File name: Pandora107s1_LynnMA_20240607_L2Fit_fout2c7d20230718p1-8.txt File generation date: 20240916T085302.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c7p1-8 Local principal investigator: Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 107 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora107_OF_v1d20230601.txt Instrument calibration file used: Pandora107s1_CF_v7d20230718.txt Level 1 file used: Pandora107s1_LynnMA_20240607_L1_smca1c7d20230718p1-8.txt Full location name: Lynn Massachusetts Department of Environmental Protection Short location name: LynnMA Country of location: United States Location latitude [deg]: 42.4746 Location longitude [deg]: -70.9708 Location altitude [m]: 52 Local noon date: 20240607 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: OOB session based on clearance session 6 First and last pixel inside fitting window: 220 362 Nominal wavelengths inside fitting window [nm]: 305.0382 305.1791 305.3200 305.4608 305.6017 305.7426 305.8834 306.0242 306.1650 306.3059 306.4467 306.5874 306.7282 306.8690 307.0097 307.1505 307.2912 307.4319 307.5727 307.7134 307.8540 307.9947 308.1354 308.2761 308.4167 308.5573 308.6980 308.8386 308.9792 309.1198 309.2604 309.4009 309.5415 309.6820 309.8226 309.9631 310.1036 310.2441 310.3846 310.5251 310.6656 310.8060 310.9465 311.0869 311.2273 311.3678 311.5082 311.6485 311.7889 311.9293 312.0697 312.2100 312.3504 312.4907 312.6310 312.7713 312.9116 313.0519 313.1922 313.3324 313.4727 313.6129 313.7531 313.8934 314.0336 314.1738 314.3139 314.4541 314.5943 314.7344 314.8746 315.0147 315.1548 315.2949 315.4350 315.5751 315.7152 315.8552 315.9953 316.1353 316.2754 316.4154 316.5554 316.6954 316.8354 316.9753 317.1153 317.2552 317.3952 317.5351 317.6750 317.8149 317.9548 318.0947 318.2346 318.3744 318.5143 318.6541 318.7939 318.9338 319.0736 319.2134 319.3531 319.4929 319.6327 319.7724 319.9121 320.0519 320.1916 320.3313 320.4710 320.6107 320.7503 320.8900 321.0296 321.1693 321.3089 321.4485 321.5881 321.7277 321.8673 322.0068 322.1464 322.2859 322.4255 322.5650 322.7045 322.8440 322.9835 323.1230 323.2624 323.4019 323.5413 323.6808 323.8202 323.9596 324.0990 324.2384 324.3777 324.5171 324.6564 324.7958 324.9351 --------------------------------------------------------------------------------------- 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 20240607T114317.2Z 8924.488394 135 1 29.47 2 63.96 82.07 70.98 69.34 0.00 1 0.00 1 0 33 3.153e-02 9.874e-03 2.364e-02 3.882e-03 3.441685e-01 2.052957e-03 4.102801e-03 -6.000000e+00 1.912564e-02 232.51 -2.00 3.54 -2.00 318.44 0.00e+00 1.252968e-03 4.087498e-04 2.566987e-04 -6.000000e+00 8.453578e-04 284.82 -2.00 20.00 -2.00 317.67 0.00e+00 2.264 0.000 302.00 328.00 3 5.0614e+00 5.5952e-03 2.9243e-02 -6.0000e+00 4.8015e-02 6.0612e-02 6.3505e-03 1.8333e-02 -6.0000e+00 5.1760e-02 -1.5142e-02 4.1624e-03 8.9764e-03 -6.0000e+00 3.0772e-02 -1.9051e-03 2.1316e-03 2.6663e-03 -6.0000e+00 1.2904e-02 2.1901e-04 -1.2453e-04 1.1907e-04 2.9743e-05 -6.0000e+00 9.2836e-04 -3.3418e-02 0.0000e+00 12 8 8 10 0 0 99.98 21.97 0.76 -0.03342 -0.03435 17 17 1 5 0 1730.860 26.11 20.00 21.97 26.39 0.0 949.85 -15779 -7234 -9852 8746 -3872 48 -13477 -10332 7145 -12329 -201 2158 -6481 -7249 472 1177 1465 293 -1848 2320 -188 -1350 -1443 2093 1033 -2916 -3310 -3994 -3996 5540 1881 896 -549 -1988 -2364 1028 571 -288 -314 -1251 -2497 -1909 -425 -943 -311 990 -1274 -438 203 1871 3411 959 2888 1130 692 826 663 417 587 1031 1703 2191 2851 1546 -1179 -1929 999 1085 3101 102 -191 -456 -1840 -803 -331 472 -390 177 3181 -454 -49 -1858 -1687 -1053 -1121 -204 -222 -908 52 -449 -196 491 986 2029 1465 606 788 -139 -1215 -1587 -1404 -202 1125 1889 -1046 -1942 -849 -639 373 610 35 -717 -260 884 263 1780 1505 1368 712 -725 -893 -1048 1000 -68 69 -153 1116 1782 1052 -468 -714 -473 -80 797 -209 -435 244 381 -211 -608 -462 -427 466 -813 -396 -579 424 -201 2 -730 -602 395 -873 -13 143 -509 -671 48 133 180 38 -257 329 -28 -205 -224 324 173 -531 -605 -722 -699 874 314 167 -115 -438 -526 216 124 -71 -93 -431 -961 -787 -180 -408 -135 426 -559 -189 86 800 1498 458 1444 608 384 473 389 247 342 598 985 1337 1858 1087 -871 -1416 673 707 2054 77 -155 -389 -1610 -685 -267 354 -270 116 2072 -331 -40 -1663 -1615 -1054 -1176 -223 -256 -1088 62 -530 -221 519 969 1917 1428 640 906 -175 -1633 -2176 -1859 -248 1305 2179 -1284 -2540 -1145 -888 535 918 56 -1170 -422 1362 387 2488 2060 1925 1048 -1122 -1419 -1661 1535 -103 102 -216 1513 2366 1463 -698 -1132 -766 -131 1336 -366 -797 457 718 -402 -1151 -860 -764 809 SS 20240607T114853.3Z 8924.492284 138 1 29.04 2 62.94 82.95 70.04 70.12 0.00 1 0.00 1 0 28 3.428e-02 1.076e-02 2.443e-02 4.459e-03 3.367070e-01 2.354692e-03 4.065691e-03 -6.000000e+00 2.080119e-02 232.51 -2.00 3.54 -2.00 318.32 0.00e+00 4.262138e-04 4.518066e-04 4.743027e-04 -6.000000e+00 9.192380e-04 284.82 -2.00 20.00 -2.00 317.55 0.00e+00 2.186 0.000 302.00 328.00 3 5.3480e+00 6.3935e-03 2.8444e-02 -6.0000e+00 5.2222e-02 7.4574e-02 7.2449e-03 1.8061e-02 -6.0000e+00 5.6292e-02 -1.8869e-02 4.6714e-03 8.7730e-03 -6.0000e+00 3.3466e-02 6.4095e-04 2.3787e-03 2.4032e-03 -6.0000e+00 1.4036e-02 1.7855e-04 1.2632e-04 1.3651e-04 2.7857e-05 -6.0000e+00 1.0094e-03 -3.4672e-02 0.0000e+00 12 8 8 10 0 0 99.92 21.97 0.52 -0.03467 -0.03372 14 14 1 5 0 2073.060 26.11 20.00 21.97 26.64 0.0 950.24 -16016 593 -14931 -13587 -6516 -8133 -11261 -378 -3511 -4941 5734 -11796 -5446 24 -1290 1920 -740 -545 -2176 142 904 -109 11061 2723 -2 -4440 -2044 -6209 1668 2285 1077 5311 -3156 -2654 -4779 1662 1089 -2506 100 -2242 -2910 -1638 80 648 -28 -556 -90 1119 -290 1793 3083 2871 835 118 208 398 2379 -281 900 2132 1167 2090 2062 331 -635 399 1876 1349 4137 465 -1014 -1352 -1051 -279 -1274 -843 263 -92 2609 855 -91 -2366 -2194 -1567 -994 42 -423 104 -579 -465 91 -208 1784 1880 1481 997 1015 278 -1309 -1979 -1237 -838 569 1063 -1741 -2389 -966 -287 797 245 0 -455 -175 345 900 2235 1367 1593 519 77 -906 -667 580 -207 127 -29 1129 2798 754 -166 -482 -805 323 192 245 -442 -236 119 -389 -765 26 -555 467 -926 33 -1024 -902 -383 -456 -654 -22 -238 -362 390 -990 -469 2 -144 233 -99 -77 -327 22 142 -18 1619 447 0 -882 -398 -1219 294 392 192 1000 -707 -617 -1128 362 245 -664 31 -817 -1182 -704 35 288 -13 -252 -41 493 -128 785 1388 1383 437 66 119 234 1407 -171 538 1248 696 1303 1385 240 -476 291 1274 884 2769 352 -845 -1181 -927 -240 -1050 -645 183 -61 1715 623 -74 -2152 -2131 -1589 -1052 47 -494 125 -702 -551 103 -222 1750 1773 1448 1052 1171 349 -1759 -2728 -1642 -1034 660 1235 -2154 -3127 -1303 -398 1139 371 1 -743 -284 536 1317 3089 1867 2211 760 119 -1438 -1053 889 -309 184 -41 1512 3661 1042 -246 -753 -1294 524 322 427 -801 -438 224 -736 -1443 47 -986 809 SS 20240607T115859.2Z 8924.499296 144 1 3.53 2 61.09 84.54 68.34 71.52 0.00 1 0.00 1 0 33 1.893e-02 1.103e-02 1.188e-02 4.002e-03 3.106343e-01 2.125274e-03 3.720295e-03 -6.000000e+00 1.148808e-02 232.51 -2.00 3.54 -2.00 317.01 0.00e+00 5.675284e-04 2.873505e-04 7.802641e-05 -6.000000e+00 5.076154e-04 284.82 -2.00 20.00 -2.00 316.25 0.00e+00 2.059 0.000 302.00 328.00 3 3.5392e+00 5.6234e-03 2.6423e-02 -6.0000e+00 2.8841e-02 3.3574e-02 6.2761e-03 1.6390e-02 -6.0000e+00 3.1088e-02 -1.1073e-02 3.7035e-03 7.9415e-03 -6.0000e+00 1.8482e-02 -1.3591e-03 1.7776e-03 2.2244e-03 -6.0000e+00 7.7527e-03 1.3096e-03 2.1842e-04 1.2011e-04 2.6371e-05 -6.0000e+00 5.5744e-04 -3.5392e-02 0.0000e+00 12 9 9 12 1 1 74.98 21.98 0.32 -0.03539 -0.03375 3 34 1 5 0 876.110 26.11 20.00 21.98 26.60 0.0 949.50 -4068 -4904 -4503 -2698 -3677 -495 8233 -249 -2689 -5358 -2076 -1384 596 -704 4183 485 -2335 3504 -2040 -899 -74 4072 1689 111 1097 -1204 -1817 -2572 -577 4023 4053 704 -545 -3583 -3842 -553 2794 238 870 -1521 -2293 -1859 -730 -2043 -127 1069 -1866 -108 -177 657 1922 1874 1479 1257 1318 870 993 720 1320 2791 2339 2234 902 -67 -1306 -993 1238 809 3389 501 -1148 -1729 -1459 -1015 -1562 471 -530 1669 2014 -211 -386 -1602 -1403 -801 -500 -997 -755 -642 -513 -618 -19 400 1407 1494 2185 947 416 11 -1665 -1582 -1559 39 1354 1125 -826 -1690 -630 -821 527 238 -88 -706 -295 -440 1219 2000 1890 1483 1092 -301 -1220 -854 356 -293 340 107 1558 2291 842 -699 -440 -358 429 337 253 -735 -117 187 -317 -806 -533 -264 378 -442 -603 -579 -335 -438 -54 828 -30 -368 -796 -305 -209 95 -129 835 110 -578 863 -544 -246 -21 1116 476 32 336 -392 -594 -826 -178 1169 1204 231 -193 -1340 -1439 -198 997 96 402 -793 -1297 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