -1181 -518 -2570 -1665 -2462 323 168 1423 5293 884 1398 -1795 -633 305 846 -786 1055 -1013 536 872 -234 88 1294 1177 -393 1961 279 -1182 -1082 -781 -949 1184 -183 -1370 468 1564 722 67 -142 -2255 93 SS 20240628T112627.2Z 8945.476703 220 1 51.71 2 72.36 74.06 41.32 196.18 0.00 1 0.00 1 0 17 6.438e-02 7.977e-03 6.300e-03 7.205e-04 4.283138e-01 3.828626e-04 4.965325e-03 -6.000000e+00 3.925388e-02 232.83 -2.00 3.48 -2.00 318.81 0.00e+00 1.630294e-03 8.746519e-05 1.108679e-03 -6.000000e+00 1.753468e-03 288.93 -2.00 20.00 -2.00 317.97 0.00e+00 3.253 0.001 302.00 328.00 3 1.9547e+00 1.0641e-03 3.9683e-02 -6.0000e+00 9.8401e-02 -2.4542e-03 1.2231e-03 2.2707e-02 -6.0000e+00 1.0624e-01 -1.8309e-02 8.3370e-04 1.1040e-02 -6.0000e+00 6.3329e-02 7.1723e-04 4.2880e-04 3.0632e-03 -6.0000e+00 2.6247e-02 1.7597e-03 1.0393e-04 2.2461e-05 3.8756e-05 -6.0000e+00 1.9956e-03 1.7745e-03 1.3366e-05 11 9 0 11 8 0 99.77 23.53 0.47 0.00177 0.00256 215 35 1 5 0 240.490 26.21 20.00 23.53 27.92 4.4 1015.68 -29563 -19241 -10047 -17765 -21211 -24550 -24873 -23881 -19191 -15363 -15020 -16292 -13592 -12530 -5952 -3385 -3120 -2012 -1082 -2611 647 -245 160 -786 -824 -1534 -2978 -4021 -4421 -2599 -2218 -1876 322 -2559 -3906 -4948 -4134 -1772 199 -54 -54 324 660 1021 783 1520 723 303 -196 588 936 1368 1534 2177 1385 1518 764 197 25 672 1306 2161 2495 2361 1280 359 65 -51 717 1271 1055 1071 791 360 -169 -1114 -1847 -2288 -2162 -1837 -1751 -1882 -2064 -1670 -647 -232 450 844 770 600 367 -62 -805 -565 -508 -77 336 537 173 -371 -1144 -1718 -1148 -704 -993 -1063 -667 -198 566 861 936 585 358 -141 -190 70 107 421 543 430 493 633 718 684 530 26 -72 156 214 -70 -284 -601 -349 -74 -19 92 430 494 129 99 -366 -632 -788 -972 -654 -332 -624 -721 -837 -893 -945 -809 -672 -686 -813 -766 -839 -445 -284 -288 -198 -113 -289 72 -28 19 -98 -110 -216 -432 -574 -615 -363 -339 -322 60 -469 -716 -916 -824 -402 53 -17 -17 112 237 374 291 566 272 115 -76 235 400 633 706 1065 717 812 421 109 14 366 732 1296 1523 1558 873 239 42 -33 496 914 833 886 656 288 -126 -817 -1264 -1546 -1562 -1403 -1521 -1715 -2044 -1651 -677 -243 494 951 867 653 396 -63 -820 -575 -522 -84 409 689 224 -481 -1487 -2079 -1383 -859 -1226 -1392 -873 -273 793 1299 1437 925 557 -220 -277 102 157 612 835 662 765 965 1112 1019 754 37 -101 225 317 -108 -470 -997 -601 -128 -35 169 811 948 247 184 -683 -1139 -1403 SS 20240628T113613.7Z 8945.483492 223 1 51.61 2 70.54 75.44 41.84 199.70 0.00 1 0.00 1 0 17 4.653e-02 7.493e-03 4.974e-03 6.145e-04 3.947421e-01 3.265608e-04 4.579279e-03 -6.000000e+00 2.837273e-02 232.83 -2.00 3.48 -2.00 318.73 0.00e+00 1.503499e-03 7.277683e-05 9.216122e-04 -6.000000e+00 1.267340e-03 288.93 -2.00 20.00 -2.00 317.89 0.00e+00 2.967 0.000 302.00 328.00 3 1.8410e+00 9.0293e-04 3.6290e-02 -6.0000e+00 7.1125e-02 1.1040e-03 1.0351e-03 2.0816e-02 -6.0000e+00 7.6791e-02 -1.0516e-02 6.9749e-04 1.0115e-02 -6.0000e+00 4.5773e-02 -3.9329e-03 3.5836e-04 2.8153e-03 -6.0000e+00 1.8973e-02 2.6952e-03 1.5023e-04 1.9459e-05 3.4673e-05 -6.0000e+00 1.4422e-03 1.4648e-03 3.2121e-05 11 8 0 10 0 0 99.99 23.54 0.47 0.00146 0.00259 625 102 1 5 0 82.570 26.32 20.00 23.54 28.82 4.4 1022.65 -16835 -14619 -8682 -16556 -16360 -17301 -14243 -16015 -13707 -11945 -14309 -13124 -10009 -6691 -4301 -3272 -1972 -659 -353 -908 1441 -606 797 -759 -1149 -866 -2279 -2756 -2588 -2717 -1493 -345 283 -2556 -4288 -4371 -3770 -2027 -289 -427 -357 222 282 547 573 980 890 -255 104 484 723 1132 1558 1757 1079 1436 798 228 -19 451 1142 2128 2528 2257 1286 210 -180 -292 947 1324 1080 1030 947 364 -179 -1096 -1747 -2029 -2071 -1693 -1847 -1790 -1939 -1690 -783 -195 450 888 756 622 534 -107 -504 -574 -556 -120 393 558 181 -453 -1115 -1577 -998 -564 -972 -1076 -559 -299 519 908 827 506 323 -84 -207 -140 91 355 532 448 459 600 558 559 467 -4 -36 131 143 -28 -290 -453 -298 -11 35 64 367 439 227 138 -278 -638 -829 -574 -555 -329 -667 -613 -631 -527 -670 -624 -575 -734 -711 -603 -464 -344 -296 -193 -68 -39 -105 167 -73 97 -100 -161 -126 -341 -403 -365 -389 -229 -59 52 -512 -859 -874 -811 -498 -76 -132 -123 81 107 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