File name: Pandora64s1_NewHavenCT_20231001_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20231003T051842.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 64 Spectrometer number: 1 Processing software version used: BlickP v1.8.49 Instrument operation file used: Pandora64_OF_v3d20190516.txt Instrument calibration file used: Pandora64s1_CF_v4d20190911.txt Level 1 file used: Pandora64s1_NewHavenCT_20231001_L1_smca1c4d20190911p1-8.txt Full location name: New Haven - Criscuolo Park CTDEEP (USEPA AQS ID 34-017-0006) Short location name: NewHavenCT Country of location: USA Location latitude [deg]: 41.3014 Location longitude [deg]: -72.9029 Location altitude [m]: 4 Local noon date: 20231001 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: Mod WL cal slit func 9 First and last pixel inside fitting window: 249 390 Nominal wavelengths inside fitting window [nm]: 305.1279 305.2688 305.4097 305.5506 305.6915 305.8324 305.9732 306.1141 306.2549 306.3958 306.5366 306.6774 306.8182 306.9590 307.0997 307.2405 307.3812 307.5220 307.6627 307.8034 307.9441 308.0848 308.2255 308.3662 308.5068 308.6475 308.7881 308.9287 309.0693 309.2099 309.3505 309.4911 309.6316 309.7722 309.9127 310.0533 310.1938 310.3343 310.4748 310.6153 310.7557 310.8962 311.0366 311.1771 311.3175 311.4579 311.5983 311.7387 311.8791 312.0195 312.1598 312.3002 312.4405 312.5808 312.7211 312.8614 313.0017 313.1420 313.2822 313.4225 313.5627 313.7030 313.8432 313.9834 314.1236 314.2638 314.4039 314.5441 314.6842 314.8244 314.9645 315.1046 315.2447 315.3848 315.5249 315.6649 315.8050 315.9450 316.0851 316.2251 316.3651 316.5051 316.6451 316.7850 316.9250 317.0649 317.2049 317.3448 317.4847 317.6246 317.7645 317.9044 318.0442 318.1841 318.3239 318.4638 318.6036 318.7434 318.8832 319.0230 319.1628 319.3025 319.4423 319.5820 319.7217 319.8614 320.0011 320.1408 320.2805 320.4202 320.5598 320.6995 320.8391 320.9787 321.1183 321.2579 321.3975 321.5371 321.6766 321.8162 321.9557 322.0953 322.2348 322.3743 322.5138 322.6532 322.7927 322.9322 323.0716 323.2110 323.3504 323.4899 323.6292 323.7686 323.9080 324.0474 324.1867 324.3260 324.4654 324.6047 324.7440 324.8833 --------------------------------------------------------------------------------------- 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 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: 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 20231001T122351.4Z 8674.516567 274 1 47.12 2 73.30 109.96 80.71 280.57 0.00 1 0.00 1 0 25 4.965e-02 1.031e-02 3.126e-02 3.278e-03 4.008982e-01 1.754016e-03 4.807462e-03 -6.000000e+00 2.996831e-02 227.47 -2.00 3.52 -2.00 318.92 0.00e+00 6.844228e-04 4.159829e-04 6.150844e-04 -6.000000e+00 1.340446e-03 285.74 -2.00 20.00 -2.00 318.18 0.00e+00 3.424 0.001 302.00 328.00 3 4.4712e+00 4.8236e-03 4.0083e-02 -6.0000e+00 7.4300e-02 5.7104e-02 5.5646e-03 2.1194e-02 -6.0000e+00 8.0327e-02 1.3482e-03 3.9658e-03 1.0400e-02 -6.0000e+00 4.7949e-02 -5.8997e-03 2.0733e-03 2.9104e-03 -6.0000e+00 2.0438e-02 1.2155e-04 -8.8323e-04 1.0216e-04 3.5314e-05 -6.0000e+00 1.4767e-03 6.9033e-04 -7.3206e-05 12 9 8 11 8 0 96.53 21.17 0.09 0.00069 -0.00595 12 3 1 5 0 3926.530 25.79 20.00 21.17 19.68 37.7 992.79 -14083 -14053 7166 -1455 12256 -9781 -1472 -26788 16476 780 -14108 -721 -12211 -8930 -2934 -8941 -4503 -2201 -7519 4626 9564 12222 11777 3979 -295 1558 -1086 -3638 -1881 -16255 -3754 4912 3671 -2791 -7767 2022 -2955 -3212 -558 152 -671 -349 137 -5236 62 185 268 -2271 1542 -4738 3836 2425 -26 -272 1969 140 2377 489 961 1231 263 2444 2209 3179 1751 -1341 1016 989 984 2204 635 1043 -139 391 -550 -1834 1208 -1980 -1342 230 -1212 -3348 -2330 -1575 -518 -1056 520 563 1594 1007 -440 972 -1857 -289 382 867 -787 1210 851 -1108 -765 -1743 -2310 -60 7 -1531 -700 780 -221 710 1204 331 274 736 -371 -591 564 -716 536 233 -157 -467 961 385 884 594 -1339 832 926 -104 381 -478 -567 -100 565 -45 -183 425 218 -207 -33 -1119 -464 -499 211 -43 313 -304 -46 -1226 540 31 -679 -34 -774 -615 -222 -799 -409 -210 -793 453 902 1133 1167 456 -37 200 -141 -461 -231 -2444 -558 733 614 -497 -1389 348 -606 -746 -151 47 -225 -117 47 -1914 22 65 98 -822 571 -1874 1520 1050 -13 -137 1000 71 1205 250 504 652 142 1408 1388 2102 1149 -858 627 624 664 1641 510 853 -112 297 -386 -1237 751 -1286 -966 178 -1023 -3194 -2240 -1593 -559 -1164 588 645 1782 1070 -457 930 -1818 -289 401 975 -966 1601 1119 -1483 -955 -2104 -2730 -74 8 -2044 -949 1100 -327 1120 1923 532 425 1104 -546 -848 820 -1065 839 364 -253 -736 1453 576 1268 821 -1841 1186 1387 -169 631 -823 -982 -183 1052 -87 -352 822 417 -393 -60 -2060 SS 20231001T123033.0Z 8674.521216 278 1 47.85 2 72.12 111.20 81.89 281.62 0.00 1 0.00 1 0 33 4.110e-02 8.588e-03 1.420e-02 2.202e-03 3.774587e-01 1.172434e-03 4.512893e-03 -6.000000e+00 2.480129e-02 227.47 -2.00 3.52 -2.00 318.52 0.00e+00 8.854818e-04 2.445923e-04 3.782004e-04 -6.000000e+00 1.109383e-03 285.73 -2.00 20.00 -2.00 317.77 0.00e+00 3.212 0.001 302.00 328.00 3 4.0452e+00 3.1724e-03 3.7558e-02 -6.0000e+00 6.1489e-02 5.7621e-02 3.6218e-03 1.9681e-02 -6.0000e+00 6.6478e-02 -1.3591e-02 2.4298e-03 9.6910e-03 -6.0000e+00 3.9682e-02 6.7040e-04 1.2585e-03 2.7698e-03 -6.0000e+00 1.6914e-02 2.3639e-04 -7.6917e-04 6.8474e-05 3.2666e-05 -6.0000e+00 1.2221e-03 4.3307e-04 -9.5171e-05 11 8 0 10 0 0 95.11 21.17 -0.01 0.00043 -0.00535 21 5 1 5 0 2278.420 25.79 20.00 21.17 19.87 38.0 993.80 -8288 -6287 -6333 -11200 -13013 -16342 -8759 -28071 462 -5498 -14100 -4082 -9174 -9466 4107 -738 -2514 1394 -556 -1079 1652 1763 3688 1160 -416 -784 -2164 -3650 -2726 6786 408 -191 2286 -599 -6947 -2707 -1193 -1590 2 217 1476 -645 431 -2520 135 220 365 -267 -257 -1729 1656 2360 554 1512 382 552 1312 183 297 415 604 1087 1629 2944 1550 -1112 179 -531 1302 1622 1027 796 -157 694 -255 -776 105 -2143 -932 -188 -1660 -2259 -2117 -1970 -560 -563 336 458 943 854 301 815 -1161 -265 991 277 -466 943 306 -625 -727 -1847 -2042 251 71 -1508 -362 -539 -80 610 870 237 146 202 -52 -162 352 -73 393 416 -111 59 731 203 1191 647 -1193 599 931 323 558 -481 -466 -190 808 -67 -464 392 145 -672 -138 -849 -389 -287 -318 -542 -599 -799 -434 -1760 26 -316 -902 -265 -740 -898 395 -82 -301 172 -73 -149 224 240 522 179 -68 -134 -369 -598 -435 1038 74 -38 455 -122 -1438 -569 -280 -443 1 76 547 -256 175 -1056 56 91 149 -110 -107 -767 772 1174 298 805 211 314 751 104 167 236 362 707 1144 2039 1061 -779 122 -371 940 1302 833 662 -128 564 -191 -563 71 -1507 -680 -154 -1466 -2217 -2084 -2053 -619 -627 387 532 1078 968 318 799 -1164 -273 1049 314 -590 1235 413 -820 -937 -2224 -2404 307 88 -1995 -501 -754 -119 930 1388 380 225 304 -74 -233 494 -108 589 643 -172 89 1112 295 1726 905 -1656 863 1388 497 903 -810 -782 -335 1440 -124 -882 750 276 -1236 -243 -1517 SS 20231001T123634.9Z 8674.525404 281 1 47.49 2 71.07 112.34 82.94 282.57 0.00 1 0.00 1 0 25 2.857e-02 8.173e-03 1.056e-02 1.870e-03 3.572057e-01 9.958155e-04 4.280488e-03 -6.000000e+00 1.724164e-02 227.47 -2.00 3.52 -2.00 318.26 0.00e+00 2.280053e-04 1.929413e-04 2.242508e-04 -6.000000e+00 7.711596e-04 285.73 -2.00 20.00 -2.00 317.50 0.00e+00 3.045 0.000 302.00 328.00 3 3.9507e+00 2.6809e-03 3.5589e-02 -6.0000e+00 4.2747e-02 3.7184e-02 3.0430e-03 1.8634e-02 -6.0000e+00 4.6213e-02 7.9240e-04 1.9837e-03 9.1237e-03 -6.0000e+00 2.7586e-02 -3.5605e-03 1.0209e-03 2.5555e-03 -6.0000e+00 1.1759e-02 3.1634e-04 -5.3888e-04 5.8231e-05 3.0466e-05 -6.0000e+00 8.4958e-04 3.5366e-05 -7.9802e-05 11 8 0 10 0 0 89.06 21.18 -0.02 0.00004 -0.00401 26 6 1 5 0 1826.460 25.79 20.00 21.18 20.04 37.9 994.55 -1161 -4707 -3052 -12949 -13813 -9627 -5371 -13835 7868 -3289 -7599 -2630 -2969 -4761 2425 -2733 -132 2662 -1948 1959 896 2829 3234 -700 295 -151 -158 -2584 -1173 -6928 171 1876 1077 19 -4551 -2042 -1652 -1678 -464 458 226 -718 441 -1719 65 714 -289 -162 -257 -2219 1859 1451 1038 1226 -320 1221 886 198 667 355 109 1405 1353 2818 1498 -1075 -167 -869 1053 2101 712 541 -102 137 -402 -737 -190 -2157 -896 -592 -1540 -1729 -2070 -1984 -488 -467 420 553 982 856 690 856 -973 -384 808 397 -105 1000 474 -705 -635 -1730 -1831 154 292 -1488 -469 -287 -258 340 931 205 159 125 -313 -125 518 -349 401 408 -255 -185 667 58 1211 558 -869 627 946 459 503 -612 -305 -173 664 100 -513 518 -85 -507 -231 -782 -61 -255 -176 -756 -760 -522 -306 -910 487 -224 -549 -202 -267 -508 278 -362 -18 376 -300 303 141 441 532 -121 53 -28 -29 -484 -212 -1310 33 389 247 4 -1045 -484 -442 -532 -165 183 92 -310 194 -775 29 317 -128 -72 -115 -1056 922 774 563 703 -192 740 546 122 402 218 70 932 971 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