File name: Pandora55s1_QueensNY_20201222_L2Fit_fout2c10d20200414p1-8.txt File generation date: 20260625T173151.4Z Data description: Level 2 spectral fitting results file Data file version: fout2c10p1-8 Local principal investigator: James Szykman Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora55_OF_v3d20190723.txt Instrument calibration file used: Pandora55s1_CF_v10d20200414.txt Level 1 file used: Pandora55s1_QueensNY_20201222_L1_smca1c10d20200414p1-8.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: 20201222 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: 262 404 Nominal wavelengths inside fitting window [nm]: 305.1379 305.2779 305.4179 305.5579 305.6978 305.8378 305.9778 306.1177 306.2576 306.3976 306.5375 306.6774 306.8172 306.9571 307.0970 307.2369 307.3767 307.5165 307.6564 307.7962 307.9360 308.0758 308.2156 308.3553 308.4951 308.6349 308.7746 308.9143 309.0541 309.1938 309.3335 309.4732 309.6128 309.7525 309.8922 310.0318 310.1715 310.3111 310.4507 310.5903 310.7299 310.8695 311.0091 311.1486 311.2882 311.4277 311.5673 311.7068 311.8463 311.9858 312.1253 312.2648 312.4043 312.5437 312.6832 312.8226 312.9621 313.1015 313.2409 313.3803 313.5197 313.6591 313.7984 313.9378 314.0771 314.2165 314.3558 314.4951 314.6344 314.7737 314.9130 315.0523 315.1915 315.3308 315.4700 315.6092 315.7485 315.8877 316.0269 316.1661 316.3052 316.4444 316.5836 316.7227 316.8618 317.0010 317.1401 317.2792 317.4183 317.5574 317.6964 317.8355 317.9745 318.1136 318.2526 318.3916 318.5306 318.6696 318.8086 318.9476 319.0866 319.2255 319.3645 319.5034 319.6423 319.7812 319.9201 320.0590 320.1979 320.3368 320.4756 320.6145 320.7533 320.8922 321.0310 321.1698 321.3086 321.4474 321.5861 321.7249 321.8636 322.0024 322.1411 322.2798 322.4185 322.5572 322.6959 322.8346 322.9733 323.1119 323.2506 323.3892 323.5278 323.6665 323.8051 323.9436 324.0822 324.2208 324.3594 324.4979 324.6364 324.7750 324.9135 --------------------------------------------------------------------------------------- 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 20201222T140042.4Z 7661.583824 102 1 46.80 2 75.76 139.46 128.12 52.09 0.00 1 0.00 1 0 25 3.136e-01 2.246e-02 6.485e-02 4.098e-03 5.098876e-01 2.162786e-03 5.986319e-03 -6.000000e+00 1.850592e-01 223.05 -2.00 3.51 -2.00 319.80 0.00e+00 5.176208e-04 6.598455e-04 8.904491e-04 -6.000000e+00 8.325951e-03 276.75 -2.00 20.00 -2.00 319.24 0.00e+00 3.979 0.001 302.00 328.00 3 3.5580e+00 6.1318e-03 4.7300e-02 -6.0000e+00 4.5534e-01 9.6516e-02 7.3765e-03 2.6530e-02 -6.0000e+00 4.9632e-01 -1.0220e-01 6.2225e-03 1.3470e-02 -6.0000e+00 2.9390e-01 4.2680e-02 3.2153e-03 3.9435e-03 -6.0000e+00 1.2483e-01 1.6008e-04 -1.1739e-03 1.2567e-04 5.0504e-05 -6.0000e+00 9.6071e-03 1.2854e-02 8.8306e-06 12 9 9 12 33 1 99.70 22.78 0.59 0.01285 0.00403 13 3 1 5 0 3329.600 25.68 19.99 22.78 11.11 26.6 1071.36 -67699 900000 -135512 -16467 900000 -53379 900000 -54448 21967 -93022 -17620 -112552 -8532 900000 -24547 62140 103052 127828 83611 143883 18480 2795 -34898 16950 -5896 27886 -25228 -22445 -10467 -416 20956 -13569 -24388 -8319 99891 -15545 -9487 36617 20099 -4854 -2394 -10314 -1097 5344 16390 -2325 18318 7292 9996 859 -637 -5411 12277 12966 1516 14580 4254 9300 2950 1536 10027 1041 4141 4967 -6909 8044 1267 7589 1751 -3885 -742 4656 -4206 -558 -2618 -675 6892 -849 509 -3519 4664 -3335 -526 -4921 -906 -3213 -1440 -3238 -1030 -1559 -1859 652 1141 -395 1470 -1770 -611 -1300 -1616 -436 -401 -408 2454 1007 -680 -213 820 44 2396 257 -1687 669 62 -468 261 1469 2433 224 197 -1400 -573 764 2534 -851 1096 -509 1461 -315 -737 938 270 1062 67 1104 -518 -41 -34 69 -1075 -75 -737 -172 -548 -1770 900000 -7273 -269 900000 -1217 900000 -1565 333 -4439 -440 -7850 -269 900000 -1269 1586 1934 2025 2140 2139 921 164 -3083 992 -457 1614 -2374 -1998 -834 -32 1508 -1530 -3301 -989 4214 -1989 -1283 3835 2905 -1008 -532 -2588 -262 1217 3407 -576 3801 1699 2348 231 -188 -1816 3775 4218 568 5045 1631 3394 1120 590 3710 452 1914 2434 -3808 3808 624 3629 959 -2451 -489 3013 -2894 -357 -1597 -373 3386 -450 289 -2319 3216 -2678 -441 -4479 -839 -3183 -1459 -3393 -1057 -1559 -1777 579 974 -346 1362 -1848 -696 -1611 -2108 -563 -498 -473 2673 1118 -797 -261 1035 58 3295 381 -2681 1076 100 -734 392 2121 3481 335 305 -2261 -924 1204 3869 -1297 1605 -732 2024 -449 -1114 1501 457 1857 121 2052 -1008 -83 -69 142 -2242 -152 -1465 -328 -1034 SS 20201222T141552.4Z 7661.594357 108 1 50.89 2 73.96 142.54 125.84 55.67 0.00 1 0.00 1 0 25 2.103e-01 1.109e-02 5.027e-02 2.062e-03 4.660046e-01 1.062620e-03 5.518213e-03 -6.000000e+00 1.226404e-01 223.05 -2.00 3.51 -2.00 319.20 0.00e+00 1.502382e-04 2.710211e-04 2.389662e-04 -6.000000e+00 5.402902e-03 276.74 -2.00 20.00 -2.00 318.62 0.00e+00 3.557 0.001 302.00 328.00 3 2.9616e+00 2.9266e-03 4.2475e-02 -6.0000e+00 3.0178e-01 4.4651e-02 3.4115e-03 2.3786e-02 -6.0000e+00 3.2854e-01 -2.9164e-02 2.6547e-03 1.1977e-02 -6.0000e+00 1.9576e-01 6.5612e-03 1.3997e-03 3.4872e-03 -6.0000e+00 8.3108e-02 4.6197e-04 -9.5580e-04 6.2693e-05 4.3284e-05 -6.0000e+00 6.3091e-03 1.2680e-02 -1.8783e-05 12 8 8 10 0 0 99.67 22.78 0.24 0.01268 0.00550 34 6 1 5 0 1496.290 25.68 20.00 22.78 11.12 26.7 1071.92 -24341 170595 -63239 -12602 20699 -33663 121481 -25540 -12660 -37334 -16346 -46153 -8305 45411 -7925 -19720 9706 20638 6548 16696 4216 -4274 -10679 -15055 -3417 16959 -12515 -10001 -4255 -710 6910 -3903 -11173 -596 18872 -4667 -6760 10205 3292 -4583 -3075 -4733 -2228 139 3907 -2965 3757 234 3397 -597 -7 -1404 4437 4177 1419 4224 2066 2378 757 2676 3483 2570 -1908 1428 -1903 2953 -725 3870 1366 -1547 150 834 -1425 293 -812 68 2473 836 212 -1035 694 -1766 -1927 -2171 -1252 -1291 -1049 -1406 -696 -243 -320 850 1368 1215 1911 24 551 -445 -1259 -550 -331 -112 1071 552 -867 -737 -548 35 974 -75 -796 -204 -95 -179 536 980 1610 604 -28 -1180 -555 -31 391 -94 296 351 1402 603 199 749 191 583 -2 410 -522 107 -36 -273 -650 -16 -289 -158 -231 -629 761 -2530 -299 343 -957 900 -842 -404 -1576 -604 -2547 -384 1523 -506 -1554 631 1292 492 1182 341 -382 -1068 -1693 -367 1554 -1488 -1125 -452 -77 787 -554 -1821 -90 2336 -736 -1213 1857 748 -1266 -909 -1489 -705 44 1201 -970 1166 76 1099 -209 -3 -574 1840 1828 659 1980 1000 1142 363 1266 1697 1355 -1125 866 -1201 1740 -431 2264 877 -1108 113 638 -1101 215 -567 44 1488 511 139 -763 556 -1555 -1798 -2118 -1266 -1366 -1147 -1567 -770 -261 -329 821 1276 1145 1897 26 652 -569 -1685 -732 -423 -135 1233 645 -1064 -939 -722 48 1382 -113 -1262 -330 -152 -279 801 1418 2312 894 -43 -1883 -889 -49 604 -142 436 504 1957 857 297 1184 316 996 -3 737 -978 207 -71 -542 -1296 -30 -553 -293 -423 SS 20201222T142644.9Z 7661.601908 111 1 45.73 2 72.74 144.81 124.15 58.11 0.00 1 0.00 1 0 25 1.700e-01 1.130e-02 3.301e-02 2.214e-03 4.369858e-01 1.137717e-03 5.204960e-03 -6.000000e+00 9.913743e-02 223.05 -2.00 3.51 -2.00 318.91 0.00e+00 5.132894e-04 2.637858e-04 2.191620e-04 -6.000000e+00 4.367575e-03 276.74 -2.00 20.00 -2.00 318.31 0.00e+00 3.321 0.001 302.00 328.00 3 3.2293e+00 3.0949e-03 3.9697e-02 -6.0000e+00 2.4395e-01 4.7174e-02 3.5681e-03 2.2277e-02 -6.0000e+00 2.6558e-01 -2.9488e-02 2.6312e-03 1.1171e-02 -6.0000e+00 1.5824e-01 7.1383e-03 1.3886e-03 3.2735e-03 -6.0000e+00 6.7181e-02 4.5730e-04 -8.9882e-04 6.7555e-05 4.0217e-05 -6.0000e+00 5.1002e-03 1.2458e-02 -3.0488e-05 12 9 9 12 1 1 80.97 22.78 0.25 0.01246 0.00570 24 5 1 5 0 1821.600 25.68 20.00 22.78 11.36 26.6 1073.36 -21402 145991 -54429 -13038 41360 -16936 68668 -24233 -6961 -38782 3149 -42064 -2492 34045 2109 -13556 -10537 15986 14185 18704 1388 -2062 -8696 -9493 -2858 16637 -11238 -6717 -5595 -1533 5435 -4193 -10010 -6454 17432 -5550 -3419 8428 3188 -3956 -2742 -3615 -1308 11 4219 -1518 3125 1555 1935 978 686 -876 3406 3774 1360 3524 646 2304 1177 1051 3717 1153 -3000 1477 -2455 3043 -245 4254 1038 -793 -262 521 412 690 -752 343 2516 443 76 -931 356 -2146 -1249 -2499 -1328 -1631 -744 -1510 -907 -398 -459 791 1212 1568 1296 37 240 -651 -941 -540 -515 -307 1186 487 -704 -287 -535 272 905 -98 -643 102 -193 -77 449 938 1136 369 -71 -1096 -757 281 351 139 395 94 1256 609 338 547 358 596 165 612 -340 201 37 -317 -736 -134 -455 -417 -127 -735 1125 -2717 -420 762 -552 1111 -1050 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