File name: Pandora206s1_BuffaloNY_20240610_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T082911.8Z 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_20240610_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: 20240610 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 20240610T121835.8Z 8927.512914 124 1 24.01 2 63.11 82.66 99.56 47.99 0.00 1 0.00 1 0 17 2.289e-01 3.196e-02 2.292e-01 2.378e-02 3.976670e-01 1.240698e-02 4.853692e-03 -6.000000e+00 1.329548e-01 232.61 -2.00 3.55 -2.00 319.17 0.00e+00 1.622953e-03 3.043667e-03 7.089788e-04 -6.000000e+00 6.393352e-03 284.10 -2.00 20.00 -2.00 318.42 0.00e+00 2.199 0.000 302.00 328.00 3 7.8039e+00 3.4794e-02 3.0958e-02 -6.0000e+00 3.3540e-01 1.5294e-01 4.0680e-02 2.2291e-02 -6.0000e+00 3.6445e-01 -5.8534e-02 3.0568e-02 1.0586e-02 -6.0000e+00 2.1455e-01 2.9278e-02 1.5986e-02 3.2592e-03 -6.0000e+00 9.1175e-02 1.3448e-05 -1.8403e-03 6.8553e-04 3.3267e-05 -6.0000e+00 6.0549e-03 -1.7417e-02 -2.1108e-05 12 8 8 10 0 0 44.65 18.40 3.07 -0.01742 -0.03125 6 6 2 8 0 4000.000 15.00 18.40 19.17 21.79 21.79 22.1 983.66 -48872 900000 900000 900000 69509 900000 108766 900000 92845 900000 99300 62281 -47480 -40469 26683 -13581 900000 30144 81348 -144 900000 338 17975 9343 9101 -15113 8128 -4542 -12784 30468 19506 48926 9871 55104 4625 45039 -1140 21152 7640 -7657 4745 -525 1140 -7683 14190 -6598 -745 -24674 13908 128 9603 1249 4377 -16110 11887 -3567 5170 1733 4062 -408 -10430 18093 -11504 4770 -2288 7121 -1451 -184 -3765 -3 1481 1498 1617 -1339 8055 431 6363 -3284 8683 -5833 1937 -246 -1019 -469 -1342 4212 -753 -12 -2892 2778 -1495 859 280 -1847 244 4433 1937 -397 -77 315 3638 851 -1977 -7786 4294 -3830 -3625 529 1013 1497 3820 769 -4190 -416 -1626 1623 -705 -1764 -2722 -276 -1390 881 -928 3125 2673 -280 1409 1584 1989 -855 3124 -500 180 -3573 2875 -1529 422 2186 839 -484 -208 -2004 -782 -2469 900000 900000 900000 1610 900000 2519 900000 2150 900000 2300 1535 -3986 -3663 1506 -1317 900000 2138 3768 -15 900000 36 1626 987 1014 -2242 971 -582 -1656 2663 2113 4386 1414 5516 689 4441 -190 3366 1631 -2272 1377 -168 374 -2791 4128 -2383 -252 -10482 4016 43 3162 487 1761 -8499 4938 -1763 2398 828 1840 -190 -5510 7764 -7317 2820 -1480 3896 -816 -101 -2270 -2 1074 1132 1216 -990 5001 266 3351 -1827 4553 -3947 1379 -201 -902 -430 -1329 4227 -834 -14 -3383 2949 -1523 784 245 -1611 224 4248 2139 -505 -105 420 4391 963 -2113 -8987 4801 -4878 -4811 711 1433 2279 6110 1263 -7030 -651 -2372 2146 -952 -2505 -4170 -438 -2246 1355 -1412 4363 3655 -377 1767 1999 2729 -1267 4745 -818 299 -6405 5151 -3007 829 4302 1679 -942 -385 -3597 -1339 SS 20240610T132624.7Z 8927.560008 166 1 24.00 2 50.74 94.03 90.03 59.81 0.00 1 0.00 1 0 25 2.461e-01 2.618e-02 1.587e-01 1.578e-02 3.141018e-01 7.949787e-03 3.862199e-03 -6.000000e+00 1.403714e-01 232.61 -2.00 3.55 -2.00 318.22 0.00e+00 -4.742313e-03 1.466524e-03 7.557047e-04 -6.000000e+00 6.122351e-03 284.11 -2.00 20.00 -2.00 317.44 0.00e+00 1.577 0.000 302.00 328.00 3 8.0318e+00 2.1693e-02 2.3149e-02 -6.0000e+00 3.5291e-01 5.9629e-02 2.4668e-02 1.6786e-02 -6.0000e+00 3.8210e-01 5.0705e-02 1.6487e-02 9.1705e-03 -6.0000e+00 2.2686e-01 -3.0257e-02 8.5987e-03 4.4191e-03 -6.0000e+00 9.5775e-02 2.3059e-05 -3.3388e-05 4.4272e-04 3.4860e-05 -6.0000e+00 6.2763e-03 -2.0470e-02 1.6310e-04 12 9 8 11 8 0 -3.96 18.41 -1.51 -0.02047 -0.02072 6 6 2 8 0 4000.000 15.00 18.41 20.81 21.88 21.79 22.2 993.07 6869 143256 98050 51618 139199 23625 125202 11660 57800 46426 30791 39714 -6418 37333 17863 31792 8709 18617 -4672 4397 5758 9469 -2675 15048 -86 11685 7348 7512 6354 6354 5326 -7036 9139 643 172 -5979 1952 249 15625 -10441 4690 -18093 1026 -4667 5320 -6873 -12045 -6598 -1901 3795 -4353 4033 -5077 3762 -34 551 112 3825 992 -1730 -160 3624 -3025 -440 95 -2807 1284 -4963 4569 -5978 3373 -709 2613 -70 2948 6592 4980 5749 -2035 1548 45 2096 -3028 744 -1286 2829 -1460 -250 -1470 3275 779 588 3029 -2751 2522 -457 5970 869 2882 24 2409 -1805 -2166 -3480 1522 -2327 -2572 3634 -1392 1262 259 2074 -4112 270 -1039 -3478 248 -1025 -1164 -685 143 -1940 -777 100 2458 -1752 2500 -2579 2274 -2286 2320 102 458 -130 -1027 98 -234 2448 362 1770 -521 310 -1777 361 2646 2641 1960 2515 1006 2544 689 2580 2466 1911 2287 -636 2799 1796 3104 1119 2257 -748 670 892 1403 -466 2418 -17 2226 1484 1409 1091 1061 958 -1543 1873 151 38 -1346 450 68 4502 -4549 2008 -9857 476 -2294 2403 -3491 -6298 -3180 -861 1632 -2169 2002 -2928 2119 -21 344 72 2377 616 -1083 -100 2341 -2273 -336 72 -2087 856 -3440 3055 -4947 2890 -642 2284 -62 2358 4531 3234 3502 -1399 1130 38 1907 -3015 766 -1408 3189 -1804 -314 -1878 3824 882 610 2812 -2612 2415 -499 6802 1128 3900 32 2993 -2211 -2473 -4148 1892 -3059 -3533 4922 -2081 1966 420 3359 -6830 413 -1471 -4860 332 -1449 -1713 -1069 224 -3044 -1176 147 3344 -2372 3161 -3338 3029 -3417 3499 162 738 -212 -1802 180 -436 4552 691 3211 -927 526 -3081 SS 20240610T153238.3Z 8927.647666 236 1 24.00 2 29.02 125.18 69.35 79.61 0.00 1 0.00 1 0 17 4.932e-02 2.143e-02 4.607e-02 1.629e-02 2.259028e-01 8.171771e-03 2.894672e-03 -6.000000e+00 2.811812e-02 232.62 -2.00 3.55 -2.00 317.08 0.00e+00 1.197495e-03 1.090635e-03 5.486602e-04 -6.000000e+00 1.227615e-03 284.11 -2.00 20.00 -2.00 316.30 0.00e+00 1.143 0.000 302.00 328.00 3 8.5761e+00 2.1732e-02 1.6902e-02 -6.0000e+00 7.0692e-02 9.2209e-02 2.4407e-02 1.2724e-02 -6.0000e+00 7.6556e-02 -6.2828e-03 1.4369e-02 5.9006e-03 -6.0000e+00 4.5451e-02 -1.1672e-02 6.9126e-03 2.1263e-03 -6.0000e+00 1.9175e-02 2.3582e-05 -3.2978e-04 4.5117e-04 2.3472e-05 -6.0000e+00 1.2587e-03 -1.8450e-02 3.7100e-05 12 8 8 10 0 0 47.79 18.42 1.25 -0.01845 -0.02093 6 6 2 8 0 4000.000 15.00 18.42 22.59 21.88 21.79 22.5 1005.11 1150 20555 14934 11308 7269 -87 17727 -11233 3816 -5317 21884 8768 -16021 9074 3650 3183 2413 4919 4 -6037 10735 -5082 511 -826 -7418 -2343 -3786 -1104 -7669 3764 -142 2030 1821 -2367 6483 -2843 -6301 3369 6725 -6179 1620 -3312 3856 -1387 4070 -1542 -3915 -7052 -582 -255 -1009 3245 384 4786 2209 1657 3334 3037 857 -1462 -3036 -6252 -4783 1477 1417 -3406 -1320 -3090 2466 -787 4321 1421 2831 1861 3497 -180 2958 -321 -6 -1795 -499 644 -3132 1199 -1750 3388 738 1597 -1287 281 91 225 1134 -2883 230 -459 2287 -427 -484 -211 1625 438 2913 -2361 385 -1843 -1758 1997 -1765 1781 89 1944 -3725 -1163 -2360 1577 -628 -1228 -3665 -339 248 -555 512 259 2058 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