File name: Pandora55s1_QueensNY_20220319_L2Fit_fout2c19d20211111p1-8.txt File generation date: 20250606T115130.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c19p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora55_OF_v4d20190723.txt Instrument calibration file used: Pandora55s1_CF_v19d20211111.txt Level 1 file used: Pandora55s1_QueensNY_20220319_L1_smca1c19d20211111p1-8.txt Full location name: Queens College NYSDEC (USEPA AQS ID 36-081-0124) Short location name: QueensNY Country of location: USA Location latitude [deg]: 40.7361 Location longitude [deg]: -73.8215 Location altitude [m]: 25 Local noon date: 20220319 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: None First and last pixel inside fitting window: 261 404 Nominal wavelengths inside fitting window [nm]: 305.0379 305.1778 305.3178 305.4578 305.5977 305.7376 305.8776 306.0175 306.1574 306.2973 306.4372 306.5770 306.7169 306.8567 306.9966 307.1364 307.2762 307.4160 307.5558 307.6956 307.8354 307.9752 308.1149 308.2547 308.3944 308.5341 308.6738 308.8135 308.9532 309.0929 309.2326 309.3723 309.5119 309.6515 309.7912 309.9308 310.0704 310.2100 310.3496 310.4892 310.6287 310.7683 310.9079 311.0474 311.1869 311.3264 311.4659 311.6054 311.7449 311.8844 312.0239 312.1633 312.3028 312.4422 312.5816 312.7210 312.8604 312.9998 313.1392 313.2786 313.4179 313.5573 313.6966 313.8360 313.9753 314.1146 314.2539 314.3932 314.5324 314.6717 314.8110 314.9502 315.0895 315.2287 315.3679 315.5071 315.6463 315.7855 315.9246 316.0638 316.2030 316.3421 316.4812 316.6204 316.7595 316.8986 317.0377 317.1767 317.3158 317.4549 317.5939 317.7329 317.8720 318.0110 318.1500 318.2890 318.4280 318.5669 318.7059 318.8449 318.9838 319.1227 319.2617 319.4006 319.5395 319.6784 319.8172 319.9561 320.0950 320.2338 320.3726 320.5115 320.6503 320.7891 320.9279 321.0667 321.2054 321.3442 321.4830 321.6217 321.7604 321.8991 322.0379 322.1766 322.3152 322.4539 322.5926 322.7312 322.8699 323.0085 323.1471 323.2857 323.4243 323.5629 323.7015 323.8401 323.9786 324.1172 324.2557 324.3943 324.5328 324.6713 324.8098 324.9483 --------------------------------------------------------------------------------------- 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 100-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-387: 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 20220319T134018.3Z 8113.569656 307 1 5.63 2 61.63 118.44 110.40 283.46 0.00 1 0.00 1 0 25 2.518e-02 9.708e-03 1.855e-02 6.770e-03 2.818284e-01 3.504462e-03 3.451992e-03 -6.000000e+00 1.482430e-02 226.49 -2.00 3.51 -2.00 316.90 0.00e+00 1.930343e-04 4.533016e-04 6.416977e-05 -6.000000e+00 6.465458e-04 277.51 -2.00 20.00 -2.00 316.27 0.00e+00 2.094 0.000 302.00 328.00 3 4.2537e+00 9.1561e-03 2.5410e-02 -6.0000e+00 3.6750e-02 2.2737e-02 1.0262e-02 1.4508e-02 -6.0000e+00 3.9927e-02 3.2786e-04 6.0635e-03 7.1669e-03 -6.0000e+00 2.3754e-02 -1.9302e-03 2.8963e-03 2.0133e-03 -6.0000e+00 9.9318e-03 6.5724e-04 -1.5847e-03 2.0789e-04 2.6844e-05 -6.0000e+00 7.5154e-04 -4.2829e-03 -9.4164e-05 12 9 9 12 33 1 999.00 22.67 0.44 -0.00428 -0.01619 1 3 1 5 0 2724.850 25.68 20.00 22.67 19.14 31.5 1100.00 -423 -8976 -2295 -5118 -11946 8552 -3820 11232 4789 -3622 -4408 -2324 -4507 2767 5693 5104 794 2597 2883 5065 5385 805 -1167 -2348 1491 -2230 -63 -999 -68 -2028 1155 5435 -25 -674 494 867 -2592 -1322 330 234 -2421 -445 -1768 -1006 -1233 -2762 -2749 211 -179 -553 518 -2220 148 1204 3226 1407 4 1976 1269 1143 427 3020 929 -1139 -1015 -613 13 282 1862 1502 225 -1791 342 -885 415 159 704 1084 2088 288 -372 185 -1220 -45 -923 985 -1542 -1192 -572 -34 -185 -1021 753 1714 1287 1734 426 -93 764 -1175 -55 -1224 -906 702 -1605 -786 -103 -638 -51 76 202 -443 157 -350 -154 608 1098 1443 -101 -350 -730 -458 -594 320 245 706 1249 1572 1002 484 432 -684 -39 -850 183 292 -22 291 -424 -641 41 -372 -165 171 -52 -1301 -324 -720 -1667 941 -481 1352 676 -583 -727 -385 -824 535 1209 1194 204 684 783 1396 1510 237 -352 -739 478 -765 -22 -333 -22 -638 361 1746 -9 -253 182 311 -980 -545 153 122 -1402 -268 -1105 -634 -780 -1770 -1751 130 -109 -339 322 -1466 101 845 2307 1038 3 1486 954 854 322 2313 759 -988 -901 -537 11 227 1492 1277 207 -1743 334 -866 391 143 591 864 1637 238 -334 178 -1244 -48 -1013 1109 -1834 -1459 -707 -42 -221 -1177 813 1766 1323 1849 486 -113 977 -1562 -71 -1552 -1099 825 -1953 -989 -134 -853 -70 107 296 -669 238 -521 -221 831 1453 1902 -137 -495 -1067 -678 -874 462 346 969 1662 2037 1311 656 610 -1001 -57 -1286 281 462 -36 481 -711 -1082 68 -609 -264 270 SS 20220319T135333.4Z 8113.578859 316 1 30.70 2 59.45 121.31 112.78 285.74 0.00 1 0.00 1 0 25 3.320e-02 1.014e-02 7.533e-03 2.870e-03 2.671210e-01 1.485496e-03 3.202368e-03 -6.000000e+00 1.957994e-02 226.49 -2.00 3.51 -2.00 316.80 0.00e+00 -3.783022e-05 1.878887e-04 6.080458e-05 -6.000000e+00 8.527508e-04 277.51 -2.00 20.00 -2.00 316.18 0.00e+00 1.959 0.000 302.00 328.00 3 4.8941e+00 3.8764e-03 2.3792e-02 -6.0000e+00 4.8542e-02 4.6655e-02 4.3462e-03 1.3570e-02 -6.0000e+00 5.2705e-02 -2.3345e-03 2.5566e-03 6.6925e-03 -6.0000e+00 3.1360e-02 -3.2027e-03 1.2108e-03 1.8882e-03 -6.0000e+00 1.3133e-02 4.0076e-04 5.3511e-04 8.8312e-05 2.4269e-05 -6.0000e+00 9.9023e-04 -7.1034e-03 2.8086e-04 12 9 9 12 33 1 99.98 22.67 0.55 -0.00710 -0.00308 8 3 1 5 0 3391.240 25.68 19.99 22.67 20.31 31.5 1100.00 689 -3057 -6331 -15459 -1688 9739 -12913 15052 1271 -1130 -7954 -3875 -4929 -303 9421 -1200 3513 15567 3449 3555 163 -1955 -379 -4783 -1577 -990 -186 239 -3232 -664 -1545 2217 810 -4573 -2425 7692 -2257 -1674 2406 1022 -2215 888 -2644 -1004 -575 415 -2695 1171 -229 1544 -158 -1319 -239 2129 2120 1499 3204 826 2746 522 1467 2791 142 -820 156 -1061 869 -806 881 811 -510 -586 313 -824 821 -299 354 2050 73 -574 -1868 18 -1251 -693 -1368 -1284 -1256 -276 -683 84 -513 -128 12 757 600 847 -103 279 -278 -800 -340 -320 -259 900 398 -550 -642 -660 201 563 499 14 -52 -366 -552 -221 310 1054 330 -232 -916 -212 430 929 213 740 -34 1525 360 247 639 223 574 176 463 195 122 47 -188 -436 -496 -551 -447 -614 89 -449 -987 -2539 -227 1116 -1858 1841 195 -187 -1426 -683 -944 -63 2006 -307 913 3775 961 1021 49 -607 -117 -1583 -534 -347 -65 81 -1078 -210 -500 739 293 -1789 -923 2624 -856 -697 1110 540 -1312 542 -1698 -647 -370 265 -1745 728 -142 941 -99 -873 -165 1500 1542 1116 2409 634 2068 396 1112 2159 118 -720 139 -942 726 -655 712 695 -472 -570 308 -813 776 -271 298 1613 58 -475 -1685 18 -1278 -735 -1511 -1478 -1503 -339 -852 103 -621 -148 13 781 616 904 -118 340 -359 -1063 -446 -404 -312 1053 478 -692 -837 -884 276 797 732 22 -78 -546 -791 -302 409 1382 446 -327 -1338 -312 629 1333 299 1009 -45 1960 466 332 894 322 842 262 705 306 197 78 -313 -732 -825 -898 -712 -970 SS 20220319T141154.5Z 8113.591603 322 1 31.63 2 56.54 125.49 116.02 289.02 0.00 1 0.00 1 0 25 9.924e-03 6.394e-03 2.504e-03 1.149e-03 2.467420e-01 5.968944e-04 2.990227e-03 -6.000000e+00 5.849672e-03 226.49 -2.00 3.51 -2.00 316.35 0.00e+00 -7.666562e-05 6.776378e-05 5.352923e-05 -6.000000e+00 2.549273e-04 277.51 -2.00 20.00 -2.00 315.74 0.00e+00 1.808 0.000 302.00 328.00 3 3.4639e+00 1.5483e-03 2.1982e-02 -6.0000e+00 1.4502e-02 2.7497e-02 1.7312e-03 1.2571e-02 -6.0000e+00 1.5749e-02 -1.4529e-03 1.0028e-03 6.2082e-03 -6.0000e+00 9.3706e-03 -2.9488e-03 4.6297e-04 1.7488e-03 -6.0000e+00 3.9220e-03 2.0274e-03 -9.3672e-05 3.5377e-05 2.3436e-05 -6.0000e+00 2.9614e-04 -6.4598e-03 1.3264e-04 12 1 1 12 1 1 100.00 22.66 0.22 -0.00646 -0.00716 64 19 1 5 0 483.970 25.68 20.00 22.66 21.11 31.6 1100.00 -2233 -1350 -1037 -4447 -1223 220 -1148 4143 873 -801 -1440 611 371 -131 1962 -1224 -897 -1477 1187 1002 461 851 1171 347 284 -474 326 -492 -68 1193 1264 1471 1187 -1586 -1002 1880 63 208 1358 -679 -1570 -1025 -1393 -1067 -829 -349 -1554 -824 -867 826 647 252 551 805 1090 632 1060 98 1022 736 1662 1049 1278 251 -642 -535 211 276 1133 1124 181 -283 -449 -621 -558 -36 204 1124 1207 360 -152 -604 -1576 -1080 -1123 -932 -725 -522 -504 -563 -182 161 482 1332 1217 1369 694 606 -487 -411 -349 -646 -56 1047 -4 -608 -351 -636 -77 -11 -122 -547 -227 -30 -130 496 635 882 425 -74 -664 -376 -94 151 234 142 481 1265 735 110 555 -76 320 121 319 -231 15 74 -379 -412 -283 -153 -224 -122 -383 -251 -197 -843 -209 35 -189 713 170 -167 -305 129 84 -33 540 -375 -287 -491 397 345 163 302 415 128 109 -190 131 -193 -26 429 459 562 482 -678 -422 755 26 95 698 -397 -1002 -683 -954 -739 -574 -241 -1069 -556 -576 542 431 175 399 603 838 496 843 79 813 583 1314 857 1093 226 -594 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