File name: Pandora257s1_AustinTX_20250516_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20250517T063456.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Paul Walter Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 257 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora257_OF_v3d20221216.txt Instrument calibration file used: Pandora257s1_CF_v2d20230110.txt Level 1 file used: Pandora257s1_AustinTX_20250516_L1_smca1c2d20230110p1-8.txt Full location name: St. Edward's University Short location name: AustinTX Country of location: United States Location latitude [deg]: 30.2285 Location longitude [deg]: -97.7544 Location altitude [m]: 205 Local noon date: 20250516 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 clearance session 1 First and last pixel inside fitting window: 228 370 Nominal wavelengths inside fitting window [nm]: 305.0779 305.2183 305.3587 305.4991 305.6395 305.7799 305.9203 306.0607 306.2010 306.3413 306.4817 306.6220 306.7623 306.9026 307.0429 307.1832 307.3234 307.4637 307.6039 307.7442 307.8844 308.0246 308.1648 308.3050 308.4452 308.5854 308.7255 308.8657 309.0058 309.1459 309.2860 309.4261 309.5662 309.7063 309.8464 309.9865 310.1265 310.2665 310.4066 310.5466 310.6866 310.8266 310.9666 311.1065 311.2465 311.3865 311.5264 311.6663 311.8062 311.9461 312.0860 312.2259 312.3658 312.5057 312.6455 312.7854 312.9252 313.0650 313.2048 313.3446 313.4844 313.6242 313.7639 313.9037 314.0434 314.1832 314.3229 314.4626 314.6023 314.7420 314.8816 315.0213 315.1610 315.3006 315.4402 315.5799 315.7195 315.8591 315.9986 316.1382 316.2778 316.4173 316.5569 316.6964 316.8359 316.9754 317.1149 317.2544 317.3939 317.5334 317.6728 317.8123 317.9517 318.0911 318.2305 318.3699 318.5093 318.6487 318.7880 318.9274 319.0667 319.2061 319.3454 319.4847 319.6240 319.7633 319.9025 320.0418 320.1810 320.3203 320.4595 320.5987 320.7379 320.8771 321.0163 321.1555 321.2946 321.4338 321.5729 321.7121 321.8512 321.9903 322.1294 322.2685 322.4075 322.5466 322.6856 322.8247 322.9637 323.1027 323.2417 323.3807 323.5197 323.6587 323.7976 323.9366 324.0755 324.2144 324.3533 324.4922 324.6311 324.7700 324.9089 --------------------------------------------------------------------------------------- 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 20250516T150345.7Z 9267.627613 317 1 55.44 2 47.14 91.15 98.10 241.71 0.00 1 0.00 1 0 17 5.912e-02 2.388e-02 1.214e-02 5.094e-03 1.585900e-01 2.820432e-03 1.727853e-03 -6.000000e+00 3.802753e-02 230.92 -2.00 3.25 -2.00 316.69 0.00e+00 -7.484305e-04 3.628892e-04 2.182408e-04 -6.000000e+00 1.744988e-03 288.93 -2.00 20.00 -2.00 315.83 0.00e+00 1.468 0.000 302.00 328.00 3 7.4035e+00 7.4176e-03 1.6160e-02 -6.0000e+00 9.4821e-02 -7.5431e-02 8.2812e-03 7.5322e-03 -6.0000e+00 1.0223e-01 7.1790e-02 4.7841e-03 3.6212e-03 -6.0000e+00 6.1007e-02 -3.1621e-02 2.1579e-03 1.0061e-03 -6.0000e+00 2.5215e-02 6.8249e-05 1.8363e-03 1.8485e-04 1.5434e-05 -6.0000e+00 2.1377e-03 2.3199e-02 8.8437e-05 12 9 8 11 40 0 99.98 28.35 0.69 0.02320 0.03700 36 3 2 5 0 1539.910 36.25 20.00 28.35 33.56 0.0 987.39 -3080 -3018 -4525 21850 -23548 -13043 -9602 -4308 1210 -4052 10944 -9062 3626 19402 12823 -3346 -3016 -11858 10179 10229 17272 -2674 15430 3895 5064 -4920 -9747 2743 -2811 5799 -346 3349 -6712 3450 -8570 26074 -9249 -1260 255 993 2123 -968 4454 -4286 -2833 -4934 -5725 3245 -62 3423 3475 8251 -300 4389 -2259 -1808 -2512 175 1871 -717 -877 -730 6857 -675 -4306 -3949 3805 1959 -1577 3163 545 1391 -2190 588 1379 3014 4553 -4637 80 -2633 -2149 -1357 -5118 -2366 1119 -1234 292 534 154 1043 -2538 -257 2263 811 678 3856 1325 319 -1877 -1748 553 -1578 3046 927 1829 -2036 25 1166 -405 1630 463 -162 -627 2198 -20 -787 322 -1433 -1532 -995 387 -1011 -1873 3766 -1502 330 1365 -1419 536 -1101 -1293 -1067 2290 961 -913 -127 -851 1473 1086 2299 -528 -2355 -189 -483 -491 -738 2605 -4200 -2079 -1561 -794 226 -827 1968 -2080 791 3961 3032 -986 -920 -4070 2882 2968 4753 -913 4515 1331 1774 -1926 -3922 931 -963 1792 -116 1123 -2564 1193 -3312 7331 -4066 -588 135 588 1342 -600 2942 -2828 -1834 -3217 -4036 2033 -40 2112 2215 5259 -218 3161 -1786 -1450 -2049 139 1459 -581 -738 -588 5927 -584 -3778 -3580 3017 1564 -1369 2841 490 1287 -2103 532 1274 2512 3447 -3704 62 -2294 -2043 -1388 -5281 -2522 1228 -1475 361 676 195 1259 -2967 -270 2369 836 721 4275 1492 390 -2432 -2235 660 -1829 3621 1052 2178 -2665 34 1621 -596 2455 725 -255 -949 3025 -27 -982 394 -1851 -2101 -1436 568 -1507 -2760 5044 -2018 457 1802 -1923 737 -1461 -1786 -1510 3207 1411 -1432 -207 -1444 2496 1859 3837 -886 -3931 -305 SS 20250516T154842.7Z 9267.658828 345 1 56.01 2 37.46 97.63 106.47 246.39 0.00 1 0.00 1 0 17 3.363e-02 1.770e-02 7.175e-03 3.840e-03 1.277286e-01 2.119088e-03 1.407206e-03 -6.000000e+00 2.159766e-02 230.92 -2.00 3.25 -2.00 316.11 0.00e+00 -8.427923e-05 2.401794e-04 1.287089e-04 -6.000000e+00 9.926137e-04 288.93 -2.00 20.00 -2.00 315.28 0.00e+00 1.259 0.000 302.00 328.00 3 7.2964e+00 5.5319e-03 1.3689e-02 -6.0000e+00 5.3850e-02 -9.0899e-02 6.1570e-03 6.1401e-03 -6.0000e+00 5.8082e-02 6.8610e-02 3.5073e-03 2.9315e-03 -6.0000e+00 3.4660e-02 -2.6640e-02 1.5339e-03 8.1015e-04 -6.0000e+00 1.4305e-02 9.9265e-05 1.1469e-03 1.3834e-04 1.3724e-05 -6.0000e+00 1.2158e-03 2.6875e-02 -1.2578e-04 12 9 9 12 1 1 99.99 28.46 1.26 0.02687 0.03549 13 1 3 5 0 4000.000 36.25 20.00 28.46 34.97 0.0 997.41 -3576 -7762 -2887 12846 -11986 -5224 -5938 -3512 3652 2822 -3487 -9175 -830 2997 5747 -4068 1466 7423 4759 3236 11326 96 7640 2527 2207 -2618 14 2574 -2736 1966 -562 1561 -5025 5 -8018 10857 -7655 -1340 321 -442 1497 -2807 1362 -1240 -938 -3321 -5423 925 -44 -121 2979 4723 -113 2889 -532 369 -1463 -492 2646 465 766 -163 5591 -641 -3469 -2509 3863 -279 415 2057 122 1679 -906 401 1160 1354 2730 -4845 -455 -1021 -1969 -871 -4227 -1740 -226 -1653 -336 783 -95 575 -758 -141 1993 630 1377 3335 1551 -94 -1467 -848 230 -821 711 694 964 -624 -545 972 -357 1958 746 -590 -500 1377 -269 -414 -372 -382 -89 -851 -140 -1498 -464 2511 -1165 489 596 -199 808 -578 -1221 -1040 1095 526 -365 -440 -283 509 2132 2169 -844 -2430 109 -774 -1805 -690 2482 -2810 -1133 -1363 -850 874 701 -937 -2714 -243 918 1844 -1516 534 2610 1761 1242 4067 39 2947 1062 959 -1201 6 1042 -1114 748 -222 625 -2199 2 -3564 4110 -3830 -721 195 -276 984 -2010 955 -897 -673 -2402 -3895 604 -31 -86 2114 3442 -82 2103 -411 287 -1166 -388 2024 369 629 -143 4834 -600 -3245 -2181 2966 -220 342 1803 117 1640 -909 384 1033 1213 2222 -4089 -378 -919 -1778 -842 -4506 -1919 -261 -2067 -436 1028 -125 726 -904 -153 1965 610 1362 3471 1785 -118 -1929 -1093 281 -961 804 809 1189 -828 -757 1387 -494 2746 1083 -860 -697 1918 -352 -516 -460 -490 -121 -1236 -209 -2267 -681 3440 -1575 619 726 -244 1010 -764 -1680 -1463 1539 769 -563 -711 -432 790 3281 3595 -1411 -4039 175 SS 20250516T160025.2Z 9267.666958 354 1 4.74 2 34.96 99.62 108.70 247.53 0.00 1 0.00 1 0 17 7.414e-03 6.031e-03 2.694e-03 2.036e-03 1.528968e-01 1.158856e-03 1.701210e-03 -6.000000e+00 4.764419e-03 230.92 -2.00 3.25 -2.00 314.45 0.00e+00 1.405242e-04 9.432024e-05 1.433344e-05 -6.000000e+00 2.188393e-04 288.93 -2.00 20.00 -2.00 313.81 0.00e+00 1.219 0.000 302.00 328.00 3 4.2743e+00 2.9711e-03 1.4000e-02 -6.0000e+00 1.1880e-02 3.9513e-03 3.2762e-03 7.3277e-03 -6.0000e+00 1.2811e-02 4.3256e-03 1.8737e-03 3.5459e-03 -6.0000e+00 7.6451e-03 -5.0532e-03 7.8273e-04 9.7221e-04 -6.0000e+00 3.1570e-03 1.9797e-03 3.3112e-04 7.2485e-05 1.7646e-05 -6.0000e+00 2.6806e-04 2.5675e-02 -3.9979e-05 12 1 1 12 1 1 99.90 28.50 0.27 0.02567 0.02816 7 9 1 5 0 591.760 36.25 20.00 28.50 35.35 0.0 1000.01 377 -1019 -1760 -1641 -2443 -848 925 444 967 -315 -1272 -890 690 259 876 -686 58 263 938 1353 747 814 1713 639 1020 -205 175 -550 274 881 879 882 614 -404 -2107 -510 -670 -514 -81 -714 -970 -673 -843 -1312 -551 -599 -849 -719 -314 -228 915 700 654 895 196 512 1206 483 59 768 882 915 1143 1024 313 -570 107 163 787 1067 132 224 3 464 -134 -163 -154 -546 -244 -339 -1274 -1405 -1826 -1511 -1009 -457 -302 76 84 0 -7 25 39 671 726 729 74 446 162 -660 -292 -69 -494 320 253 -901 -679 -185 -235 625 217 -79 -123 285 -143 -90 127 72 582 116 -280 6 -45 415 527 593 281 818 881 221 153 -61 -191 -84 172 -18 -373 161 97 86 -299 -462 -777 147 -416 -710 -625 -950 -318 355 171 393 -133 -551 -399 326 125 455 -358 31 144 520 762 428 470 997 388 634 -122 108 -324 152 477 483 501 359 -238 -1245 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