File name: Pandora206s1_BuffaloNY_20240412_L2Fit_fout2c1d20220512p1-8.txt File generation date: 20240413T051903.7Z 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_20240412_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: 20240412 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 20240412T142004.2Z 8868.597271 139 1 24.01 2 51.18 118.41 76.45 66.30 0.00 1 0.00 1 0 17 9.197e-02 1.662e-02 7.144e-02 1.222e-02 3.063101e-01 6.044148e-03 3.684222e-03 -6.000000e+00 5.156253e-02 228.09 -2.00 3.55 -2.00 318.24 0.00e+00 7.503329e-04 1.107855e-03 2.727159e-04 -6.000000e+00 2.227665e-03 277.67 -2.00 20.00 -2.00 317.59 0.00e+00 1.592 0.000 302.00 328.00 3 7.4787e+00 1.6289e-02 2.2561e-02 -6.0000e+00 1.2849e-01 4.4951e-02 1.8509e-02 1.6109e-02 -6.0000e+00 1.3978e-01 1.3263e-02 1.2203e-02 7.8872e-03 -6.0000e+00 8.2986e-02 -7.4576e-03 6.3443e-03 2.3944e-03 -6.0000e+00 3.5139e-02 4.0318e-05 5.2816e-04 3.4068e-04 2.4019e-05 -6.0000e+00 2.3435e-03 1.2705e-02 7.0784e-05 12 8 8 10 0 0 99.48 17.81 0.35 0.01270 0.01667 6 6 2 8 0 4000.000 15.00 17.81 12.13 21.38 21.27 20.9 988.62 -19217 54888 18962 18986 10705 9922 2965 26272 2565 5259 56584 7456 -14510 11777 19682 -9735 23566 -3571 -777 -7635 25470 7892 4035 2920 -1632 524 1666 9281 -15558 5053 -6977 2846 -4235 6118 -7913 3125 -2331 -3874 37 787 -4017 -2690 1477 -512 4771 -4283 -5094 -8546 3802 -2580 383 913 417 4181 2647 1551 -2782 1306 -315 1517 -2580 3849 -1636 1653 -313 2294 -2344 -3185 3122 -2166 2776 -1241 2215 187 1918 -2347 1976 -3446 -1520 -2251 -764 762 -2275 -301 -411 2164 1534 1271 939 2272 -1122 171 -1117 -1246 -709 76 812 -158 2167 405 603 -2141 -1504 -2755 1627 -2903 471 333 252 1041 1171 1713 -767 298 -2082 831 -3906 -286 -2231 518 -153 -499 -198 -30 1886 253 887 -111 -70 -1080 1255 -650 160 -509 764 811 -44 1057 867 -137 222 -665 -1500 -1415 2207 1102 1074 574 513 175 1379 192 409 2674 572 -1545 1157 2073 -1501 2731 -568 -126 -1378 3480 1225 667 522 -320 105 334 1665 -3307 871 -1473 591 -1041 1419 -1941 665 -579 -1132 12 305 -1789 -1232 672 -240 2112 -2084 -2459 -4180 1622 -1180 182 465 226 2312 1538 926 -1774 794 -190 887 -1619 2444 -1200 1266 -245 1599 -1601 -2143 2100 -1762 2356 -1108 1958 162 1506 -1714 1290 -2262 -1034 -1708 -643 701 -2237 -302 -443 2440 1826 1564 1163 2656 -1245 177 -1070 -1160 -703 83 954 -210 2979 552 766 -2559 -1713 -3295 1980 -3875 635 472 366 1607 1915 2823 -1245 446 -3003 1091 -5389 -397 -3394 816 -239 -787 -304 -44 2626 342 1127 -145 -98 -1594 1912 -1039 258 -859 1318 1465 -82 1988 1639 -252 390 -1167 -2583 SS 20240412T142939.4Z 8868.603928 144 1 24.01 2 49.65 120.76 74.88 67.68 0.00 1 0.00 1 0 17 8.093e-02 1.519e-02 7.286e-02 1.316e-02 3.013260e-01 6.499977e-03 3.643434e-03 -6.000000e+00 4.534231e-02 228.09 -2.00 3.55 -2.00 318.15 0.00e+00 1.301243e-03 1.169390e-03 4.223877e-04 -6.000000e+00 1.960684e-03 277.67 -2.00 20.00 -2.00 317.51 0.00e+00 1.542 0.000 302.00 328.00 3 7.6061e+00 1.7508e-02 2.2100e-02 -6.0000e+00 1.1299e-01 5.8601e-02 1.9870e-02 1.6094e-02 -6.0000e+00 1.2294e-01 1.7508e-02 1.2954e-02 7.7418e-03 -6.0000e+00 7.2987e-02 -1.2218e-02 6.7157e-03 2.5503e-03 -6.0000e+00 3.0888e-02 3.7182e-05 -5.4398e-05 3.6576e-04 2.4453e-05 -6.0000e+00 2.0628e-03 1.4990e-02 -1.4723e-05 12 8 8 10 0 0 99.29 17.81 1.41 0.01499 0.01458 6 6 2 8 0 4000.000 14.99 17.81 12.44 21.38 21.27 21.0 991.26 -24322 2588 68981 2517 34963 922 11558 -8072 -1461 16457 14567 14811 1513 12169 16845 -7404 4671 1175 179 2599 14646 3364 3501 -185 7895 7261 4983 2979 -755 -3989 -7193 -4487 -2599 450 -2029 -4539 -2902 -807 3571 -3606 -2071 -834 -792 -4322 3618 -1480 -7588 -5409 315 -548 -3016 -1833 671 3909 1659 1536 -684 140 539 -1262 -695 479 -526 1525 1632 2472 -1138 -1559 2357 -715 2849 926 904 1200 -1160 3665 592 -1384 -6409 -118 863 -167 -3334 -601 -1345 1731 1599 1578 1810 2155 552 -1631 -1142 -1819 -1204 -2056 2174 578 2082 1600 219 -1772 -683 -2023 171 -2170 -794 895 -852 797 615 1330 -2215 -378 -2278 78 -1435 -1242 -629 -32 594 -300 -41 482 1898 -610 779 -74 1541 563 927 343 348 -898 -819 508 1029 1413 340 153 -881 -850 -1123 -1931 180 2655 172 1555 53 641 -608 -115 1158 1059 1102 143 1209 1855 -1168 684 187 30 443 2261 571 607 -35 1461 1410 998 571 -139 -758 -1533 -1010 -632 111 -471 -1083 -752 -229 1174 -1505 -931 -386 -379 -2167 1668 -722 -3870 -2642 143 -253 -1522 -985 371 2221 995 937 -435 88 328 -774 -437 322 -390 1194 1275 1751 -782 -1049 1623 -582 2452 818 820 1039 -951 2552 398 -902 -4641 -88 722 -156 -3336 -609 -1474 1971 1912 1944 2231 2533 605 -1721 -1098 -1708 -1202 -2302 2520 761 2860 2149 278 -2172 -771 -2402 210 -2866 -1081 1258 -1281 1224 1003 2181 -3614 -581 -3261 106 -1975 -1726 -932 -50 937 -467 -62 692 2621 -824 982 -95 2109 834 1398 535 552 -1497 -1455 906 1861 2606 635 276 -1591 -1474 -1902 SS 20240412T150626.6Z 8868.629475 163 1 24.01 2 44.18 130.71 68.73 72.91 0.00 1 0.00 1 0 17 3.941e-02 1.355e-02 3.188e-02 8.694e-03 2.817261e-01 4.303650e-03 3.419903e-03 -6.000000e+00 2.208718e-02 228.09 -2.00 3.55 -2.00 317.59 0.00e+00 1.895930e-03 6.577959e-04 1.886177e-04 -6.000000e+00 9.546948e-04 277.68 -2.00 20.00 -2.00 316.94 0.00e+00 1.393 0.000 302.00 328.00 3 7.2564e+00 1.1425e-02 2.0295e-02 -6.0000e+00 5.5040e-02 9.5364e-02 1.2892e-02 1.4920e-02 -6.0000e+00 5.9882e-02 -1.1995e-02 7.9427e-03 7.2583e-03 -6.0000e+00 3.5551e-02 -3.0020e-03 3.9944e-03 2.5955e-03 -6.0000e+00 1.5048e-02 6.2400e-05 1.7295e-05 2.4001e-04 2.5047e-05 -6.0000e+00 1.0044e-03 1.4325e-02 4.0233e-05 12 8 8 10 0 0 99.47 17.80 0.74 0.01432 0.01445 6 6 2 8 0 4000.000 14.99 17.80 13.86 21.38 21.27 21.2 1001.01 -16103 20544 4332 6135 813 -6024 -10666 10971 6246 -961 13632 -9079 -651 -2498 4940 -6001 8622 -1704 1418 -3090 11398 -3088 5264 -789 724 -907 1861 3601 -11008 2720 1190 4175 -752 245 -5255 1717 -1607 -1511 2819 383 489 -1657 -925 -2285 2954 -2014 -2777 -5048 3221 -1253 1738 773 1034 695 1240 1820 -979 1842 -158 407 -746 1814 -1453 3181 87 -2414 -1158 -5784 1920 -3551 3693 1111 3199 456 1599 -534 151 -2415 -2067 -2961 1297 -59 -1332 -443 -1162 1504 373 34 83 1480 -378 -344 -1240 -1916 -464 -284 1750 1240 1590 1004 829 -863 -1064 -2752 18 -2129 -150 464 129 982 820 1265 -784 -415 -715 300 -1987 -718 -1228 826 -443 -54 132 893 1078 -348 -348 323 1275 -624 1086 610 -232 -1124 387 -608 -336 -16 891 390 -1062 746 -441 -1735 1697 436 590 71 -538 -1052 964 641 -112 1341 -1139 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