File name: Pandora206s1_BuffaloNY_20240412_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T075215.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: Kang Sun Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 206 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora206_OF_v3d20211008.txt Instrument calibration file used: Pandora206s1_CF_v4d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20240412_L1_smca1c4d20220512p1-8.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]: 305.0744 305.2154 305.3564 305.4973 305.6383 305.7792 305.9201 306.0611 306.2020 306.3428 306.4837 306.6246 306.7654 306.9063 307.0471 307.1879 307.3287 307.4695 307.6103 307.7511 307.8918 308.0326 308.1733 308.3140 308.4548 308.5955 308.7362 308.8768 309.0175 309.1582 309.2988 309.4394 309.5801 309.7207 309.8613 310.0019 310.1424 310.2830 310.4236 310.5641 310.7046 310.8451 310.9857 311.1261 311.2666 311.4071 311.5476 311.6880 311.8285 311.9689 312.1093 312.2497 312.3901 312.5305 312.6708 312.8112 312.9515 313.0919 313.2322 313.3725 313.5128 313.6531 313.7934 313.9336 314.0739 314.2141 314.3543 314.4946 314.6348 314.7750 314.9151 315.0553 315.1955 315.3356 315.4758 315.6159 315.7560 315.8961 316.0362 316.1763 316.3163 316.4564 316.5964 316.7364 316.8765 317.0165 317.1565 317.2964 317.4364 317.5764 317.7163 317.8563 317.9962 318.1361 318.2760 318.4159 318.5558 318.6956 318.8355 318.9753 319.1152 319.2550 319.3948 319.5346 319.6744 319.8141 319.9539 320.0937 320.2334 320.3731 320.5128 320.6525 320.7922 320.9319 321.0716 321.2112 321.3509 321.4905 321.6301 321.7697 321.9093 322.0489 322.1885 322.3280 322.4676 322.6071 322.7467 322.8862 323.0257 323.1652 323.3046 323.4441 323.5836 323.7230 323.8624 324.0018 324.1413 324.2806 324.4200 324.5594 324.6988 324.8381 324.9774 --------------------------------------------------------------------------------------- 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 9.196e-02 1.662e-02 7.144e-02 1.221e-02 3.064057e-01 6.043642e-03 3.694860e-03 -6.000000e+00 5.153717e-02 228.09 -2.00 3.55 -2.00 318.25 0.00e+00 7.610308e-04 1.107786e-03 2.750649e-04 -6.000000e+00 2.227854e-03 277.67 -2.00 20.00 -2.00 317.60 0.00e+00 1.592 0.000 302.00 328.00 3 7.7626e+00 1.6287e-02 2.2576e-02 -6.0000e+00 1.2843e-01 4.5218e-02 1.8508e-02 1.6126e-02 -6.0000e+00 1.3973e-01 1.3105e-02 1.2203e-02 7.8987e-03 -6.0000e+00 8.2954e-02 -7.3846e-03 6.3449e-03 2.3762e-03 -6.0000e+00 3.5112e-02 3.0343e-05 1.1646e-04 3.4063e-04 2.4045e-05 -6.0000e+00 2.3438e-03 -1.2724e-02 1.8993e-04 12 8 8 10 0 0 99.48 17.81 0.35 -0.01272 -0.01185 6 6 2 8 0 4000.000 15.00 17.81 12.13 21.38 21.27 20.9 988.62 -19141 54924 18967 18926 10647 9931 3004 26318 2593 5241 56545 7478 -14454 11834 19743 -9702 23582 -3544 -756 -7616 25469 7887 4055 2933 -1631 520 1636 9232 -15592 5063 -6946 2875 -4199 6110 -7941 3145 -2290 -3822 91 820 -4008 -2688 1477 -520 4768 -4286 -5101 -8622 3718 -2568 408 931 435 4196 2653 1496 -2781 1240 -322 1517 -2571 3865 -1669 1665 -318 2284 -2344 -3178 3145 -2143 2747 -1234 2175 183 1908 -2358 1970 -3443 -1504 -2233 -747 777 -2264 -291 -399 2173 1541 1277 944 2274 -1120 173 -1113 -1240 -701 86 822 -148 2153 391 588 -2158 -1495 -2750 1631 -2925 474 337 233 1023 1177 1723 -753 292 -2065 844 -3898 -281 -2251 501 -144 -490 -211 -18 1897 239 898 -113 -73 -1081 1235 -643 167 -529 744 815 -39 1043 879 -122 234 -673 -1496 -1409 2208 1102 1071 571 514 178 1381 194 408 2672 573 -1539 1163 2080 -1495 2732 -564 -123 -1374 3479 1224 670 524 -320 104 328 1656 -3314 873 -1466 597 -1032 1417 -1948 670 -569 -1117 30 318 -1785 -1231 672 -244 2110 -2085 -2462 -4220 1588 -1175 194 474 235 2320 1541 894 -1773 754 -194 886 -1613 2454 -1225 1274 -248 1592 -1601 -2138 2115 -1743 2332 -1101 1923 158 1498 -1722 1285 -2260 -1023 -1693 -629 715 -2227 -292 -431 2450 1834 1571 1168 2659 -1243 179 -1066 -1154 -694 94 966 -196 2960 534 747 -2581 -1703 -3290 1985 -3904 640 478 338 1578 1925 2840 -1222 437 -2977 1109 -5377 -390 -3426 788 -225 -772 -324 -26 2642 323 1141 -147 -103 -1595 1881 -1028 269 -892 1283 1472 -72 1961 1661 -225 412 -1181 -2577 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 8.087e-02 1.520e-02 7.286e-02 1.316e-02 3.012102e-01 6.500608e-03 3.651968e-03 -6.000000e+00 4.529166e-02 228.09 -2.00 3.55 -2.00 318.16 0.00e+00 1.285658e-03 1.169180e-03 4.199701e-04 -6.000000e+00 1.959286e-03 277.67 -2.00 20.00 -2.00 317.51 0.00e+00 1.542 0.000 302.00 328.00 3 7.8907e+00 1.7511e-02 2.2106e-02 -6.0000e+00 1.1286e-01 5.8126e-02 1.9872e-02 1.6087e-02 -6.0000e+00 1.2282e-01 1.7782e-02 1.2955e-02 7.7492e-03 -6.0000e+00 7.2915e-02 -1.2309e-02 6.7157e-03 2.5121e-03 -6.0000e+00 3.0844e-02 2.7983e-05 -4.8698e-04 3.6562e-04 2.4347e-05 -6.0000e+00 2.0618e-03 -9.9573e-03 1.1427e-04 12 8 8 10 0 0 99.29 17.81 1.41 -0.00996 -0.01362 6 6 2 8 0 4000.000 14.99 17.81 12.44 21.38 21.27 21.0 991.26 -24279 2593 68957 2438 34888 913 11587 -8021 -1410 16480 14578 14867 1584 12225 16894 -7386 4670 1176 177 2597 14363 3351 3518 -160 7922 7292 4995 2970 -762 -3970 -7168 -4469 -2580 432 -2062 -4528 -2870 -759 3628 -3562 -2137 -812 -773 -4313 3627 -1474 -7589 -5495 313 -540 -2998 -1897 683 3921 1667 1549 -735 84 550 -1247 -739 441 -504 1540 1631 2464 -1139 -1554 2316 -694 2863 937 911 1207 -1155 3669 599 -1373 -6391 -100 878 -153 -3324 -590 -1331 1710 1612 1590 1822 2165 563 -1659 -1174 -1851 -1192 -2083 2183 585 2059 1606 226 -1796 -672 -2012 150 -2187 -810 879 -841 806 624 1341 -2202 -390 -2292 88 -1428 -1266 -624 -24 607 -310 -24 502 1887 -620 797 -98 1545 540 932 351 355 -895 -816 493 1017 1422 335 151 -861 -851 -1130 -1927 180 2654 166 1552 53 643 -604 -111 1160 1060 1106 150 1214 1860 -1165 684 187 30 443 2223 569 610 -31 1466 1415 1001 569 -140 -754 -1528 -1006 -628 107 -479 -1081 -744 -216 1192 -1486 -961 -375 -370 -2162 1672 -718 -3870 -2686 142 -249 -1513 -1020 378 2228 1000 945 -469 53 335 -765 -466 296 -374 1205 1274 1746 -782 -1046 1596 -565 2464 828 827 1045 -947 2554 402 -895 -4627 -75 735 -144 -3326 -598 -1458 1947 1927 1960 2245 2545 616 -1751 -1129 -1739 -1190 -2333 2530 770 2829 2157 288 -2202 -758 -2389 185 -2889 -1103 1235 -1264 1238 1018 2199 -3593 -600 -3282 120 -1965 -1760 -925 -37 958 -483 -36 721 2607 -839 1005 -126 2115 799 1406 547 563 -1492 -1451 880 1839 2622 626 273 -1555 -1476 -1913 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 3.939e-02 1.354e-02 3.188e-02 8.693e-03 2.817893e-01 4.303191e-03 3.427554e-03 -6.000000e+00 2.206692e-02 228.09 -2.00 3.55 -2.00 317.59 0.00e+00 1.893382e-03 6.577865e-04 1.866521e-04 -6.000000e+00 9.542691e-04 277.68 -2.00 20.00 -2.00 316.95 0.00e+00 1.393 0.000 302.00 328.00 3 7.5405e+00 1.1423e-02 2.0305e-02 -6.0000e+00 5.4989e-02 9.5433e-02 1.2889e-02 1.4926e-02 -6.0000e+00 5.9834e-02 -1.2039e-02 7.9413e-03 7.2657e-03 -6.0000e+00 3.5522e-02 -2.9732e-03 3.9945e-03 2.5711e-03 -6.0000e+00 1.5031e-02 4.6961e-05 -3.4486e-04 2.3989e-04 2.4964e-05 -6.0000e+00 1.0040e-03 -1.1380e-02 1.6198e-04 12 8 8 10 0 0 99.47 17.80 0.74 -0.01138 -0.01397 6 6 2 8 0 4000.000 14.99 17.80 13.86 21.38 21.27 21.2 1001.01 -16054 20552 4309 6049 728 -6042 -10648 11005 6270 -975 13600 -9053 -595 -2450 4986 -5985 8620 -1697 1419 -3090 11380 -3109 5270 -782 727 -905 1840 3560 -11040 2724 1210 4191 -730 227 -5295 1726 -1577 -1466 2869 415 499 -1652 -971 -2292 2948 -2021 -2790 -5059 3212 -1250 1754 784 1044 704 1201 1823 -977 1837 -163 407 -778 1827 -1440 3187 77 -2430 -1164 -5782 1939 -3532 3703 1116 3197 452 1589 -581 144 -2415 -2054 -2946 1279 -48 -1325 -435 -1153 1512 358 38 85 1480 -379 -344 -1239 -1911 -457 -276 1736 1228 1597 1011 816 -856 -1058 -2749 21 -2125 -166 467 132 969 825 1257 -773 -402 -720 310 -2001 -734 -1227 829 -436 -46 124 904 1069 -337 -338 321 1272 -643 1088 599 -228 -1140 385 -606 -331 -26 901 402 -1065 742 -437 -1730 1697 434 581 64 -540 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