File name: Pandora159s1_Wakkerstroom_20210713_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T031232.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: B. Scholes Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 159 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora159_OF_v5d20191004.txt Instrument calibration file used: Pandora159s1_CF_v3d20201207.txt Level 1 file used: Pandora159s1_Wakkerstroom_20210713_L1_smca1c3d20201207p1-8.txt Full location name: Global Change Institute, University of Witwatersrand field site in Wakkerstroom Short location name: Wakkerstroom Country of location: South Africa Location latitude [deg]: -27.3493 Location longitude [deg]: 30.1438 Location altitude [m]: 1760 Local noon date: 20210713 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: None First and last pixel inside fitting window: 222 364 Nominal wavelengths inside fitting window [nm]: 305.0731 305.2139 305.3547 305.4955 305.6363 305.7770 305.9178 306.0585 306.1992 306.3399 306.4806 306.6213 306.7620 306.9026 307.0433 307.1839 307.3246 307.4652 307.6058 307.7464 307.8869 308.0275 308.1681 308.3086 308.4492 308.5897 308.7302 308.8707 309.0112 309.1517 309.2921 309.4326 309.5730 309.7135 309.8539 309.9943 310.1347 310.2751 310.4155 310.5558 310.6962 310.8365 310.9769 311.1172 311.2575 311.3978 311.5381 311.6784 311.8186 311.9589 312.0991 312.2393 312.3795 312.5198 312.6599 312.8001 312.9403 313.0805 313.2206 313.3607 313.5009 313.6410 313.7811 313.9212 314.0612 314.2013 314.3414 314.4814 314.6214 314.7615 314.9015 315.0415 315.1814 315.3214 315.4614 315.6013 315.7413 315.8812 316.0211 316.1610 316.3009 316.4408 316.5807 316.7205 316.8604 317.0002 317.1400 317.2798 317.4196 317.5594 317.6992 317.8389 317.9787 318.1184 318.2582 318.3979 318.5376 318.6773 318.8170 318.9566 319.0963 319.2359 319.3756 319.5152 319.6548 319.7944 319.9340 320.0736 320.2131 320.3527 320.4922 320.6318 320.7713 320.9108 321.0503 321.1898 321.3292 321.4687 321.6081 321.7476 321.8870 322.0264 322.1658 322.3052 322.4446 322.5839 322.7233 322.8626 323.0019 323.1413 323.2806 323.4199 323.5591 323.6984 323.8377 323.9769 324.1162 324.2554 324.3946 324.5338 324.6730 324.8121 324.9513 --------------------------------------------------------------------------------------- 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: 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 77: 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 78: 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 79: 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 80: 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 81: 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 82: Atmospheric variability [%], 999=no atmospheric variability was determined Column 83: Wavelength effective temperature [°C], 999=no effective temperature given Column 84: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 85: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 86: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 87: Number of bright count cycles Column 88: Number of dark count cycles Column 89: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 90: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 91: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 92: Integration time [ms] Column 93: Spectrometer control temperature [°C], 999=no temperature signal Column 94: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 95: Temperature in head sensor [°C], 999=no temperature signal Column 96: Temperature at electronics board 1 [°C], 999=no temperature signal Column 97: Temperature at electronics board 2 [°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 20210713T051501.1Z 7864.218763 21 1 48.97 2 85.60 62.68 117.69 84.07 0.00 1 0.00 1 0 25 5.946e-01 5.111e-02 4.743e-01 3.987e-02 9.979148e-01 2.431168e-02 1.099148e-02 -6.000000e+00 3.470599e-01 225.43 -2.00 3.06 -2.00 322.33 0.00e+00 -2.510016e-02 9.704113e-03 9.359130e-04 -6.000000e+00 1.691534e-02 276.82 -2.00 20.00 -2.00 321.84 0.00e+00 10.823 0.008 302.00 328.00 3 3.9171e-01 8.2413e-02 1.0323e-01 -6.0000e+00 8.5473e-01 1.7544e+00 1.0116e-01 7.1494e-02 -6.0000e+00 9.3430e-01 -2.2099e+00 6.9330e-02 2.3860e-02 -6.0000e+00 5.5693e-01 8.4923e-01 3.7587e-02 2.4942e-02 -6.0000e+00 2.3991e-01 1.9687e-05 -2.3707e-03 1.1030e-03 3.4935e-04 -6.0000e+00 1.6923e-02 3.2570e-03 12 8 8 10 0 0 83.82 18.46 0.64 0.00326 -0.01456 30 6 4 8 0 1632.000 15.02 18.46 7.22 20.96 20.96 16.4 832.85 111284 900000 15190 104568 27442 -15825 900000 156161 55190 -71362 2992 -35973 900000 92102 210013 29661 900000 -29723 71851 900000 900000 900000 33219 900000 900000 900000 151932 231460 -59502 22253 33272 70231 110450 -36664 129778 -35330 900000 20553 900000 -13281 900000 75116 900000 6555 23947 900000 100803 900000 -42960 900000 23832 900000 38684 102350 27886 101521 102086 124299 77826 102079 161466 -7426 168442 -11156 900000 17253 66182 30163 16083 7744 32769 59817 20415 117622 6453 35882 31286 57375 -6149 28569 -16028 1922 24511 3751 12086 -7195 10923 -9609 19249 -4188 21659 1061 37099 -17683 21669 -8438 -4907 -6202 -2518 -8 -6510 -3281 -6295 4410 -15445 1388 -11900 9469 -8756 -440 -2418 -1783 -3778 1293 1803 -1886 5516 3906 3250 -7010 2934 435 4980 450 5404 4842 8302 5535 -3322 -2645 3775 -354 -29 1206 -3154 1207 1328 2945 -775 -2733 962 -5324 2992 4309 900000 1229 4049 1280 -1023 900000 6047 2472 -11346 231 -4055 900000 3567 8132 2118 900000 -3640 3146 900000 900000 900000 1739 900000 900000 900000 5883 8963 -6486 1039 1504 2720 4277 -3909 5025 -3128 900000 1292 900000 -1690 900000 4559 900000 676 1881 900000 3903 900000 -5720 900000 1948 900000 3284 5096 3038 5743 5910 5623 5023 4661 6253 -958 6523 -1847 900000 2269 5454 3725 2545 1514 5491 7939 3839 7925 1118 4107 3485 5129 -1146 4555 -4631 544 6220 1241 3898 -2945 3885 -4229 6274 -1629 6151 351 8718 -7644 7426 -4548 -3002 -4442 -1918 -6 -4931 -2155 -3807 2379 -10865 881 -9098 6395 -7968 -433 -2800 -2271 -5110 1674 2257 -2380 6554 4942 4366 -10655 3934 566 5912 549 6119 5390 8709 6382 -4913 -4567 6950 -742 -64 2901 -8538 3319 3713 8165 -2205 -7511 2347 -12686 6267 SS 20210713T052933.8Z 7864.228863 24 1 50.15 2 82.75 60.86 114.59 82.67 0.00 1 0.00 1 0 25 5.764e-01 7.007e-03 3.015e-01 3.744e-03 7.777470e-01 2.031930e-03 7.513107e-03 -6.000000e+00 3.242390e-01 225.43 -2.00 3.06 -2.00 321.77 0.00e+00 4.193854e-03 1.101134e-03 4.241863e-03 -6.000000e+00 1.415525e-02 276.82 -2.00 20.00 -2.00 321.32 0.00e+00 7.336 0.002 302.00 328.00 3 2.4323e-01 7.3599e-03 7.4424e-02 -6.0000e+00 8.0298e-01 1.3058e-01 1.1859e-02 5.2553e-02 -6.0000e+00 8.7494e-01 -1.0949e-01 1.3787e-02 2.2847e-02 -6.0000e+00 5.2030e-01 2.8875e-02 6.2854e-03 7.8918e-03 -6.0000e+00 2.2082e-01 4.9552e-04 -1.2415e-03 1.0185e-04 8.6464e-05 -6.0000e+00 1.5402e-02 2.8311e-03 11 8 0 10 0 0 84.50 18.45 0.31 0.00283 -0.00650 204 44 4 8 0 241.060 14.98 18.45 8.23 20.96 20.96 16.2 837.77 -203298 -231192 -192797 -185066 -61694 -131230 -137194 -222433 -203717 -169239 -201452 -173593 -89833 -90030 -62508 -33752 -76010 2403 -44630 -61216 -10318 -49906 -57856 -47517 -47307 -17801 -32298 -33251 -28114 -71426 -32856 -18735 -14302 -11206 12783 -10567 -16032 -1265 -19379 -16131 -3757 7333 -5834 -3001 -1272 -880 4686 13383 -2081 12339 -923 5571 12871 4925 4555 2561 55 208 93 9410 4797 3665 3521 5195 2992 4471 1679 1647 1491 909 -495 -343 446 993 -536 -923 -11 -78 829 -4 -599 -873 -1804 -87 -712 -587 -780 -409 1002 288 905 968 416 1420 920 247 -62 142 -923 135 -421 134 803 -41 -1542 -1386 -44 -989 -634 -351 -438 -378 242 244 473 1334 919 512 -191 -769 -491 71 -567 -318 136 135 1582 1266 364 272 206 269 192 284 -394 -533 194 -240 -646 -50 244 48 440 -742 -1351 -845 -743 -225 -479 -501 -1543 -1339 -865 -1545 -1204 -361 -493 -342 -173 -694 11 -375 -648 -68 -492 -655 -538 -587 -175 -377 -388 -318 -1408 -552 -342 -298 -245 215 -224 -398 -33 -750 -664 -156 297 -287 -148 -63 -45 238 662 -129 729 -71 457 1094 499 496 299 7 26 11 1006 557 482 539 898 568 834 323 334 341 243 -148 -107 136 281 -140 -216 -2 -18 216 -1 -228 -385 -886 -45 -393 -344 -482 -258 621 173 504 507 214 762 568 181 -54 141 -1019 148 -434 122 657 -34 -1385 -1316 -43 -1065 -757 -477 -669 -568 366 392 721 1942 1355 795 -317 -1321 -825 113 -869 -472 194 186 2078 1760 587 506 391 548 415 656 -981 -1398 516 -650 -1747 -129 585 107 942 SS 20210713T053549.4Z 7864.233211 27 1 51.02 2 81.54 60.04 113.26 82.07 0.00 1 0.00 1 0 25 4.056e-01 6.594e-03 1.774e-01 2.157e-03 6.977930e-01 1.170235e-03 6.813739e-03 -6.000000e+00 2.281872e-01 225.43 -2.00 3.06 -2.00 321.48 0.00e+00 3.403645e-03 5.787614e-04 2.698959e-03 -6.000000e+00 9.961826e-03 276.82 -2.00 20.00 -2.00 320.98 0.00e+00 6.416 0.002 302.00 328.00 3 2.4274e-01 4.0032e-03 6.3389e-02 -6.0000e+00 5.6511e-01 6.5000e-02 5.8607e-03 4.0341e-02 -6.0000e+00 6.1574e-01 -4.3015e-02 6.5543e-03 1.8353e-02 -6.0000e+00 3.6617e-01 5.9223e-03 3.0881e-03 6.9521e-03 -6.0000e+00 1.5541e-01 1.0959e-03 -9.4703e-04 6.1073e-05 6.8877e-05 -6.0000e+00 1.0839e-02 2.5828e-03 11 8 0 10 0 0 81.33 18.45 0.29 0.00258 -0.00453 307 66 2 8 0 160.420 15.01 18.45 8.69 20.96 20.96 16.3 840.30 -119810 -125561 -165735 -132983 -167436 -25597 -121037 -95666 -130003 -32805 -155444 -107612 -117179 -77124 -89618 -62549 -34913 -30823 -7245 -22239 16447 -23065 -17383 -38606 -9119 -44819 -22006 -30543 -21505 -20583 -14857 11632 -15282 2620 -3235 -496 -5618 -4995 -7801 -1251 -5594 -1016 -719 2 3521 -746 3714 1082 3746 2746 5103 994 3808 2965 2472 911 -176 1719 985 1770 2136 1932 1805 3080 246 3459 1149 1461 1895 170 1112 -280 84 -397 -434 217 -301 106 947 -386 -234 -896 -2158 -474 -1345 -792 -283 -144 60 327 1034 665 590 1355 1028 311 1253 78 -589 -446 190 -118 1071 -82 -1602 -1347 -992 -754 -269 39 -493 -173 22 576 474 1396 610 496 -280 -973 -883 -95 -31 -380 523 273 1470 1386 338 74 201 160 190 324 -426 -463 93 11 -600 -46 1 61 456 -378 -502 -1081 -615 -1021 -54 -509 -362 -793 -83 -1439 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