File name: Pandora206s1_BuffaloNY_20240717_L2Fit_fout2c1d20220512p1-8.txt File generation date: 20240718T052537.7Z 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 v1.8.59 Instrument operation file used: Pandora206_OF_v3d20211008.txt Instrument calibration file used: Pandora206s1_CF_v1d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20240717_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: 20240717 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 20240717T142512.4Z 8964.600838 187 1 24.00 2 42.66 106.72 161.40 26.15 0.00 1 0.00 1 0 17 6.241e-02 1.911e-02 4.708e-02 1.576e-02 2.138193e-01 7.922759e-03 2.552934e-03 -6.000000e+00 3.557442e-02 232.88 -2.00 3.55 -2.00 317.18 0.00e+00 5.145266e-04 1.099368e-03 1.536894e-04 -6.000000e+00 1.574736e-03 287.38 -2.00 20.00 -2.00 316.34 0.00e+00 1.358 0.000 302.00 328.00 3 8.0901e+00 2.1162e-02 1.7647e-02 -6.0000e+00 8.9395e-02 4.8752e-02 2.3796e-02 1.1376e-02 -6.0000e+00 9.6776e-02 2.2922e-02 1.4032e-02 5.4631e-03 -6.0000e+00 5.7554e-02 -1.7614e-02 6.7801e-03 1.5873e-03 -6.0000e+00 2.4308e-02 3.2427e-05 3.1361e-04 4.3886e-04 1.6303e-05 -6.0000e+00 1.5935e-03 2.0076e-02 -3.7931e-05 12 9 8 11 4 0 31.73 17.33 2.07 0.02008 0.02243 6 6 2 8 0 4000.000 15.00 17.33 29.25 20.25 20.56 23.6 1010.39 -12047 31119 -2380 36376 2292 1223 1127 10485 2711 26148 55 16528 -7426 814 -4557 -3663 17644 3191 2088 -2477 19478 -6540 7240 -2848 3077 -11957 4063 -3038 4361 2221 -2139 -2236 -2556 9946 -4054 -2570 -12921 -56 -1530 1017 570 51 -2778 -1568 -315 -2144 -2306 1532 -510 -4669 712 39 1745 -4142 2777 421 2569 2639 -1451 -1073 -3864 3504 -1852 2495 -1891 1329 -3646 266 2206 -1004 774 4170 2676 3806 3505 -23 1635 -2792 -2711 -4439 -1305 -420 -1242 -1610 639 1654 2885 1244 250 -1403 -2134 634 -836 -2476 -696 -239 1579 1709 1959 641 1573 -393 -3596 -2314 288 447 1601 634 -870 -192 2207 663 -2705 -1533 -208 -691 -2369 -1393 -476 970 -914 646 -225 412 1564 -1320 297 -1175 398 58 317 2306 -40 -1134 1354 190 -1411 1225 312 -691 742 859 -1400 -1764 3213 -351 3480 267 138 136 1284 400 3214 8 2179 -1395 159 -1033 -901 3708 799 547 -703 4518 -1929 1902 -875 927 -4344 1257 -935 1141 583 -621 -688 -855 3012 -1284 -810 -4835 -21 -711 540 328 31 -1761 -986 -195 -1344 -1409 870 -287 -2722 416 24 1127 -2987 1915 301 1830 1863 -1043 -765 -2926 2651 -1598 2187 -1699 1042 -2777 195 1685 -876 723 3913 2537 3432 2939 -19 1157 -1946 -1977 -3719 -1181 -402 -1267 -1713 717 1969 3562 1610 327 -1785 -2502 679 -824 -2387 -699 -263 1828 2192 2630 844 1918 -466 -4148 -2770 357 578 2137 893 -1298 -302 3546 1048 -4339 -2241 -282 -883 -3092 -1887 -667 1436 -1403 962 -331 590 2088 -1728 361 -1462 522 81 460 3353 -61 -1790 2151 320 -2468 2142 553 -1196 1226 1416 -2309 SS 20240717T152606.2Z 8964.643127 222 1 24.00 2 32.57 123.26 154.44 56.07 0.00 1 0.00 1 0 17 3.397e-02 1.448e-02 2.542e-02 1.104e-02 1.854752e-01 5.552474e-03 2.226491e-03 -6.000000e+00 1.936208e-02 232.88 -2.00 3.55 -2.00 316.62 0.00e+00 2.723176e-04 6.720799e-04 1.970089e-04 -6.000000e+00 8.571483e-04 287.38 -2.00 20.00 -2.00 315.81 0.00e+00 1.186 0.000 302.00 328.00 3 7.8911e+00 1.4693e-02 1.5336e-02 -6.0000e+00 4.8654e-02 2.1527e-02 1.6439e-02 9.8206e-03 -6.0000e+00 5.2674e-02 1.7907e-02 9.5025e-03 4.7092e-03 -6.0000e+00 3.1326e-02 -5.9914e-03 4.4511e-03 1.3619e-03 -6.0000e+00 1.3228e-02 5.0005e-05 5.5680e-04 3.0580e-04 1.4798e-05 -6.0000e+00 8.6736e-04 2.2730e-02 2.9421e-05 12 9 8 11 4 0 61.46 17.32 1.53 0.02273 0.02691 6 6 2 8 0 4000.000 15.00 17.32 32.02 20.25 20.56 23.6 1026.29 -17258 9976 -2472 10051 2692 7117 -3609 10290 -2410 16277 1232 1309 -5328 2645 3522 -1428 7167 904 2193 -296 10662 -6956 5391 -3062 1207 -1651 1104 -2226 -908 1346 236 -1110 -2913 2379 -5616 -2610 -5821 725 1508 796 -3368 -136 -467 -2007 166 -931 229 -643 227 -940 -182 68 949 -590 2180 186 1033 917 -1912 887 -2882 3631 -226 639 -1435 526 -3356 -1539 815 -476 2377 985 3258 1158 2241 -533 735 -4596 -2181 -2943 -323 -74 -1665 -1801 -699 2624 1733 714 1149 1225 -178 -756 -640 -1202 -1335 -648 1050 458 769 2568 108 -1016 -1300 -1915 2120 -1475 -814 -88 -165 280 1911 595 -1394 -535 -1635 625 -1843 -970 -644 292 -1009 -233 -333 685 1164 -692 425 -158 695 393 622 -97 260 -639 768 -327 -19 664 862 419 1225 -2026 -727 -3599 1706 -486 1604 411 996 -598 1652 -489 2871 243 258 -1245 639 947 -425 2050 282 697 -100 3262 -2484 1736 -1132 444 -646 419 -806 -296 419 78 -390 -1121 886 -2055 -935 -2308 311 772 478 -2205 -89 -315 -1377 111 -624 151 -413 140 -579 -117 47 672 -446 1636 144 807 711 -1492 671 -2340 2966 -200 594 -1328 442 -2701 -1172 644 -436 2233 974 3140 1133 2013 -439 554 -3429 -1658 -2458 -292 -74 -1770 -1934 -801 3121 2184 938 1507 1532 -207 -826 -631 -1181 -1347 -713 1254 591 1035 3276 132 -1197 -1455 -2276 2655 -1943 -1112 -125 -243 422 2954 929 -2103 -759 -2194 769 -2336 -1278 -887 427 -1526 -345 -482 962 1533 -884 522 -197 886 530 873 -140 376 -966 1185 -535 -32 1127 1465 692 1947 -3218 -1151 SS 20240717T163155.0Z 8964.688831 256 1 24.01 2 24.29 150.90 144.10 75.05 0.00 1 0.00 1 0 25 2.449e-02 1.324e-02 1.594e-02 7.952e-03 1.768443e-01 4.019641e-03 2.097275e-03 -6.000000e+00 1.396413e-02 232.88 -2.00 3.55 -2.00 316.21 0.00e+00 4.254614e-04 4.419005e-04 4.030113e-05 -6.000000e+00 6.180766e-04 287.38 -2.00 20.00 -2.00 315.41 0.00e+00 1.097 0.000 302.00 328.00 3 7.5804e+00 1.0574e-02 1.4343e-02 -6.0000e+00 3.5090e-02 3.4662e-02 1.1812e-02 9.2667e-03 -6.0000e+00 3.7985e-02 9.0441e-03 6.7780e-03 4.4691e-03 -6.0000e+00 2.2590e-02 -5.6056e-03 3.1068e-03 1.2570e-03 -6.0000e+00 9.5441e-03 7.5539e-05 1.3959e-04 2.1871e-04 1.3513e-05 -6.0000e+00 6.2539e-04 1.6650e-02 -1.1580e-04 12 9 8 11 4 0 76.80 17.32 1.20 0.01665 0.01770 6 6 2 8 0 4000.000 15.00 17.32 34.05 20.25 20.56 24.0 1041.44 -10414 7594 -1775 1844 -4783 3143 -356 -982 -1054 3680 3807 4441 -6391 149 2560 -929 8834 -1228 5473 -4048 6655 -4446 3776 -1135 2013 -2518 -831 -1870 -1035 2646 -1824 4148 -1156 4463 -3528 -2652 -7531 -460 1204 -124 -815 -404 705 -97 1091 -3313 -191 -1458 475 -1864 1447 -343 1191 -237 1607 901 -183 2823 -1367 988 -1916 1322 632 2837 -474 479 -2139 -1595 -666 -951 1619 335 2001 558 1860 -1514 1660 -3380 -330 -2992 -1865 -324 -1795 -1738 -148 1582 -73 1297 939 1240 -336 182 -2082 -1162 -1471 -1094 1853 1074 1799 807 678 -1167 -1167 -1449 244 -1286 49 -293 913 -34 1710 433 -1169 -338 -1136 -551 -2449 156 -290 958 328 254 -733 664 1106 612 -1420 372 106 -272 1078 -874 -401 -1196 874 499 57 1045 591 435 -89 -1051 -863 -2387 1564 -407 375 -930 538 -67 -206 -246 857 849 980 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