File name: Pandora64s1_NewHavenCT_20210729_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20260321T233248.1Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 64 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora64_OF_v3d20190516.txt Instrument calibration file used: Pandora64s1_CF_v4d20190911.txt Level 1 file used: Pandora64s1_NewHavenCT_20210729_L1_smca1c4d20190911p1-8.txt.bz2 Full location name: New Haven - Criscuolo Park CTDEEP (USEPA AQS ID 34-017-0006) Short location name: NewHavenCT Country of location: USA Location latitude [deg]: 41.3014 Location longitude [deg]: -72.9029 Location altitude [m]: 4 Local noon date: 20210729 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: Mod WL cal slit func 9 First and last pixel inside fitting window: 249 390 Nominal wavelengths inside fitting window [nm]: 305.1279 305.2688 305.4097 305.5506 305.6915 305.8324 305.9732 306.1141 306.2549 306.3958 306.5366 306.6774 306.8182 306.9590 307.0997 307.2405 307.3812 307.5220 307.6627 307.8034 307.9441 308.0848 308.2255 308.3662 308.5068 308.6475 308.7881 308.9287 309.0693 309.2099 309.3505 309.4911 309.6316 309.7722 309.9127 310.0533 310.1938 310.3343 310.4748 310.6153 310.7557 310.8962 311.0366 311.1771 311.3175 311.4579 311.5983 311.7387 311.8791 312.0195 312.1598 312.3002 312.4405 312.5808 312.7211 312.8614 313.0017 313.1420 313.2822 313.4225 313.5627 313.7030 313.8432 313.9834 314.1236 314.2638 314.4039 314.5441 314.6842 314.8244 314.9645 315.1046 315.2447 315.3848 315.5249 315.6649 315.8050 315.9450 316.0851 316.2251 316.3651 316.5051 316.6451 316.7850 316.9250 317.0649 317.2049 317.3448 317.4847 317.6246 317.7645 317.9044 318.0442 318.1841 318.3239 318.4638 318.6036 318.7434 318.8832 319.0230 319.1628 319.3025 319.4423 319.5820 319.7217 319.8614 320.0011 320.1408 320.2805 320.4202 320.5598 320.6995 320.8391 320.9787 321.1183 321.2579 321.3975 321.5371 321.6766 321.8162 321.9557 322.0953 322.2348 322.3743 322.5138 322.6532 322.7927 322.9322 323.0716 323.2110 323.3504 323.4899 323.6292 323.7686 323.9080 324.0474 324.1867 324.3260 324.4654 324.6047 324.7440 324.8833 --------------------------------------------------------------------------------------- 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 20210729T105200.1Z 7880.452779 212 1 48.86 2 78.94 74.84 46.05 214.44 0.00 1 0.00 1 0 17 4.711e-01 1.378e-02 1.462e-01 4.166e-03 6.894655e-01 2.372161e-03 8.491749e-03 -6.000000e+00 2.892122e-01 232.47 -2.00 3.52 -2.00 321.04 0.00e+00 3.061797e-03 1.132881e-03 5.419183e-03 -6.000000e+00 1.293224e-02 289.64 -2.00 20.00 -2.00 320.40 0.00e+00 5.024 0.002 302.00 328.00 3 2.8088e+00 8.0938e-03 6.7720e-02 -6.0000e+00 7.2478e-01 1.4494e-01 1.0714e-02 5.0287e-02 -6.0000e+00 7.8058e-01 -2.0460e-01 9.7347e-03 2.1881e-02 -6.0000e+00 4.6509e-01 7.6620e-02 4.6791e-03 5.2848e-03 -6.0000e+00 1.9660e-01 1.0005e-04 -6.9847e-04 1.2211e-04 1.1097e-04 -6.0000e+00 1.4032e-02 1.0659e-02 -1.0136e-04 12 8 8 10 0 0 98.11 21.26 0.27 0.01066 0.00541 41 10 1 5 0 1191.470 25.90 20.01 21.26 28.81 33.5 1045.08 -172067 -139098 -171664 -109295 -209525 -161103 -141278 31971 -136351 -108195 -155048 -126241 -107301 -109776 -49708 -57162 -63678 -23056 -39009 -44205 -53917 30421 31957 4463 -1031 3343 -20550 -26280 -25631 -22898 -27091 4503 -9935 3312 -25748 -23490 -12353 -3471 -1123 -3623 11450 1973 10940 2791 2502 3084 5268 2375 -8209 -8750 11668 577 10175 6475 7911 3854 3298 2924 8439 2629 4352 3650 8389 7124 9165 2560 3812 3577 3786 3528 3773 3626 -253 -110 332 -1925 -518 -3966 -1297 -525 -2662 192 -1963 -3219 -625 -391 927 389 1312 915 -1368 -482 -2696 -1339 -351 178 -1432 1090 -58 -985 -1416 -2580 -3940 335 -1066 -1767 -678 431 -751 1130 996 673 87 62 -651 -501 767 203 613 1243 289 643 792 612 1618 -1 -1697 688 1285 207 438 -1095 -834 -375 705 -56 -347 607 421 -192 -43 -1306 -2247 -1453 -2590 -888 -4134 -2057 -1640 130 -1899 -1224 -3059 -2308 -2086 -2771 -851 -1227 -1626 -435 -917 -1154 -1564 418 469 93 -22 73 -566 -755 -766 -771 -1148 161 -467 137 -1390 -1336 -724 -225 -86 -307 912 184 975 274 253 318 549 269 -1098 -1294 1589 97 1697 1212 1523 805 703 615 1650 553 965 914 2117 1999 2539 748 1137 1137 1373 1438 1626 1588 -110 -45 122 -669 -176 -1494 -556 -262 -1469 116 -1298 -2298 -467 -307 745 317 1041 689 -991 -333 -1907 -1019 -303 166 -1555 1291 -68 -1125 -1589 -2661 -3963 341 -1173 -2048 -836 539 -1057 1649 1574 1092 140 96 -972 -777 1152 321 1015 2061 470 1002 1200 935 2383 -2 -2513 1098 2184 374 858 -2297 -1765 -843 1670 -131 -829 1452 984 -446 -96 -2786 SS 20210729T111520.1Z 7880.468982 224 1 9.30 2 74.68 78.45 48.62 221.41 0.00 1 0.00 1 0 17 1.704e-01 1.294e-02 1.638e-01 7.493e-03 5.240101e-01 4.138512e-03 6.468200e-03 -6.000000e+00 1.046122e-01 232.47 -2.00 3.52 -2.00 319.98 0.00e+00 1.684891e-03 1.380900e-03 2.777900e-03 -6.000000e+00 4.717991e-03 289.64 -2.00 20.00 -2.00 319.22 0.00e+00 3.713 0.001 302.00 328.00 3 3.7796e+00 1.2283e-02 4.8185e-02 -6.0000e+00 2.6215e-01 4.6080e-02 1.4860e-02 3.2349e-02 -6.0000e+00 2.8238e-01 -6.7005e-02 1.1942e-02 1.4697e-02 -6.0000e+00 1.6833e-01 2.3018e-02 6.1069e-03 3.7499e-03 -6.0000e+00 7.1571e-02 1.5868e-04 -8.2333e-04 2.2957e-04 5.5987e-05 -6.0000e+00 5.0826e-03 1.1181e-02 -1.4166e-04 12 9 9 12 1 1 99.95 21.26 0.36 0.01118 0.00499 5 8 1 5 0 1520.660 26.00 20.01 21.26 28.86 33.2 1044.91 900000 -39916 32302 -65874 -18608 -87374 23585 -85502 41120 -69416 -30789 -35438 -40932 -35096 2217 -17137 -2323 -33458 -13730 -11954 -17509 28976 16467 711 -4375 3906 -6562 -3698 -9173 -14592 -6243 -9344 5270 -3460 -13638 -12438 -2977 -1114 703 6013 4180 -855 2617 2050 -1083 1077 -236 2597 -4929 990 2230 1529 669 3668 3353 5314 4105 1843 977 -1645 1351 3767 2125 5126 2492 364 -1657 501 2449 3760 659 2285 -986 358 -768 -3653 -1715 -4684 -2645 -2387 -2439 -315 -2279 -2236 282 3 2060 139 -171 608 -761 -1563 -2861 -2853 269 -139 -99 2019 946 -572 -906 -2464 -3266 12 340 -1180 -61 712 248 1770 1736 785 789 -98 -792 -1162 301 -266 1140 1048 382 -666 735 333 459 172 -1941 857 353 825 -233 -1023 -1020 -1278 624 216 -132 175 1180 -169 -116 -659 900000 -620 267 -1263 -227 -2074 218 -2498 401 -2028 -647 -922 -1383 -1362 71 -751 -95 -2047 -727 -655 -1023 1085 752 41 -280 239 -440 -233 -620 -1153 -524 -855 466 -333 -1407 -1363 -340 -150 112 1039 796 -171 525 417 -232 229 -51 565 -1198 244 602 452 215 1225 1163 1874 1486 673 355 -624 530 1593 955 2400 1182 170 -797 246 1336 2259 411 1426 -615 218 -431 -1934 -864 -2532 -1600 -1576 -1824 -257 -1917 -2002 265 3 2082 138 -168 584 -691 -1354 -2456 -2605 267 -149 -114 2533 1229 -725 -1074 -2847 -3704 14 403 -1481 -81 998 365 2687 2799 1287 1258 -149 -1199 -1733 455 -408 1821 1707 615 -1051 1160 502 670 243 -2767 1285 564 1423 -417 -1921 -1936 -2579 1267 453 -283 377 2477 -344 -235 -1283 SS 20210729T113248.3Z 7880.481115 234 1 13.01 2 71.45 81.16 50.80 226.25 0.00 1 0.00 1 0 25 8.828e-02 9.224e-03 6.358e-02 4.779e-03 4.459413e-01 2.608987e-03 5.270627e-03 -6.000000e+00 5.414069e-02 232.47 -2.00 3.52 -2.00 319.42 0.00e+00 9.413165e-04 7.228816e-04 7.592673e-04 -6.000000e+00 2.424583e-03 289.64 -2.00 20.00 -2.00 318.62 0.00e+00 3.104 0.001 302.00 328.00 3 4.0128e+00 7.4286e-03 3.9405e-02 -6.0000e+00 1.3567e-01 4.6556e-03 8.7284e-03 2.4123e-02 -6.0000e+00 1.4616e-01 8.2595e-03 6.5291e-03 1.1679e-02 -6.0000e+00 8.7083e-02 -1.2918e-02 3.3841e-03 3.1619e-03 -6.0000e+00 3.6781e-02 2.4748e-04 -1.3747e-03 1.4874e-04 3.8908e-05 -6.0000e+00 2.6315e-03 1.2278e-02 -2.8784e-04 12 9 1 12 1 1 99.99 21.26 0.16 0.01228 0.00195 13 13 1 5 0 915.740 25.90 20.00 21.26 28.92 33.4 1045.83 -35649 -18232 30952 -31359 -20857 -43338 -2995 -41544 9165 -19400 394 -22335 14150 -26946 8079 -5404 12753 -2060 962 -3213 -2260 1556 8693 -8763 7657 10726 303 -9547 4398 4612 7737 -942 7463 -196 322 -5527 -1117 -3255 -797 1037 -1690 730 -865 -568 -2611 -2667 -711 300 -3412 -4404 1593 1697 2067 1397 -418 1240 1037 261 1566 518 176 383 2082 2794 613 -682 179 -129 1960 1212 1641 1014 -855 616 -451 -328 -905 -1457 -1131 -169 -1256 635 -2182 -2047 -385 -61 -39 638 1039 1172 270 -123 -1786 -407 409 912 300 1355 413 -735 -1220 -2239 -2090 607 -138 -1744 90 -904 54 360 1020 776 254 -485 -172 -289 389 -533 374 583 -64 109 1349 -359 1618 424 -1170 240 380 316 512 -924 -438 -762 851 -90 -305 523 101 -120 154 -849 -914 -425 481 -785 -449 -1224 -63 -1452 214 -633 11 -911 482 -1558 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