File name: Pandora206s1_BuffaloNY_20230729_L2Fit_fout2c1d20220512p1-8.txt File generation date: 20230801T135328.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Kang Sun Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 206 Spectrometer number: 1 Processing software version used: BlickP v1.8.49 Instrument operation file used: Pandora206_OF_v3d20211008.txt Instrument calibration file used: Pandora206s1_CF_v1d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20230729_L1_smca1c1d20220512p1-8.txt Full location name: University at Buffalo Short location name: BuffaloNY Country of location: Canada Location latitude [deg]: 43.0015 Location longitude [deg]: -78.7869 Location altitude [m]: 190 Local noon date: 20230729 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: 223 365 Nominal wavelengths inside fitting window [nm]: 305.0398 305.1808 305.3218 305.4628 305.6038 305.7447 305.8857 306.0266 306.1675 306.3084 306.4493 306.5902 306.7311 306.8720 307.0128 307.1537 307.2945 307.4353 307.5761 307.7169 307.8577 307.9985 308.1393 308.2800 308.4207 308.5615 308.7022 308.8429 308.9836 309.1243 309.2649 309.4056 309.5462 309.6869 309.8275 309.9681 310.1087 310.2493 310.3899 310.5305 310.6710 310.8116 310.9521 311.0926 311.2331 311.3736 311.5141 311.6546 311.7950 311.9355 312.0759 312.2164 312.3568 312.4972 312.6376 312.7779 312.9183 313.0587 313.1990 313.3394 313.4797 313.6200 313.7603 313.9006 314.0408 314.1811 314.3214 314.4616 314.6018 314.7421 314.8823 315.0225 315.1626 315.3028 315.4430 315.5831 315.7232 315.8634 316.0035 316.1436 316.2837 316.4238 316.5638 316.7039 316.8439 316.9839 317.1240 317.2640 317.4040 317.5439 317.6839 317.8239 317.9638 318.1038 318.2437 318.3836 318.5235 318.6634 318.8033 318.9431 319.0830 319.2228 319.3627 319.5025 319.6423 319.7821 319.9219 320.0616 320.2014 320.3412 320.4809 320.6206 320.7603 320.9000 321.0397 321.1794 321.3191 321.4587 321.5984 321.7380 321.8776 322.0172 322.1568 322.2964 322.4360 322.5755 322.7151 322.8546 322.9941 323.1336 323.2731 323.4126 323.5521 323.6916 323.8310 323.9705 324.1099 324.2493 324.3887 324.5281 324.6675 324.8069 324.9462 --------------------------------------------------------------------------------------- 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: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Temperature at electronics board 1 [°C], 999=no temperature signal Column 98: Temperature at electronics board 2 [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: 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 20230729T122523.2Z 8610.517630 108 1 28.00 2 65.86 86.38 154.49 299.59 0.00 1 0.00 1 0 17 3.645e-01 3.071e-02 2.330e-01 2.168e-02 3.231965e-01 1.110755e-02 3.769266e-03 -6.000000e+00 2.095677e-01 232.48 -2.00 3.55 -2.00 318.75 0.00e+00 -1.506696e-04 2.413295e-03 5.215230e-04 -6.000000e+00 1.005278e-02 287.60 -2.00 20.00 -2.00 317.92 0.00e+00 2.427 0.000 302.00 328.00 3 7.3905e+00 3.0814e-02 2.9468e-02 -6.0000e+00 5.2513e-01 8.9990e-02 3.5531e-02 1.7408e-02 -6.0000e+00 5.6818e-01 5.7306e-02 2.4974e-02 8.3758e-03 -6.0000e+00 3.3737e-01 -3.5950e-02 1.3113e-02 2.3249e-03 -6.0000e+00 1.4428e-01 1.8911e-05 -3.2491e-05 6.2416e-04 2.2902e-05 -6.0000e+00 9.4874e-03 1.8880e-03 2.7887e-04 12 8 8 10 0 0 -40.97 18.67 2.76 0.00189 0.00164 7 7 2 8 0 4000.000 14.99 18.67 30.31 21.98 22.09 18.5 1025.88 -9184 900000 64528 40390 900000 900000 274844 49403 41631 191087 121987 900000 -13954 3595 -44648 32167 166277 14111 7922 8512 43666 2048 -2279 20714 34404 -8166 -9363 -12690 8672 11342 138 2192 12423 20583 12879 644 17726 -5744 1855 -786 6497 -1098 8609 450 6279 -3562 -5735 -27632 2819 -3002 7798 2853 -5979 1179 8014 2576 23 2675 -1940 -18153 -7153 4338 2620 2526 -177 -50 -2234 682 -1582 313 -441 3143 9252 539 2717 3652 2531 250 2196 -425 543 4812 -6308 -2706 -10 987 2565 1562 -2316 -279 -518 -70 5074 -3093 2386 -1887 3822 2171 919 1099 3244 -606 -1605 -2740 137 -81 -1993 1142 -1221 -568 612 -443 -4473 -1073 -2069 1941 -299 -3176 -1894 1563 53 -158 2120 2327 6456 -1805 -54 -1225 1465 -1382 3661 -2000 -918 -1141 -845 710 -68 2171 1373 2162 -377 -1217 -2805 -388 900000 1619 1253 900000 900000 5806 1402 1457 4037 2577 900000 -1045 265 -6019 2368 3626 1391 877 981 3776 258 -306 2387 3793 -1406 -1672 -2226 1168 1460 21 355 2004 3383 2142 115 2925 -1346 488 -255 2188 -419 3097 179 2339 -1473 -2397 -14097 1050 -1190 2950 1233 -2997 587 3888 1347 13 1438 -1065 -11550 -4167 2419 1627 1706 -125 -32 -1389 414 -998 223 -350 2525 7018 429 1972 2423 1528 146 1306 -295 423 4009 -6142 -2645 -10 1071 2883 1834 -2849 -324 -557 -70 4455 -2828 2186 -2007 4155 2689 1239 1457 3948 -726 -1791 -3147 168 -102 -2656 1552 -1785 -884 1004 -752 -7664 -1662 -2970 2572 -403 -4574 -2796 2381 84 -245 3231 3389 8515 -2471 -69 -1573 1980 -2069 5526 -3310 -1532 -1975 -1507 1315 -130 4146 2668 4031 -691 -2230 -5063 SS 20230729T142854.5Z 8610.603409 156 1 28.00 2 43.63 110.03 164.12 13.91 0.00 1 0.00 1 0 17 8.495e-02 2.773e-02 7.081e-02 2.012e-02 2.069643e-01 1.015843e-02 2.391914e-03 -6.000000e+00 4.850526e-02 232.47 -2.00 3.55 -2.00 317.36 0.00e+00 5.634946e-04 1.467811e-03 2.204417e-04 -6.000000e+00 2.145844e-03 287.60 -2.00 20.00 -2.00 316.51 0.00e+00 1.380 0.000 302.00 328.00 3 8.4502e+00 2.7143e-02 1.7408e-02 -6.0000e+00 1.2177e-01 2.3279e-02 3.0545e-02 1.0829e-02 -6.0000e+00 1.3171e-01 6.4847e-02 1.8323e-02 5.1666e-03 -6.0000e+00 7.8382e-02 -4.4042e-02 8.9482e-03 1.5437e-03 -6.0000e+00 3.3255e-02 2.2387e-05 -2.9282e-04 5.6580e-04 1.5675e-05 -6.0000e+00 2.1665e-03 2.6381e-03 1.8500e-04 12 8 8 10 0 0 90.65 18.66 3.83 0.00264 0.00044 7 7 2 8 0 4000.000 15.00 18.66 27.39 21.98 22.09 18.5 1008.43 3649 22677 14362 -6934 11318 53366 32591 26967 -9511 5598 9665 1583 -22412 -32525 -8064 14094 17418 14000 -2551 5056 432 -5522 -3825 3118 1084 -10037 -2234 1410 8870 6294 3247 -1315 12528 10360 1978 -7803 -7947 4297 3625 3586 3302 1614 -4145 -283 4733 657 -2242 -15353 1790 -3403 1620 2166 -5962 1339 5359 1532 4156 -415 -777 -5085 -1071 1832 985 3767 402 -418 -3437 -3198 917 -368 -990 4395 1185 9393 -616 2021 -307 867 -4551 -433 -1829 2120 -4358 -69 -1828 -1802 4443 508 -531 634 1090 1359 3826 -12034 1603 -382 3368 1276 -419 669 3249 -241 -1600 -3945 -69 -240 390 616 -710 651 142 -2169 -3288 -456 46 1491 -1142 -1107 -808 151 656 -741 1566 2061 3010 -1825 749 1132 1851 626 2478 -1697 -246 -1461 -1431 3876 -1141 2579 283 188 -130 -1175 -2727 390 2224 1591 -908 1074 3211 2536 2469 -1366 744 1211 212 -4227 -7719 -1699 2649 3285 2809 -628 1197 110 -1475 -1014 817 303 -3265 -683 405 2158 1515 845 -380 3400 3028 582 -2398 -2666 1464 1491 1752 1781 890 -2502 -166 2718 394 -1355 -10211 974 -1918 908 1293 -4050 891 3540 1063 2867 -299 -551 -3728 -773 1374 807 3207 355 -339 -2623 -2329 664 -307 -922 4061 1137 8040 -546 1619 -225 583 -3297 -338 -1620 1992 -4514 -71 -2050 -2177 5317 655 -699 797 1255 1468 3647 -12675 1536 -410 3844 1596 -569 882 4050 -288 -1804 -4678 -87 -318 518 855 -1039 994 229 -3623 -5323 -665 63 1861 -1451 -1463 -1145 229 1018 -1153 2334 2923 3982 -2418 911 1406 2349 855 3482 -2551 -368 -2280 -2377 6443 -2045 4568 520 336 -226 -1998 -4586 SS 20230729T155302.3Z 8610.661832 177 1 28.00 2 30.66 135.52 155.17 59.62 0.00 1 0.00 1 0 25 3.542e-02 1.817e-02 2.581e-02 1.022e-02 1.944948e-01 5.135690e-03 2.299737e-03 -6.000000e+00 2.021966e-02 232.47 -2.00 3.55 -2.00 316.82 0.00e+00 7.581184e-04 6.534226e-04 1.006612e-04 -6.000000e+00 8.944951e-04 287.60 -2.00 20.00 -2.00 316.00 0.00e+00 1.162 0.000 302.00 328.00 3 7.9008e+00 1.3600e-02 1.5436e-02 -6.0000e+00 5.0758e-02 1.1802e-02 1.5241e-02 1.0161e-02 -6.0000e+00 5.4906e-02 2.8341e-02 8.8958e-03 4.9276e-03 -6.0000e+00 3.2674e-02 -1.5934e-02 4.2379e-03 1.4150e-03 -6.0000e+00 1.3863e-02 4.9557e-05 2.6392e-04 2.8197e-04 1.4176e-05 -6.0000e+00 9.0329e-04 1.9847e-05 5.5214e-05 12 9 8 11 8 0 69.63 18.64 0.90 0.00002 0.00200 7 7 2 8 0 4000.000 15.00 18.64 27.55 21.98 21.98 18.4 1008.14 -5370 13350 2830 -5433 7268 -2275 8344 4002 5718 -5188 12752 -15844 -4794 -4032 -3862 -7311 14561 1529 634 1313 2011 1609 -2928 3701 -517 1334 -3687 2708 -1398 2877 -1892 1206 4085 -271 -635 -5660 -331 -1885 2296 -876 3379 -1860 2286 -1575 4511 -1542 -1540 -6026 -2444 -613 809 -163 -3216 3612 1596 2770 52 442 -2055 -3861 -122 3599 1784 2681 907 -771 -1091 -3414 -1691 -1064 2883 -255 2573 1007 2292 -579 -652 -4214 -3174 -3513 -1104 1908 -2774 357 -1068 1758 1396 2283 94 1417 983 -628 -1049 -2325 -4 -2508 827 360 1925 -543 1915 -2854 -670 -3555 370 -2287 -1045 534 984 1125 1948 999 1064 -214 -2350 -320 -2676 -2268 -2415 1075 504 1103 986 617 1933 -915 -757 -1951 1337 -607 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