File name: Pandora206s1_BuffaloNY_20240315_L2Fit_fout2c1d20220512p1-8.txt File generation date: 20240316T052825.3Z 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_20240315_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: 20240315 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 20240315T153952.1Z 8840.652686 165 1 24.00 2 50.51 145.40 76.95 67.96 0.00 1 0.00 1 0 25 6.029e-02 1.956e-02 4.514e-02 1.152e-02 2.715252e-01 5.648328e-03 3.280286e-03 -6.000000e+00 3.348069e-02 225.91 -2.00 3.55 -2.00 317.74 0.00e+00 2.686551e-03 8.984616e-04 5.958902e-04 -6.000000e+00 1.441771e-03 274.55 -2.00 20.00 -2.00 317.16 0.00e+00 1.569 0.000 302.00 328.00 3 7.4730e+00 1.4951e-02 2.0979e-02 -6.0000e+00 8.3097e-02 7.7613e-02 1.6917e-02 1.4939e-02 -6.0000e+00 9.0626e-02 3.4579e-03 1.0631e-02 6.8532e-03 -6.0000e+00 5.3796e-02 -3.5410e-03 5.4023e-03 3.1011e-03 -6.0000e+00 2.2800e-02 4.3713e-05 2.5409e-04 3.1970e-04 2.7496e-05 -6.0000e+00 1.5363e-03 1.5984e-02 -1.2865e-04 12 8 8 10 0 0 66.86 17.71 1.76 0.01598 0.01789 6 6 2 8 0 4000.000 15.00 17.71 12.95 21.27 21.17 20.6 997.68 -18355 14731 12096 22191 5218 18576 -27448 7207 -17742 -5180 3874 1235 4381 3774 2543 2054 18942 -2761 9120 -4021 20315 -8921 12762 2867 279 -5170 6036 6336 -10311 6555 -657 4894 -1900 2258 -3645 -313 -8945 -3399 2684 -3434 3641 -449 3540 -11930 7121 -1936 -1899 -5987 3644 -3271 1844 -6212 526 2745 3826 1888 875 86 -1629 5380 -145 4449 585 2364 -1139 630 -4604 -3507 746 -729 3827 -963 2885 639 1336 -3061 94 -1808 -3010 -2738 646 -223 -2728 -1892 -397 1192 1757 1355 1513 2868 -366 -815 -1501 -2059 -2620 -481 1733 1297 479 302 2332 -679 317 -1741 1647 -2395 574 752 -1793 114 1207 1891 -1792 451 -1637 -1168 -1232 -4278 -569 895 1199 472 -1137 1177 1020 -1038 -1318 850 1775 -861 497 -212 404 -994 960 19 1644 657 1351 -63 -47 -1514 -1595 -1970 1250 1087 1681 420 1253 -2995 634 -2148 -580 398 134 530 517 408 369 2994 -565 1729 -901 3744 -2083 2524 637 66 -1334 1443 1412 -2522 1358 -158 1204 -549 646 -1009 -82 -2811 -1166 1041 -1603 1717 -229 1796 -7131 3511 -1050 -1011 -3241 1817 -1751 999 -3781 315 1697 2400 1221 581 57 -1071 3388 -97 3066 457 1945 -961 475 -3410 -2584 544 -617 3374 -924 2642 573 1099 -2421 65 -1216 -2171 -2242 555 -213 -2844 -2033 -437 1385 2128 1697 1894 3382 -422 -859 -1454 -2012 -2666 -531 2085 1693 665 406 2964 -814 353 -2064 2066 -3168 771 1056 -2711 175 1937 3032 -2848 669 -2265 -1560 -1652 -5996 -827 1365 1844 716 -1711 1699 1394 -1381 -1662 1098 2372 -1260 754 -322 619 -1602 1618 34 2933 1177 2405 -113 -82 -2553 -2626 SS 20240315T165343.2Z 8840.703972 208 1 24.01 2 45.26 169.36 64.35 78.62 0.00 1 0.00 1 0 25 1.381e-01 2.654e-02 8.927e-02 1.826e-02 2.466803e-01 8.957549e-03 2.959174e-03 -6.000000e+00 7.678567e-02 225.92 -2.00 3.55 -2.00 317.75 0.00e+00 2.550174e-03 1.416722e-03 5.184564e-04 -6.000000e+00 3.301928e-03 274.55 -2.00 20.00 -2.00 317.15 0.00e+00 1.419 0.000 302.00 328.00 3 8.2002e+00 2.3805e-02 1.8999e-02 -6.0000e+00 1.9058e-01 3.1083e-02 2.6888e-02 1.3602e-02 -6.0000e+00 2.0777e-01 4.7087e-02 1.7015e-02 6.2109e-03 -6.0000e+00 1.2334e-01 -2.3773e-02 8.7479e-03 2.9270e-03 -6.0000e+00 5.2322e-02 2.5549e-05 7.8419e-04 5.1069e-04 2.5376e-05 -6.0000e+00 3.5167e-03 1.3254e-02 8.9050e-05 12 9 8 11 8 0 -28.72 17.72 -1.21 0.01325 0.01915 6 6 2 8 0 4000.000 15.00 17.72 14.54 21.27 21.17 20.7 1007.70 11142 69531 29649 73909 17750 66205 -10969 12811 -2450 19284 30935 24455 33464 15675 14280 1204 33960 9480 8977 -43047 17966 -4449 20226 6189 -1222 -2436 -7587 18993 -10389 18687 2378 15256 -3409 13075 311 -974 -8150 -3050 -637 -3999 -909 -2677 -1498 -3214 4776 -4051 -3191 -9431 11471 -2820 7261 -2652 -1927 -2750 4164 -161 -280 -392 -1459 236 1384 5950 -2230 2048 -1815 2417 -3094 -335 2709 -962 2956 2782 3593 4112 2823 -2908 -285 4630 -5410 -1357 1893 -200 -2125 -2609 -7459 3048 3017 1313 -364 2469 -594 -1847 712 -1803 -1461 -1368 945 1446 1070 1506 2327 -1767 1780 -958 3077 -3428 523 768 -1065 -1299 1005 193 -3081 -427 -1899 2647 -1533 -247 -754 1170 -331 290 141 28 169 -1627 41 1686 1070 -1636 2795 -873 842 -2217 995 383 991 304 127 164 783 -1342 -697 905 3595 2294 3567 1265 2948 -1044 1062 -263 1760 2524 2164 3096 1946 2075 216 4707 1746 1734 -14080 3360 -1020 3681 1364 -301 -629 -2078 3742 -2544 3511 548 3320 -977 3304 82 -251 -2486 -1019 -249 -1901 -456 -1418 -813 -1796 2459 -2291 -1757 -5381 5197 -1469 3625 -1566 -1187 -1803 2617 -107 -190 -263 -967 153 919 4070 -1802 1698 -1553 1801 -2260 -230 1915 -807 2608 2557 3262 3566 2300 -2311 -199 2910 -3944 -1078 1631 -188 -2166 -2777 -8955 3534 3675 1627 -475 2997 -682 -1953 689 -1723 -1480 -1484 1112 1885 1479 2013 2885 -2094 1967 -1134 3715 -4626 709 1088 -1607 -2030 1617 315 -4958 -639 -2626 3382 -2045 -340 -1088 1770 -517 441 210 42 234 -2184 51 2084 1430 -2392 4107 -1363 1309 -3565 1651 671 1760 557 235 292 1338 -2256 -1172 SS 20240315T175838.1Z 8840.749052 242 1 27.27 2 45.41 192.25 52.84 88.36 0.00 1 0.00 1 0 17 1.362e-02 6.309e-03 5.785e-03 2.653e-03 2.309298e-01 1.309911e-03 2.824977e-03 -6.000000e+00 7.566694e-03 225.92 -2.00 3.55 -2.00 316.40 0.00e+00 7.808213e-04 1.474521e-04 4.636229e-05 -6.000000e+00 3.258462e-04 274.56 -2.00 20.00 -2.00 315.82 0.00e+00 1.422 0.000 302.00 328.00 3 5.7263e+00 3.4013e-03 1.8322e-02 -6.0000e+00 1.8780e-02 3.6313e-02 3.8176e-03 1.1851e-02 -6.0000e+00 2.0482e-02 -6.1977e-03 2.2263e-03 5.8675e-03 -6.0000e+00 1.2158e-02 -1.3917e-03 1.0524e-03 1.7573e-03 -6.0000e+00 5.1523e-03 3.2189e-04 8.6903e-05 7.2239e-05 1.8765e-05 -6.0000e+00 3.4718e-04 1.7711e-02 -6.8478e-05 10 0 0 10 0 0 99.83 17.72 0.32 0.01771 0.01836 9 9 1 8 0 3029.950 15.00 17.72 18.56 21.27 21.17 21.2 1036.08 -2466 -347 1248 -1623 -11485 -4938 -1749 -1284 431 -1003 -1299 1293 -1034 -666 270 1052 1300 429 721 1256 1250 544 1487 1790 -1047 304 515 -418 -407 620 1321 1299 1291 19 -1406 -2418 -1431 -1420 972 -630 71 -893 -496 -965 314 174 -1192 -806 -255 -685 761 979 358 1266 475 1078 465 433 114 213 966 1267 1927 1164 284 34 -542 -1268 349 -318 695 46 510 476 286 -645 582 -825 -717 -901 -750 -1040 -1992 -1260 -979 -108 -162 -65 484 216 613 -37 -276 -371 53 -57 390 582 569 67 197 -1034 -751 -354 -360 -768 -709 -186 -339 247 648 398 86 125 -383 -331 -378 451 -29 387 121 -140 397 119 1057 308 306 664 662 366 399 -125 -199 1 -29 5 104 138 231 18 -392 -589 -915 -418 -63 227 -310 -2089 -804 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