File name: Pandora75s1_EssexMD_20241223_L2Fit_fout2c1d20221230p1-8.txt File generation date: 20241224T051315.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 75 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora75_OF_v3d20220127.txt Instrument calibration file used: Pandora75s1_CF_v104d20221230.txt Level 1 file used: Pandora75s1_EssexMD_20241223_L1_smca1c1d20221230p1-8.txt Full location name: MDE Essex Monitoring Site Short location name: EssexMD Country of location: United States Location latitude [deg]: 39.3109 Location longitude [deg]: -76.4745 Location altitude [m]: 12 Local noon date: 20241223 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: OoB-data based on session 103 First and last pixel inside fitting window: 196 337 Nominal wavelengths inside fitting window [nm]: 305.0663 305.2078 305.3493 305.4908 305.6322 305.7737 305.9151 306.0566 306.1980 306.3394 306.4807 306.6221 306.7635 306.9048 307.0461 307.1874 307.3287 307.4700 307.6112 307.7524 307.8937 308.0349 308.1761 308.3172 308.4584 308.5996 308.7407 308.8818 309.0229 309.1640 309.3051 309.4461 309.5872 309.7282 309.8692 310.0102 310.1512 310.2921 310.4331 310.5740 310.7149 310.8558 310.9967 311.1376 311.2784 311.4193 311.5601 311.7009 311.8417 311.9825 312.1233 312.2640 312.4048 312.5455 312.6862 312.8269 312.9676 313.1083 313.2489 313.3896 313.5302 313.6708 313.8114 313.9520 314.0925 314.2331 314.3736 314.5141 314.6547 314.7951 314.9356 315.0761 315.2165 315.3570 315.4974 315.6378 315.7782 315.9186 316.0590 316.1993 316.3397 316.4800 316.6203 316.7606 316.9009 317.0411 317.1814 317.3216 317.4619 317.6021 317.7423 317.8825 318.0227 318.1628 318.3030 318.4431 318.5832 318.7233 318.8634 319.0035 319.1436 319.2836 319.4237 319.5637 319.7037 319.8437 319.9837 320.1237 320.2636 320.4036 320.5435 320.6834 320.8233 320.9632 321.1031 321.2430 321.3828 321.5227 321.6625 321.8023 321.9421 322.0819 322.2217 322.3615 322.5012 322.6409 322.7807 322.9204 323.0601 323.1998 323.3395 323.4791 323.6188 323.7584 323.8980 324.0376 324.1772 324.3168 324.4564 324.5960 324.7355 324.8750 --------------------------------------------------------------------------------------- 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 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: 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 20241223T142120.8Z 9123.598158 330 1 50.08 2 73.49 141.12 59.74 232.58 0.00 1 0.00 1 0 17 2.009e-01 1.089e-02 1.857e-01 6.870e-03 4.669268e-01 3.730691e-03 5.488803e-03 -6.000000e+00 1.203603e-01 223.32 -2.00 3.48 -2.00 320.22 0.00e+00 3.451732e-03 1.261582e-03 8.791560e-04 -6.000000e+00 5.307607e-03 277.97 -2.00 20.00 -2.00 319.67 0.00e+00 3.463 0.001 302.00 328.00 3 4.3929e+00 1.0934e-02 4.1930e-02 -6.0000e+00 2.9600e-01 1.0260e-01 1.3305e-02 2.4144e-02 -6.0000e+00 3.2080e-01 -5.9105e-02 1.1790e-02 1.3280e-02 -6.0000e+00 1.9090e-01 6.8701e-03 6.0568e-03 5.1445e-03 -6.0000e+00 8.1669e-02 1.1460e-04 -1.6950e-03 2.2500e-04 6.7084e-05 -6.0000e+00 6.1756e-03 -2.1427e-02 2.0836e-04 12 9 8 11 24 0 -29.77 22.75 0.43 -0.02143 -0.03416 13 2 1 5 0 3851.900 25.68 20.00 22.75 1.96 5.7 838.51 -91970 -12353 -188 -62764 27133 900000 -13946 -36910 130829 -43763 -58845 90107 -34183 -11644 -25073 -44926 27370 11017 17732 -13605 2680 4666 21892 3852 15805 -9321 3555 2209 2096 -32521 15565 13024 7319 -8892 4767 1296 -2043 -9783 -16280 1083 -8555 -81 -336 7659 259 -1290 772 1140 1922 2572 -3019 1554 4035 1796 4533 1257 1201 1022 -3464 1922 2702 2654 3122 1323 2798 700 -4224 -1865 3056 5087 1709 1911 937 1479 783 -2612 -510 -2798 -2223 -262 -577 -2224 -2216 -2370 -1807 -1463 137 919 519 2339 1323 -2091 -1167 -1774 1950 957 968 -515 928 157 -1934 -956 -1089 -403 -531 -850 -1680 447 -290 961 499 690 261 89 -1082 268 -80 -885 122 101 548 828 702 1952 -131 -438 -482 225 -971 106 -77 -421 151 17 -1 74 670 -186 762 -452 -219 -851 -2053 -145 -2 -1414 231 900000 -178 -652 876 -986 -1612 603 -937 -312 -931 -2380 783 402 648 -712 122 210 853 190 731 -579 197 121 112 -2554 843 825 548 -828 380 106 -188 -1126 -2389 157 -1526 -14 -62 1467 54 -277 164 244 416 577 -772 414 1132 551 1418 418 407 346 -1204 631 912 972 1259 589 1259 312 -1918 -837 1406 2569 974 1133 557 832 409 -1279 -228 -1269 -1085 -143 -362 -1586 -1711 -1946 -1574 -1351 130 890 503 2137 1138 -1730 -910 -1408 1618 905 1037 -623 1171 198 -2338 -1053 -1135 -424 -594 -1008 -2122 588 -414 1474 822 1165 434 141 -1630 382 -115 -1339 192 166 899 1324 1089 2870 -188 -605 -652 314 -1492 176 -137 -789 292 35 -1 167 1543 -439 1764 -1023 -473 -1774 SS 20241223T142700.3Z 9123.602087 333 1 50.19 2 72.81 142.28 60.61 233.82 0.00 1 0.00 1 0 25 1.774e-01 1.096e-02 1.539e-01 6.262e-03 4.431861e-01 3.373947e-03 5.440427e-03 -6.000000e+00 1.058293e-01 223.32 -2.00 3.48 -2.00 320.11 0.00e+00 2.334199e-03 1.102817e-03 2.061250e-03 -6.000000e+00 4.623889e-03 277.97 -2.00 20.00 -2.00 319.55 0.00e+00 3.335 0.001 302.00 328.00 3 4.4142e+00 9.8059e-03 4.0920e-02 -6.0000e+00 2.6051e-01 5.7201e-02 1.1851e-02 2.5061e-02 -6.0000e+00 2.8227e-01 -3.7749e-02 1.0227e-02 1.3258e-02 -6.0000e+00 1.6830e-01 4.4857e-03 5.2639e-03 4.1130e-03 -6.0000e+00 7.2157e-02 1.3366e-04 -1.2749e-03 2.0618e-04 6.4493e-05 -6.0000e+00 5.4544e-03 -2.4806e-02 1.2515e-04 12 9 8 11 24 0 11.28 22.75 0.24 -0.02481 -0.03439 14 2 1 5 0 3584.530 25.68 20.00 22.75 2.43 5.7 842.33 106121 -31501 -24794 -23105 -16700 -64740 8821 9665 -82034 -72965 81833 -22712 -45172 -2845 -31572 -3373 -11544 6072 -10866 4698 -3672 -743 4463 -2844 -9434 224 -6881 -11291 -7543 -22526 -1824 18735 2299 9530 -8568 -3547 -1786 -2948 3257 2879 2323 -883 -3627 2026 -2105 3878 2698 354 5872 -3354 3282 367 5320 965 5082 1055 3776 2612 -3829 -47 1312 1492 2548 4052 1536 658 -3874 224 502 578 1949 2019 2162 162 277 -1865 -3795 -3894 -5548 -357 164 -1584 -1206 -2509 -1151 178 1043 64 1398 1029 -1642 863 -28 -1650 212 237 55 -110 451 92 -1106 -1806 -1379 -780 -1518 -1165 -1852 -14 490 1919 1604 894 53 -402 -161 624 -2 -684 583 54 463 950 656 556 -744 448 -533 907 -621 337 -668 -904 -180 160 -640 -614 714 572 554 246 -716 -424 648 -559 -440 -398 -250 -1509 103 123 -2914 -2551 636 -542 -1580 -79 -1402 -131 -538 256 -579 224 -196 -39 228 -166 -623 14 -470 -783 -490 -1750 -128 1206 194 788 -832 -327 -175 -340 423 441 400 -168 -813 439 -481 843 596 81 1287 -839 828 104 1543 312 1654 369 1307 912 -1402 -16 472 580 1081 1831 727 303 -1810 101 244 315 1142 1232 1309 96 150 -938 -1810 -1842 -2882 -201 105 -1148 -942 -2108 -1019 165 1007 64 1375 975 -1490 709 -22 -1334 182 229 60 -134 576 117 -1335 -2024 -1459 -836 -1744 -1411 -2384 -19 704 2947 2635 1515 89 -640 -240 887 -4 -1033 919 90 764 1526 1025 834 -1080 618 -726 1261 -952 557 -1190 -1690 -347 324 -1379 -1382 1627 1326 1275 548 -1543 -875 SS 20241223T143736.5Z 9123.609450 336 1 52.73 2 71.59 144.48 62.29 236.07 0.00 1 0.00 1 0 17 1.129e-01 8.628e-03 7.644e-02 4.760e-03 4.167676e-01 2.518711e-03 5.048112e-03 -6.000000e+00 6.735144e-02 223.32 -2.00 3.48 -2.00 319.75 0.00e+00 2.665721e-03 7.441307e-04 1.531608e-03 -6.000000e+00 2.943241e-03 277.97 -2.00 20.00 -2.00 319.18 0.00e+00 3.126 0.000 302.00 328.00 3 4.3904e+00 7.1065e-03 3.7933e-02 -6.0000e+00 1.6579e-01 4.7585e-02 8.4247e-03 2.2200e-02 -6.0000e+00 1.7965e-01 -2.9194e-02 6.9790e-03 1.1907e-02 -6.0000e+00 1.0712e-01 1.1959e-03 3.6540e-03 3.9809e-03 -6.0000e+00 4.5915e-02 1.7302e-04 -1.1632e-03 1.5423e-04 5.4305e-05 -6.0000e+00 3.4722e-03 -2.3875e-02 1.1044e-04 11 9 0 11 24 0 -13.08 22.77 0.40 -0.02387 -0.03262 17 3 1 5 0 3101.110 25.68 20.00 22.77 3.51 5.7 849.47 -77513 37489 -20033 28565 -35065 -29768 1035 -25538 -18786 -38770 -29479 -30287 -34783 11608 -1484 -7432 3796 -1710 -3471 3008 -3898 2036 -2331 -4680 -10159 -4402 -31 6742 11863 -5018 3024 2771 -1101 -6375 -6798 -6342 -3002 -65 -2836 -2037 -115 469 -1010 1625 5665 2169 1905 -1136 -1740 -433 1215 1041 -526 2125 1387 242 297 -2107 -466 -250 3444 3502 3598 2023 3230 581 -1538 689 449 2752 934 1424 623 86 114 -1364 -1137 -2898 -2255 -517 -1711 -1507 -2205 -1560 -906 -145 248 1141 870 748 400 248 -1517 -1129 273 -588 -90 599 291 -99 -1016 -1988 -308 -1075 -1703 -432 -549 -540 142 1070 1309 885 212 -313 76 -197 -298 194 551 365 331 816 954 667 -364 -610 -524 -10 415 -480 -404 -541 -139 183 -2 41 9 669 67 116 -272 -828 -2518 443 -448 386 -829 -641 17 -603 -460 -1243 -896 -997 -1394 353 -61 -376 189 -97 -212 180 -257 127 -156 -340 -823 -351 -2 472 766 -394 265 274 -125 -802 -839 -777 -386 -9 -504 -421 -26 112 -255 410 1386 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