File name: Pandora25s1_HoustonTX_20250516_L2Fit_fout2c9d20230101p1-8.txt File generation date: 20250517T063025.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c9p1-8 Local principal investigator: Jimmy Flynn Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 25 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora25_OF_v7d20190903.txt Instrument calibration file used: Pandora25s1_CF_v9d20230101.txt Level 1 file used: Pandora25s1_HoustonTX_20250516_L1_smca1c9d20230101p1-8.txt Full location name: University Of Houston Short location name: HoustonTX Country of location: United States Location latitude [deg]: 29.7200 Location longitude [deg]: -95.3400 Location altitude [m]: 19 Local noon date: 20250516 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: Modification of session 8, but repeated E-MLE of HCHO. First and last pixel inside fitting window: 281 423 Nominal wavelengths inside fitting window [nm]: 305.0808 305.2213 305.3618 305.5022 305.6427 305.7831 305.9235 306.0640 306.2044 306.3447 306.4851 306.6255 306.7658 306.9062 307.0465 307.1868 307.3272 307.4675 307.6077 307.7480 307.8883 308.0285 308.1688 308.3090 308.4492 308.5894 308.7296 308.8698 309.0100 309.1501 309.2903 309.4304 309.5705 309.7106 309.8507 309.9908 310.1309 310.2710 310.4110 310.5511 310.6911 310.8311 310.9711 311.1111 311.2511 311.3911 311.5310 311.6710 311.8109 311.9508 312.0907 312.2306 312.3705 312.5104 312.6503 312.7901 312.9300 313.0698 313.2096 313.3494 313.4892 313.6290 313.7688 313.9085 314.0483 314.1880 314.3277 314.4675 314.6072 314.7468 314.8865 315.0262 315.1658 315.3055 315.4451 315.5847 315.7243 315.8639 316.0035 316.1431 316.2826 316.4222 316.5617 316.7013 316.8408 316.9803 317.1198 317.2592 317.3987 317.5382 317.6776 317.8170 317.9564 318.0958 318.2352 318.3746 318.5140 318.6534 318.7927 318.9320 319.0714 319.2107 319.3500 319.4893 319.6285 319.7678 319.9070 320.0463 320.1855 320.3247 320.4639 320.6031 320.7423 320.8815 321.0206 321.1598 321.2989 321.4380 321.5771 321.7162 321.8553 321.9944 322.1334 322.2725 322.4115 322.5506 322.6896 322.8286 322.9676 323.1065 323.2455 323.3845 323.5234 323.6623 323.8012 323.9402 324.0790 324.2179 324.3568 324.4957 324.6345 324.7733 324.9122 --------------------------------------------------------------------------------------- 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: Temperature at electronics board [°C], 999=no temperature signal Column 95: Spectrometer control temperature [°C], 999=no temperature signal Column 96: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 97: Temperature in head sensor [°C], 999=no temperature signal Column 98: Humidity in head sensor [%], -9=no humidity signal Column 99: Pressure in head sensor [hPa], -9=no pressure signal Columns 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: 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 20250516T123200.4Z 9267.522227 220 1 49.68 2 77.63 74.75 74.37 222.69 0.00 1 0.00 1 0 17 2.954e-01 1.344e-02 1.194e-01 4.609e-03 5.475342e-01 2.504238e-03 5.824324e-03 -6.000000e+00 1.761081e-01 231.02 -2.00 3.24 -2.00 320.57 0.00e+00 2.370299e-03 9.813024e-04 4.336136e-04 -6.000000e+00 7.939008e-03 290.18 -2.00 20.00 -2.00 319.84 0.00e+00 4.534 0.001 302.00 328.00 3 3.5501e+00 7.9102e-03 5.2524e-02 -6.0000e+00 4.4112e-01 5.9535e-02 1.0062e-02 2.7034e-02 -6.0000e+00 4.7734e-01 -9.1559e-02 8.7234e-03 1.3814e-02 -6.0000e+00 2.8240e-01 3.5010e-02 4.3429e-03 4.9202e-03 -6.0000e+00 1.2031e-01 9.0868e-05 -7.6787e-04 1.3776e-04 5.4507e-05 -6.0000e+00 8.4750e-03 -1.0721e-02 0.0000e+00 12 9 8 11 8 0 99.98 24.14 0.23 -0.01072 -0.01649 53 11 1 5 0 937.280 26.73 20.00 24.14 32.69 33.4 1100.00 900000 -41869 -117581 1384 -66998 -114098 900000 -129714 900000 -107055 -46689 92478 -87999 -25070 -48630 900000 1171 66231 -32012 85607 2857 17307 -14580 -20097 -18707 17571 -29068 4229 -22376 -18456 69982 16451 11111 -7428 -18871 12610 22900 90150 18362 -6584 -6980 7554 -3364 10944 12248 12901 -11255 -4191 11276 829 8673 302 2415 9890 6318 3820 7694 -8433 1802 -387 4305 -940 -558 -2369 -1088 -259 2113 -1148 5541 2003 3400 2664 563 -730 3978 3782 -6954 2270 2424 1788 357 -744 -3762 980 -1260 -2496 -280 -1648 -776 -280 1268 -287 1242 -1469 -1467 936 -372 303 -344 -821 151 -1713 -858 -480 1657 -97 -811 -898 695 -1183 68 571 797 104 122 822 66 -115 -753 -510 -504 1013 643 406 119 1091 -193 1695 -199 -11 145 -280 -328 1497 -268 -472 70 550 -460 -301 212 -838 -79 900000 -494 -2881 11 -947 -2417 900000 -3797 900000 -3050 -810 500 -2909 -580 -1668 900000 33 1136 -1401 1388 99 531 -616 -957 -941 673 -1710 180 -1186 -992 1947 847 676 -566 -1551 775 1394 3512 1625 -857 -1017 1031 -531 1553 1743 1856 -2052 -730 1755 149 1579 65 557 2290 1594 1024 2044 -2608 499 -108 1184 -293 -193 -918 -436 -101 782 -444 2171 914 1686 1396 301 -381 1855 1611 -3032 900 1032 875 203 -480 -2707 715 -993 -2114 -244 -1501 -706 -248 1049 -226 920 -1112 -1194 834 -377 340 -419 -1019 178 -1912 -888 -491 1757 -110 -970 -1130 920 -1719 106 922 1293 166 184 1191 95 -172 -1182 -835 -835 1633 1013 625 177 1565 -271 2363 -302 -19 256 -521 -633 2958 -562 -1037 157 1249 -1057 -681 462 -1767 -161 SS 20250516T125011.4Z 9267.534854 229 1 8.23 2 73.81 76.75 77.02 225.61 0.00 1 0.00 1 0 25 3.013e-01 3.593e-02 6.375e-02 4.857e-03 4.182102e-01 2.518792e-03 4.911541e-03 -6.000000e+00 1.761392e-01 231.02 -2.00 3.24 -2.00 319.29 0.00e+00 1.130153e-02 6.485014e-04 1.409769e-03 -6.000000e+00 7.935327e-03 290.18 -2.00 20.00 -2.00 318.46 0.00e+00 3.525 0.000 302.00 328.00 3 3.3250e+00 7.1404e-03 4.0707e-02 -6.0000e+00 4.3971e-01 1.0259e-01 8.2604e-03 2.0865e-02 -6.0000e+00 4.7562e-01 -2.5396e-01 5.5189e-03 1.2347e-02 -6.0000e+00 2.8383e-01 1.3741e-01 2.8523e-03 8.2145e-03 -6.0000e+00 1.2035e-01 3.4043e-04 -6.2101e-03 1.4179e-04 1.0006e-04 -6.0000e+00 8.4515e-03 3.1959e-02 0.0000e+00 12 9 9 12 1 1 99.96 24.12 0.39 0.03196 -0.01471 8 11 1 5 0 913.000 26.73 20.00 24.12 33.05 33.2 1100.00 -161001 74407 75110 73842 60363 39860 140942 36705 72544 31153 33408 56465 15873 55232 24203 136049 40641 50412 40358 44926 42790 34085 32627 25276 14186 15134 17839 14018 18764 12024 37620 27235 29458 23118 19769 21093 21811 26836 12965 9841 7068 10953 5501 8598 9080 12247 7212 10888 15615 11311 13996 7873 7184 5023 5366 373 959 -5294 -1799 -2747 2527 401 3043 2929 2313 1619 1457 1464 1602 260 -1126 -2325 -2051 -3287 -2693 -1818 -5651 -2875 -694 -1294 -1454 -2299 -4130 -3076 -3571 -3409 -2748 -3257 -1551 -1294 -1273 -956 -1417 -1982 -1264 -1119 -1257 -427 -239 -705 428 -98 -525 -525 -865 -1160 -271 -344 660 1293 891 413 555 120 624 838 845 987 660 892 777 1043 1922 2149 1666 2080 1370 2647 1157 1669 284 613 494 302 -20 -308 -686 -880 -876 -1130 -1165 -1383 -1394 -32625 1935 2010 1892 1571 1174 1625 1174 1747 1116 1163 1701 831 2459 1718 3903 3055 3683 3395 3740 3654 3082 2968 2485 1562 1674 1919 1519 1917 1368 3789 3414 3997 3451 2903 2979 3258 4343 2757 2442 1950 3068 1683 2630 2821 3769 2344 3446 4782 3683 4715 3004 2920 2181 2388 175 451 -2614 -851 -1311 1195 208 1685 1748 1424 968 837 834 959 173 -819 -1771 -1560 -2447 -1887 -1170 -3499 -1704 -426 -890 -1116 -1941 -3759 -2895 -3533 -3543 -2960 -3621 -1715 -1404 -1320 -933 -1320 -1828 -1217 -1173 -1446 -532 -315 -940 547 -119 -606 -606 -1050 -1476 -356 -469 936 1931 1404 671 898 189 938 1212 1212 1450 1013 1424 1260 1678 3018 3297 2491 3014 1939 3712 1716 2622 472 1051 866 543 -38 -597 -1359 -1768 -1770 -2261 -2272 -2623 -2585 SS 20250516T130902.8Z 9267.547949 239 1 49.51 2 69.81 78.80 79.91 228.47 0.00 1 0.00 1 0 17 3.558e-01 2.693e-02 1.895e-01 1.057e-02 3.809378e-01 5.633606e-03 4.140602e-03 -6.000000e+00 2.122357e-01 231.02 -2.00 3.24 -2.00 319.30 0.00e+00 -3.621995e-03 1.456921e-03 3.211011e-04 -6.000000e+00 1.002409e-02 290.18 -2.00 20.00 -2.00 318.46 0.00e+00 2.866 0.000 302.00 328.00 3 6.1154e+00 1.5977e-02 3.4140e-02 -6.0000e+00 5.3184e-01 -1.2733e-03 1.8850e-02 1.8712e-02 -6.0000e+00 5.7503e-01 1.2004e-01 1.4079e-02 9.6961e-03 -6.0000e+00 3.4044e-01 -6.0258e-02 7.3263e-03 4.1839e-03 -6.0000e+00 1.4506e-01 4.0475e-05 8.2397e-05 3.2823e-04 3.9591e-05 -6.0000e+00 1.0240e-02 -2.0105e-02 0.0000e+00 12 8 8 10 0 0 99.98 24.14 0.01 -0.02011 -0.01949 74 16 1 5 0 668.990 26.73 19.99 24.14 33.27 33.4 1100.00 238483 56178 151875 900000 122657 107496 900000 -13975 900000 6533 25907 900000 -58746 92413 -49711 900000 1285 98596 -7341 64675 735 16643 -1224 -14756 3779 6506 3751 8217 17096 -16694 100753 12185 28273 3737 -5281 29447 31367 101778 9433 -449 -13192 12698 -6932 11074 5764 6383 -14270 -12749 9626 -103 6353 -7145 -4333 1709 5652 -1327 11820 -12072 -2138 -485 5936 -6257 -3478 -3821 -3639 -3269 -493 1610 4834 6939 5369 5204 -1312 -684 5230 8119 -9460 4716 4732 6654 -103 -2295 -2179 4581 -645 -5692 675 -2399 -1262 158 1538 252 852 160 -4066 1634 -40 2141 -230 -97 501 -1173 -1932 -879 2636 1974 -1044 -1666 2588 -634 -299 284 1455 -675 1052 1281 120 -2435 -285 -2184 -1540 838 1770 708 -1891 2953 -1298 2556 -551 108 -1022 -11 -1168 3417 -1442 -609 324 1522 -1048 -1018 1536 -2345 1780 2456 1066 1564 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