File name: Pandora25s1_HoustonTX_20231117_L2Fit_fout2c9d20230101p1-8.txt File generation date: 20241218T041817.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c9p1-8 Local principal investigator: Jimmy Flynn Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 25 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora25_OF_v7d20190903.txt Instrument calibration file used: Pandora25s1_CF_v9d20230101.txt Level 1 file used: Pandora25s1_HoustonTX_20231117_L1_smca1c9d20230101p1-8.txt Full location name: University Of Houston Short location name: HoustonTX Country of location: United States Location latitude [deg]: 29.7200 Location longitude [deg]: -95.3400 Location altitude [m]: 19 Local noon date: 20231117 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: Modification of session 8, but repeated E-MLE of HCHO. First and last pixel inside fitting window: 281 423 Nominal wavelengths inside fitting window [nm]: 305.0808 305.2213 305.3618 305.5022 305.6427 305.7831 305.9235 306.0640 306.2044 306.3447 306.4851 306.6255 306.7658 306.9062 307.0465 307.1868 307.3272 307.4675 307.6077 307.7480 307.8883 308.0285 308.1688 308.3090 308.4492 308.5894 308.7296 308.8698 309.0100 309.1501 309.2903 309.4304 309.5705 309.7106 309.8507 309.9908 310.1309 310.2710 310.4110 310.5511 310.6911 310.8311 310.9711 311.1111 311.2511 311.3911 311.5310 311.6710 311.8109 311.9508 312.0907 312.2306 312.3705 312.5104 312.6503 312.7901 312.9300 313.0698 313.2096 313.3494 313.4892 313.6290 313.7688 313.9085 314.0483 314.1880 314.3277 314.4675 314.6072 314.7468 314.8865 315.0262 315.1658 315.3055 315.4451 315.5847 315.7243 315.8639 316.0035 316.1431 316.2826 316.4222 316.5617 316.7013 316.8408 316.9803 317.1198 317.2592 317.3987 317.5382 317.6776 317.8170 317.9564 318.0958 318.2352 318.3746 318.5140 318.6534 318.7927 318.9320 319.0714 319.2107 319.3500 319.4893 319.6285 319.7678 319.9070 320.0463 320.1855 320.3247 320.4639 320.6031 320.7423 320.8815 321.0206 321.1598 321.2989 321.4380 321.5771 321.7162 321.8553 321.9944 322.1334 322.2725 322.4115 322.5506 322.6896 322.8286 322.9676 323.1065 323.2455 323.3845 323.5234 323.6623 323.8012 323.9402 324.0790 324.2179 324.3568 324.4957 324.6345 324.7733 324.9122 --------------------------------------------------------------------------------------- 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 20231117T133747.8Z 8721.567915 55 1 49.49 2 80.92 118.09 132.03 101.79 0.00 1 0.00 1 0 25 3.013e-01 6.583e-03 1.547e-01 1.862e-03 6.340179e-01 9.965287e-04 6.765289e-03 -6.000000e+00 1.741688e-01 225.01 -2.00 3.24 -2.00 320.86 0.00e+00 1.798435e-03 4.555459e-04 6.445650e-04 -6.000000e+00 7.942835e-03 288.44 -2.00 20.00 -2.00 320.21 0.00e+00 6.009 0.003 302.00 328.00 3 6.6891e-01 3.3109e-03 6.7088e-02 -6.0000e+00 4.2909e-01 4.0020e-02 4.4779e-03 3.1777e-02 -6.0000e+00 4.6611e-01 -2.8920e-02 4.3425e-03 1.5832e-02 -6.0000e+00 2.7803e-01 3.2067e-03 2.1053e-03 5.7606e-03 -6.0000e+00 1.2001e-01 3.8057e-04 -1.1906e-03 5.2920e-05 6.2237e-05 -6.0000e+00 8.5913e-03 5.3477e-03 0.0000e+00 11 8 0 10 0 0 99.45 24.68 0.29 0.00535 -0.00360 165 35 1 5 0 299.870 27.15 20.00 24.68 22.19 30.0 1035.34 900000 33604 -167056 871 -144249 -98621 900000 -85007 132040 -72954 -110869 37926 -88788 -20509 -32347 -46725 -6674 14415 -2920 -22519 -7225 -21752 -39504 -16965 -18788 -876 -22448 -20643 -22288 -20138 9813 -371 980 -1260 -18765 10367 2053 23739 -1910 -3633 -4024 2075 -1633 1929 7616 696 -2886 -3641 9273 555 6818 -1101 2060 3894 2334 2172 1832 -1876 1184 -255 -25 1977 -172 865 -220 1402 -106 617 2117 1753 848 1108 300 -218 1268 839 -2092 -713 1081 -845 -22 -1153 -1287 -918 -1014 -1384 -342 -241 -190 797 521 1284 505 433 -187 119 101 351 -212 -406 -11 -364 60 -702 -449 -1335 -1078 -897 62 2001 -241 18 -50 232 204 830 487 127 -247 -501 -643 76 -196 153 143 588 254 897 187 -33 70 -129 64 368 -47 -393 -212 94 -83 -249 226 -158 72 900000 61 -2224 2 -1397 -667 900000 -645 240 -614 -1342 131 -1276 -192 -431 -862 -94 183 -48 -480 -137 -484 -1118 -423 -523 -22 -706 -625 -684 -661 285 -14 40 -56 -975 439 97 1087 -140 -325 -410 216 -173 203 832 78 -343 -453 1068 75 969 -190 381 773 503 492 430 -459 274 -59 -6 513 -49 271 -74 457 -35 207 774 740 400 548 149 -104 545 327 -783 -266 440 -414 -12 -714 -881 -669 -744 -1090 -281 -205 -161 650 400 972 370 325 -147 108 100 397 -250 -486 -13 -396 60 -697 -474 -1515 -1289 -1086 81 2869 -372 29 -83 374 312 1204 707 193 -398 -849 -1094 125 -311 233 211 874 367 1319 292 -55 130 -245 127 777 -101 -904 -481 216 -193 -562 502 -333 153 SS 20231117T134929.8Z 8721.576040 60 1 49.43 2 78.70 119.76 129.67 102.73 0.00 1 0.00 1 0 25 1.354e-01 5.202e-03 3.272e-02 1.219e-03 5.300279e-01 6.311762e-04 5.714310e-03 -6.000000e+00 7.767643e-02 225.01 -2.00 3.24 -2.00 320.14 0.00e+00 8.911746e-03 2.268618e-04 5.746853e-04 -6.000000e+00 3.539302e-03 288.44 -2.00 20.00 -2.00 319.42 0.00e+00 4.929 0.001 302.00 328.00 3 1.1014e+00 1.8974e-03 5.5668e-02 -6.0000e+00 1.9131e-01 2.2280e-02 2.3536e-03 2.8942e-02 -6.0000e+00 2.0762e-01 -2.0222e-02 2.0628e-03 1.5418e-02 -6.0000e+00 1.2439e-01 3.5175e-03 1.0588e-03 1.1829e-02 -6.0000e+00 5.3572e-02 7.4654e-04 -8.4020e-04 3.4711e-05 9.3554e-05 -6.0000e+00 3.7877e-03 5.0118e-03 0.0000e+00 11 1 0 11 8 0 89.54 24.68 0.26 0.00501 -0.00130 179 38 1 5 0 276.000 27.15 19.99 24.68 23.09 30.4 1040.99 -85035 -30958 -58910 -24519 -40539 -40721 2590 -42106 -15806 -46341 -48101 -23492 -24968 -12912 -17943 13244 -3067 7563 -3244 -6069 -1257 -2041 -16911 -6490 -10965 -2848 -11054 -7078 -6505 -4476 1330 1541 4255 -2567 -6885 301 -334 8815 -34 -3373 -1904 495 -1137 -781 2169 768 -1878 -692 1529 737 2681 1091 1039 1696 1034 753 1073 -644 588 -463 920 1143 1144 1010 309 255 566 185 1482 757 51 545 -137 -250 413 342 -1263 -724 113 -651 -648 -1025 -1687 -1140 -1071 -840 -278 133 395 688 933 861 842 541 701 398 350 375 61 -250 -35 -475 -193 -96 -511 -937 -612 -664 13 -74 -252 -1 125 203 236 547 536 110 -299 -538 -767 -137 -155 62 270 395 428 1205 591 276 211 0 55 280 -21 -281 -189 119 -153 -234 -77 -122 -10 -1342 -331 -891 -254 -456 -449 20 -551 -174 -731 -806 -353 -486 -289 -531 342 -96 236 -122 -248 -50 -82 -812 -296 -551 -137 -588 -357 -329 -243 81 110 340 -232 -627 25 -31 887 -4 -502 -312 85 -210 -150 415 154 -397 -149 333 172 625 286 297 518 333 251 364 -221 196 -156 321 440 466 458 147 118 254 85 731 430 30 335 -84 -147 237 178 -619 -352 60 -382 -442 -795 -1354 -966 -969 -765 -266 131 390 657 880 755 700 454 643 395 380 462 77 -323 -42 -558 -208 -109 -592 -1161 -758 -876 18 -111 -394 -1 205 319 365 804 785 169 -467 -886 -1278 -221 -242 99 409 574 629 1791 923 459 367 1 102 545 -42 -594 -411 253 -328 -509 -160 -251 -21 SS 20231117T135532.8Z 8721.580241 63 1 43.97 2 77.57 120.65 128.46 103.21 0.00 1 0.00 1 0 25 7.458e-02 4.658e-03 1.695e-02 9.232e-04 4.883086e-01 4.740742e-04 5.309927e-03 -6.000000e+00 4.278914e-02 225.01 -2.00 3.24 -2.00 319.69 0.00e+00 3.462138e-03 1.462706e-04 4.415257e-04 -6.000000e+00 1.949656e-03 288.44 -2.00 20.00 -2.00 318.93 0.00e+00 4.513 0.001 302.00 328.00 3 9.2985e-01 1.3687e-03 5.0592e-02 -6.0000e+00 1.0539e-01 1.3152e-02 1.6481e-03 2.4384e-02 -6.0000e+00 1.1437e-01 -6.1612e-03 1.3452e-03 1.1893e-02 -6.0000e+00 6.8520e-02 -3.3288e-03 7.0346e-04 5.4360e-03 -6.0000e+00 2.9512e-02 1.3949e-03 -6.8261e-04 2.6674e-05 4.9011e-05 -6.0000e+00 2.0865e-03 4.8770e-03 0.0000e+00 12 1 1 12 1 1 99.75 24.69 0.29 0.00488 -0.00025 250 60 1 5 0 175.140 27.15 20.00 24.69 23.31 30.0 1040.54 -42495 -5139 -40342 -2169 -34334 -20701 -10117 -19618 -5923 -17772 -26719 -14341 -17204 -11058 -8389 -2229 -1846 -2686 -811 -1926 -1310 -1663 -7427 -1232 -2970 -2625 -5799 -4688 -3913 -1650 1510 2670 1240 -352 -4192 892 -615 3124 504 -1408 -587 -672 -287 -930 455 -471 -836 -657 712 101 1496 852 727 1395 766 1060 451 -198 93 207 677 849 918 1418 278 362 368 -31 1147 447 312 179 93 -105 75 329 -450 -485 41 -408 -585 -814 -1475 -1337 -928 -700 -454 0 126 575 709 1006 944 875 515 344 512 429 114 -389 -268 -556 -97 5 -606 -1083 -523 -599 -147 -89 -68 76 115 158 151 498 370 133 -203 -333 -667 -196 -53 50 296 565 408 1094 499 274 203 -16 107 207 54 -178 -202 52 -131 -294 -110 -122 -52 -742 -72 -823 -30 -593 -313 -150 -357 -105 -375 -635 -338 -504 -376 -335 -97 -88 -140 -44 -111 -77 -99 -485 -81 -212 -196 -451 -351 -287 -125 127 254 134 -40 -481 98 -75 430 85 -280 -128 -156 -69 -230 113 -120 -217 -173 190 28 447 279 255 519 299 425 186 -82 38 84 282 381 453 753 153 194 192 -16 643 279 210 125 65 -71 48 193 -250 -268 24 -269 -432 -660 -1279 -1209 -878 -694 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