File name: Pandora206s1_BuffaloNY_20240505_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T081326.8Z 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_20240505_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: 20240505 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 20240505T132236.9Z 8891.557372 151 1 24.01 2 55.08 100.23 45.42 145.07 0.00 1 0.00 1 0 17 1.989e-01 2.663e-02 1.479e-01 2.064e-02 2.835383e-01 1.025843e-02 3.486444e-03 -6.000000e+00 1.124858e-01 230.11 -2.00 3.55 -2.00 318.17 0.00e+00 1.529028e-03 1.846290e-03 5.726294e-04 -6.000000e+00 4.871173e-03 280.29 -2.00 20.00 -2.00 317.47 0.00e+00 1.742 0.000 302.00 328.00 3 8.2321e+00 2.7858e-02 2.3089e-02 -6.0000e+00 2.8143e-01 6.6763e-02 3.1584e-02 1.5804e-02 -6.0000e+00 3.0545e-01 6.2294e-03 2.0376e-02 7.3716e-03 -6.0000e+00 1.8133e-01 -3.4205e-03 1.0490e-02 2.6424e-03 -6.0000e+00 7.6722e-02 1.6935e-05 3.7795e-04 5.8024e-04 2.4849e-05 -6.0000e+00 5.0707e-03 -2.1778e-02 2.3523e-04 12 8 8 10 0 0 67.99 18.51 2.67 -0.02178 -0.01894 6 6 2 8 0 4000.000 15.00 18.51 21.25 21.88 21.88 22.1 1036.25 -51052 -34070 46049 65055 37532 91852 78589 77013 53539 87462 69310 17392 -11770 30824 11028 -5619 26825 12015 -1699 16335 23883 -14398 15413 7450 4507 -7289 13368 5511 -3880 3351 10490 11258 17423 13269 -8412 2460 -13753 8586 15689 -9485 -6017 313 -1388 -2042 238 -4293 -8775 -14629 2316 1452 10705 -836 376 3608 6668 -717 1697 -1157 1472 -2753 -5281 3156 -4743 1346 608 -567 -1252 -2217 -191 -6379 5845 1391 1870 -1088 5113 351 1103 -1210 -3408 -687 769 1082 -3080 965 351 -411 4219 19 -1716 -851 1520 -1479 5335 970 1874 -4095 2454 -833 1969 1123 3274 -901 -1240 -3032 2649 -2095 -465 1060 -430 -495 6020 627 -2740 140 -4080 1666 -2406 -1341 -2358 -347 916 -2118 -584 90 3690 -1617 -510 -114 1487 502 -104 -1552 139 223 519 -341 -1096 1306 972 866 419 -819 -400 -5781 -3739 2441 2707 1788 2487 2564 2834 2695 3461 3224 1331 -1374 2731 1377 -901 3366 1763 -299 2576 3574 -3002 2503 1390 904 -1712 2584 1084 -773 614 1929 2221 3543 2956 -2145 540 -3895 2242 4591 -4090 -2751 145 -654 -1013 115 -2178 -4581 -7903 1038 656 4677 -442 207 2036 3772 -443 1045 -729 881 -1702 -3445 2038 -3616 1041 475 -410 -848 -1471 -131 -5330 4754 1234 1649 -949 3895 250 728 -773 -2326 -519 623 970 -3076 962 378 -479 4929 24 -2210 -1044 1672 -1531 4871 889 1808 -4498 2812 -1101 2696 1517 4050 -1066 -1416 -3514 3182 -2773 -632 1489 -643 -792 9567 1032 -4485 214 -5945 2215 -3214 -1848 -3526 -543 1442 -3371 -893 131 5041 -2224 -655 -146 2026 739 -158 -2448 218 363 897 -625 -2067 2461 1850 1594 745 -1418 -693 SS 20240505T144918.8Z 8891.617579 196 1 25.43 2 40.21 120.09 39.69 175.48 0.00 1 0.00 1 0 17 1.467e-01 3.158e-02 1.375e-01 2.926e-02 2.617963e-01 1.460162e-02 3.104804e-03 -6.000000e+00 8.291699e-02 230.11 -2.00 3.55 -2.00 317.76 0.00e+00 -3.956027e-03 2.294385e-03 6.933781e-05 -6.000000e+00 3.592728e-03 280.29 -2.00 20.00 -2.00 317.04 0.00e+00 1.308 0.000 302.00 328.00 3 8.6914e+00 3.9352e-02 1.9044e-02 -6.0000e+00 2.0745e-01 6.6676e-02 4.4402e-02 1.4269e-02 -6.0000e+00 2.2520e-01 1.8867e-02 2.7418e-02 6.9748e-03 -6.0000e+00 1.3368e-01 -2.2944e-02 1.3814e-02 3.6546e-03 -6.0000e+00 5.6530e-02 1.7104e-05 -7.4749e-04 8.2798e-04 3.1083e-05 -6.0000e+00 3.7401e-03 -1.9920e-02 1.5639e-04 12 8 8 10 0 0 -58.41 18.47 2.14 -0.01992 -0.02554 16 16 1 8 0 1589.250 14.99 18.47 23.28 21.88 21.88 21.9 1047.03 -5924 7454 -3319 61211 16967 56163 24131 61688 7144 62850 37120 67497 -16993 10967 1410 -16792 -1929 -1938 12935 -11790 23361 -1635 32504 6144 3200 -7325 18916 -2308 -3585 -11696 18708 42319 -854 6192 -9930 8831 -7754 18928 5708 6477 -3867 4192 609 2897 1520 -16828 -9978 -19716 235 4455 3481 1462 7265 3216 7849 344 -4998 -5262 445 -10045 873 -955 -3544 3939 -5903 1372 -2348 3270 514 -1615 4358 5610 1234 2107 6709 414 2941 -553 -3452 -1090 -222 2644 2331 -1719 2598 260 1583 -741 422 2365 -1155 -1553 1911 -4100 -643 342 1726 940 612 5449 2631 838 -1928 -4035 -127 -3777 855 770 352 -598 1223 245 -797 -2122 -1902 -1611 -1140 -3292 -2019 796 5 3220 -568 -1818 4153 1451 -3209 1489 1666 218 913 213 -1709 -3345 34 -1037 -2362 1806 2298 2540 998 -783 -623 -577 697 -356 3368 1262 2690 1721 3457 766 4355 3291 4402 -2742 1500 239 -3641 -385 -399 2380 -2781 4114 -365 5309 1421 816 -2184 4392 -615 -871 -2957 3794 7202 -234 1663 -2892 2115 -2327 5047 2111 2842 -2077 2161 334 1556 814 -10745 -5792 -12182 116 2095 1747 806 3981 1946 4711 227 -3575 -3769 293 -7205 571 -679 -2797 3089 -5111 1007 -1711 2179 370 -1311 3675 4885 1125 1898 5373 315 1957 -356 -2364 -822 -186 2387 2259 -1803 2798 308 1946 -929 544 2875 -1336 -1644 1780 -3873 -618 359 1975 1206 839 6952 3233 965 -2123 -4674 -155 -5041 1135 1072 515 -938 1992 409 -1291 -3235 -2640 -2151 -1506 -4623 -2897 1189 8 4894 -877 -2713 5504 1884 -4117 1818 2178 309 1351 327 -2706 -5564 59 -1892 -4464 3353 4281 4570 1756 -1352 -1044 SS 20240505T155253.1Z 8891.661726 232 1 24.00 2 31.36 141.53 40.88 199.54 0.00 1 0.00 1 0 17 8.735e-02 2.346e-02 5.872e-02 1.463e-02 2.475671e-01 7.284004e-03 2.935652e-03 -6.000000e+00 4.939580e-02 230.12 -2.00 3.55 -2.00 317.60 0.00e+00 -1.933495e-03 1.105008e-03 3.464177e-04 -6.000000e+00 2.138876e-03 280.30 -2.00 20.00 -2.00 316.88 0.00e+00 1.170 0.000 302.00 328.00 3 8.4588e+00 1.9488e-02 1.7555e-02 -6.0000e+00 1.2359e-01 2.5044e-03 2.1958e-02 1.3302e-02 -6.0000e+00 1.3413e-01 2.1295e-02 1.3483e-02 6.2948e-03 -6.0000e+00 7.9630e-02 -1.2898e-02 6.7461e-03 2.4307e-03 -6.0000e+00 3.3689e-02 2.5684e-05 2.1502e-04 4.0978e-04 2.2582e-05 -6.0000e+00 2.2263e-03 -1.9438e-02 3.3786e-04 12 9 8 11 8 0 29.27 18.45 0.98 -0.01944 -0.01782 6 6 2 8 0 4000.000 15.00 18.45 22.57 21.88 21.88 21.6 1040.91 -19707 22312 27043 6102 41314 -2912 59691 21129 21325 15720 18747 2352 -12236 8384 3629 -4273 10580 7534 -4810 2149 11226 1750 7445 7022 -3058 6150 1111 2317 -12345 3672 970 -2929 2505 2567 -2176 -9800 -2036 -6611 8994 -2450 1659 -4431 -6409 -991 6471 -2871 -6541 -11150 533 -2494 -2511 1887 -11 1471 332 1618 2356 563 -73 -3647 -4297 5779 -214 -183 1606 -1798 895 -2952 1977 -1544 5168 786 2161 3761 3054 -2390 -601 -3681 -6764 -1640 -3333 3376 421 583 6845 1488 -664 865 76 2392 750 -1284 1111 -5189 -752 -817 1972 -1598 2404 1269 1911 -946 -2102 -3186 743 -3440 591 2075 -903 1919 1298 1660 -1631 -461 -2410 -225 -3586 -1191 -2686 442 698 -414 2279 1151 3329 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