File name: Pandora64s1_NewHavenCT_20210716_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20260321T233033.3Z 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_20210716_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: 20210716 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 20210716T104706.1Z 7867.449376 81 1 46.94 2 78.05 72.07 138.68 16.63 0.00 1 0.00 1 0 25 3.376e-01 2.196e-02 1.381e-01 7.185e-03 5.934550e-01 4.040862e-03 7.705096e-03 -6.000000e+00 2.075724e-01 232.93 -2.00 3.52 -2.00 320.74 0.00e+00 4.829069e-03 1.660141e-03 5.357879e-03 -6.000000e+00 9.256949e-03 289.35 -2.00 20.00 -2.00 320.05 0.00e+00 4.680 0.002 302.00 328.00 3 4.0891e+00 1.3014e-02 6.1737e-02 -6.0000e+00 5.2085e-01 2.2734e-01 1.6233e-02 4.4872e-02 -6.0000e+00 5.6081e-01 -3.0981e-01 1.3220e-02 1.9188e-02 -6.0000e+00 3.3394e-01 1.2462e-01 6.5287e-03 4.3149e-03 -6.0000e+00 1.4096e-01 4.1792e-05 -1.2278e-03 2.1984e-04 1.0677e-04 -6.0000e+00 1.0056e-02 1.1461e-02 -1.1103e-04 12 8 8 10 0 0 91.57 21.20 0.17 0.01146 0.00223 14 3 1 5 0 3350.510 25.90 20.01 21.20 31.34 33.4 1062.36 -91206 -58532 -101700 -83426 -157311 -94306 -149263 -111985 -52370 -63033 -94198 14463 -15714 -81728 32550 -17027 -4916 38646 -19809 6040 32018 -77120 113254 38636 13644 26767 -26199 -28446 13563 -25808 7898 17830 13941 237 29223 -3890 12523 -3086 19063 -280 17091 5895 25368 2445 14853 1216 14677 1383 -4513 -18592 21098 -2396 12060 18994 6909 -760 6426 -4339 10811 1288 7664 -2369 8716 6397 9956 2855 3706 7698 6366 4950 7472 2325 344 -457 -3946 -951 -2125 -4782 -7015 1287 -7679 194 -3582 -1210 -1573 -204 1455 -185 1473 2567 -1915 2049 -7207 -3613 -2688 2100 -1637 1874 -194 -395 -2262 -3942 -5342 974 20 -2062 -2489 3206 -1717 1371 1295 377 1071 1048 -478 -1531 422 572 721 926 834 1398 1213 -1074 2706 476 -1481 2264 1309 -549 -11 -324 -584 -1210 875 -373 311 356 764 -939 -304 -1179 -1917 -965 -2640 -1650 -5755 -1982 -5519 -3323 -928 -1299 -2795 184 -317 -3722 641 -589 -164 908 -873 214 871 -5913 1537 1099 517 916 -1501 -1618 520 -1557 423 977 890 16 1529 -285 882 -302 1781 -36 2002 814 3002 367 2012 192 2062 230 -785 -4017 3597 -533 2504 3929 1663 -204 1618 -1195 2515 335 1995 -757 2773 2257 3374 1009 1319 2756 2615 2303 3408 1133 165 -217 -1767 -379 -838 -2038 -3525 657 -4884 128 -2607 -915 -1283 -165 1201 -157 1209 2067 -1509 1477 -5622 -2920 -2323 1977 -1815 2233 -233 -479 -2601 -4212 -5598 1016 23 -2470 -3064 4001 -2479 2112 2048 611 1689 1648 -726 -2316 647 917 1167 1520 1341 2260 1912 -1655 3896 677 -2138 3432 2137 -999 -22 -637 -1210 -2683 1942 -863 728 842 1761 -2092 -670 -2508 SS 20210716T105232.6Z 7867.453155 84 1 48.83 2 77.08 72.90 138.41 18.55 0.00 1 0.00 1 0 17 2.899e-01 1.676e-02 7.544e-02 4.733e-03 5.579123e-01 2.638494e-03 7.305789e-03 -6.000000e+00 1.782663e-01 232.93 -2.00 3.52 -2.00 320.49 0.00e+00 6.383054e-03 1.005781e-03 4.507091e-03 -6.000000e+00 7.946681e-03 289.35 -2.00 20.00 -2.00 319.77 0.00e+00 4.352 0.001 302.00 328.00 3 3.8512e+00 8.2006e-03 5.5941e-02 -6.0000e+00 4.4732e-01 1.5479e-01 1.0072e-02 3.7577e-02 -6.0000e+00 4.8161e-01 -2.2944e-01 8.1089e-03 1.8526e-02 -6.0000e+00 2.8678e-01 8.9942e-02 4.0625e-03 5.1236e-03 -6.0000e+00 1.2108e-01 7.6437e-05 -6.3984e-04 1.4552e-04 1.1263e-04 -6.0000e+00 8.6350e-03 1.1507e-02 -5.4755e-05 12 8 8 10 0 0 80.98 21.20 0.24 0.01151 0.00670 22 5 1 5 0 2219.220 25.90 19.97 21.20 31.51 33.4 1063.51 -114919 -74369 -107704 -60591 -146672 -77314 -113125 -74785 -76416 -15042 -111773 -22773 -61645 -26801 -20430 -7488 -39984 18328 -27749 29427 -20145 37747 9397 14975 -14359 21378 -19210 -18905 -14813 -10960 -7540 -253 15944 -6864 4753 -9208 2026 -3327 9814 -369 14450 2546 11099 4381 2944 3549 10756 215 -2054 -9857 12094 -1245 5710 -515 9238 -3726 4968 -294 7965 1870 4704 2947 10260 6139 9786 1205 1874 1917 4810 2389 3329 2804 764 -1325 -1600 -2010 -3007 -3797 -2855 -363 -3961 -1334 -1975 -2510 106 -809 448 288 1259 2140 -1101 985 -4055 -2216 -589 469 -2017 743 -386 -907 -1718 -2439 -4701 67 -795 -1725 -1322 1196 -990 1716 636 -31 598 601 -719 -132 134 313 1000 1253 251 962 1491 -307 1991 814 -1833 1112 1164 225 684 -778 -705 -166 767 -217 -175 401 226 -686 -158 -1437 -3252 -1642 -3181 -1098 -5505 -1580 -3306 -1750 -1965 -218 -4195 -450 -2105 -857 -691 -272 -2042 610 -1434 960 -1004 1132 393 622 -773 888 -1105 -1059 -820 -657 -513 -18 1084 -583 345 -819 183 -375 1153 -51 1987 391 1632 699 488 597 1712 39 -399 -2229 2435 -311 1433 -146 2451 -1158 1429 -88 2159 550 1441 1021 3666 2468 3759 488 763 815 2115 1200 1752 1505 404 -671 -739 -909 -1341 -1793 -1446 -208 -2670 -977 -1462 -1988 88 -713 406 264 1126 1792 -890 783 -3149 -1808 -535 480 -2268 903 -487 -1110 -1973 -2584 -5220 76 -910 -2086 -1705 1611 -1421 2629 1052 -50 975 932 -1074 -193 202 494 1659 2111 419 1544 2318 -464 2851 1199 -2618 1676 1948 395 1282 -1546 -1404 -350 1702 -478 -392 907 502 -1532 -336 -2967 SS 20210716T105825.1Z 7867.457235 87 1 47.62 2 76.02 73.79 138.08 20.60 0.00 1 0.00 1 0 17 2.316e-01 1.189e-02 7.420e-02 3.588e-03 5.310829e-01 1.984848e-03 6.293196e-03 -6.000000e+00 1.424241e-01 232.93 -2.00 3.52 -2.00 320.26 0.00e+00 3.126895e-03 7.172313e-04 1.875477e-03 -6.000000e+00 6.350498e-03 289.35 -2.00 20.00 -2.00 319.52 0.00e+00 4.045 0.001 302.00 328.00 3 3.7368e+00 6.0415e-03 5.0056e-02 -6.0000e+00 3.5738e-01 4.0593e-02 7.4176e-03 2.9775e-02 -6.0000e+00 3.8479e-01 -9.3375e-02 6.1194e-03 1.5038e-02 -6.0000e+00 2.2913e-01 3.4254e-02 3.0884e-03 4.4651e-03 -6.0000e+00 9.6726e-02 1.2181e-04 -7.2131e-04 1.1077e-04 6.6877e-05 -6.0000e+00 6.8995e-03 1.1455e-02 -8.8877e-05 12 8 8 10 0 0 97.29 21.20 0.21 0.01145 0.00603 30 7 1 5 0 1587.150 25.90 20.01 21.20 31.76 33.3 1064.64 -87721 -18649 -117682 -20971 -116627 -32827 -104217 -3181 -94768 -4261 -84403 -26158 -54869 -20405 -13870 -10471 -23193 27330 -13767 9077 -1934 34551 12769 -2666 -15766 3373 -8082 -9376 609 -6159 10068 -859 2024 -3706 -3248 -2079 737 958 7055 2130 5639 -1886 6397 -257 3034 -798 4641 603 -1052 -7825 7310 43 4517 336 4865 1218 1816 123 3392 -1781 2213 183 4828 2978 3563 -456 864 -564 1717 945 2525 995 848 -395 -1047 -2314 -1822 -3394 -710 -214 -2408 -780 -2708 -2065 -381 -353 1177 659 1591 1416 -615 761 -2740 -254 -302 927 -799 924 413 -455 -1290 -2119 -3489 80 -646 -1097 -684 796 -709 1326 1171 419 345 220 -637 -350 257 156 232 629 -203 482 916 -422 1297 580 -1609 1109 691 338 256 -638 -548 -517 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