File name: Pandora85s1_NewOrleansLA-XULA_20250803_L2Fit_fout2c5d20250716p1-8.txt File generation date: 20260326T090611.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c5p1-8 Local principal investigator: Morewell Gasseller Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 85 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora85_OF_v3d20231120.txt Instrument calibration file used: Pandora85s1_CF_v5d20250716.txt Level 1 file used: Pandora85s1_NewOrleansLA-XULA_20250803_L1_smca1c5d20250716p1-8.txt Full location name: Xavier University of Louisiana Short location name: NewOrleansLA-XULA Country of location: United States Location latitude [deg]: 29.9643 Location longitude [deg]: -90.1074 Location altitude [m]: 10 Local noon date: 20250803 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: 196 338 Nominal wavelengths inside fitting window [nm]: 305.0150 305.1556 305.2961 305.4367 305.5772 305.7178 305.8583 305.9988 306.1393 306.2798 306.4203 306.5608 306.7012 306.8417 306.9821 307.1226 307.2630 307.4034 307.5438 307.6842 307.8245 307.9649 308.1052 308.2456 308.3859 308.5262 308.6665 308.8068 308.9471 309.0874 309.2276 309.3679 309.5081 309.6484 309.7886 309.9288 310.0690 310.2091 310.3493 310.4895 310.6296 310.7698 310.9099 311.0500 311.1901 311.3302 311.4703 311.6104 311.7504 311.8905 312.0305 312.1705 312.3105 312.4505 312.5905 312.7305 312.8705 313.0104 313.1504 313.2903 313.4302 313.5702 313.7101 313.8499 313.9898 314.1297 314.2695 314.4094 314.5492 314.6891 314.8289 314.9687 315.1085 315.2482 315.3880 315.5278 315.6675 315.8072 315.9469 316.0867 316.2264 316.3660 316.5057 316.6454 316.7850 316.9247 317.0643 317.2039 317.3435 317.4831 317.6227 317.7623 317.9019 318.0414 318.1809 318.3205 318.4600 318.5995 318.7390 318.8785 319.0179 319.1574 319.2969 319.4363 319.5757 319.7151 319.8545 319.9939 320.1333 320.2727 320.4120 320.5514 320.6907 320.8300 320.9694 321.1087 321.2479 321.3872 321.5265 321.6657 321.8050 321.9442 322.0834 322.2227 322.3619 322.5010 322.6402 322.7794 322.9185 323.0577 323.1968 323.3359 323.4750 323.6141 323.7532 323.8923 324.0313 324.1704 324.3094 324.4484 324.5875 324.7265 324.8655 --------------------------------------------------------------------------------------- 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 --------------------------------------------------------------------------------------- SU 20250803T141107.6Z 9346.591060 1290 1 53.54 2 54.82 89.19 167.15 75.09 0.00 1 0.00 1 0 17 2.246e-02 1.156e-02 1.122e-02 3.682e-03 2.202002e-01 1.904169e-03 2.506308e-03 -6.000000e+00 1.315702e-02 229.80 -2.00 3.24 -2.00 317.28 0.00e+00 3.317949e-04 2.789358e-04 5.815677e-04 -6.000000e+00 6.031994e-04 294.49 -2.00 20.00 -2.00 316.34 0.00e+00 1.730 0.000 302.00 328.00 3 5.6601e+00 5.0406e-03 2.0251e-02 -6.0000e+00 3.2709e-02 1.1716e-02 5.6722e-03 1.0750e-02 -6.0000e+00 3.5263e-02 1.5348e-02 3.3779e-03 5.0579e-03 -6.0000e+00 2.1130e-02 -1.4226e-02 1.6576e-03 1.4761e-03 -6.0000e+00 9.1286e-03 2.5365e-04 4.9440e-04 1.0940e-04 1.7279e-05 -6.0000e+00 6.2579e-04 1.3403e-02 0.0000e+00 12 9 8 11 12 0 99.98 33.54 0.94 0.01340 0.01712 14 2 1 5 0 3823.510 41.25 20.00 33.54 34.34 4.0 1039.89 6360 6564 -211 -7166 -5391 -1925 -2184 1699 -5088 -8357 -6909 -5730 -3097 -5151 1865 138 2479 576 2005 1340 -281 5013 -2349 3843 -489 3707 -402 -2135 -95 -501 -2364 995 -535 -1360 -3148 -2768 -1874 -4680 -1649 234 77 714 748 2124 -58 -2069 607 -1344 584 399 470 25 -450 1200 2227 2483 1361 430 -1105 130 1115 1991 2945 2892 904 -865 -499 -1886 600 -361 -42 1204 1515 984 -153 -1817 -3013 -3008 -2231 -2238 -3074 -1373 -2535 -1081 -422 -253 149 1409 1404 1434 956 378 -1376 -2036 -1220 -528 -1272 585 606 -99 -182 -1050 -2020 -676 -897 -779 -991 -569 732 1528 1430 1833 1472 1158 39 -558 -753 -1026 -205 1052 861 770 793 623 530 -844 -1337 -322 -252 -194 -1254 -851 -873 43 -60 460 230 1005 226 -161 214 -272 -850 629 714 -28 -967 -637 -206 -243 201 -716 -1296 -1054 -866 -497 -954 364 30 557 136 484 336 -73 1235 -630 1016 -141 1068 -122 -628 -25 -129 -640 277 -162 -435 -976 -818 -584 -1714 -696 114 42 406 438 1246 -35 -1259 354 -775 321 217 265 15 -288 794 1514 1714 966 309 -795 91 791 1483 2347 2465 799 -729 -384 -1405 445 -301 -39 1165 1484 947 -140 -1543 -2324 -2148 -1579 -1737 -2701 -1313 -2649 -1168 -481 -282 175 1704 1725 1725 1081 433 -1459 -2033 -1226 -571 -1533 697 781 -130 -227 -1354 -2451 -804 -1151 -973 -1297 -778 1030 2251 2228 2922 2305 1710 53 -711 -1025 -1436 -275 1500 1286 1156 1170 891 718 -1214 -1835 -425 -346 -283 -1776 -1246 -1302 65 -95 771 400 1783 412 -292 374 -463 -1411 SU 20250803T141249.0Z 9346.592234 1293 1 24.63 2 54.45 89.39 166.81 75.69 0.00 1 0.00 1 0 17 1.360e-02 1.006e-02 2.756e-03 1.282e-03 2.193979e-01 6.650572e-04 2.498847e-03 -6.000000e+00 7.967251e-03 229.80 -2.00 3.24 -2.00 316.36 0.00e+00 8.598174e-04 7.852797e-05 3.535905e-04 -6.000000e+00 3.652910e-04 294.49 -2.00 20.00 -2.00 315.48 0.00e+00 1.715 0.000 302.00 328.00 3 3.6984e+00 1.7326e-03 2.0058e-02 -6.0000e+00 1.9807e-02 5.2891e-03 1.9320e-03 1.0437e-02 -6.0000e+00 2.1355e-02 5.8647e-03 1.1199e-03 5.0504e-03 -6.0000e+00 1.2796e-02 -1.0093e-02 5.3053e-04 1.3953e-03 -6.0000e+00 5.5272e-03 1.8406e-03 3.9781e-04 3.7379e-05 1.7382e-05 -6.0000e+00 3.7904e-04 1.4403e-02 0.0000e+00 12 9 9 12 5 1 99.38 33.55 0.40 0.01440 0.01739 28 7 1 5 0 849.110 41.25 20.00 33.55 34.38 4.0 1040.27 74 -772 976 -344 -5038 -2242 -2988 -414 -322 -1609 -4585 -2837 -1804 -590 617 -285 359 512 787 1631 1629 38 1407 1756 938 695 271 -673 -1460 -1278 309 -151 1182 -2158 -4142 -2882 -3123 -2498 -366 134 -118 51 283 320 513 521 491 -64 -238 83 923 698 903 1489 616 797 488 620 83 89 1047 1693 2213 2641 1206 -453 -676 -1501 83 1077 447 1131 543 1041 385 -723 -1954 -3002 -2406 -2201 -2260 -1479 -2415 -1893 -1199 -328 192 594 1547 1039 395 179 -1102 -1040 -646 -879 -260 750 673 -217 -710 -1227 -1753 -925 -961 -1274 -665 -439 149 1238 1677 1701 1575 1182 105 -110 -141 1 500 563 370 793 372 457 484 35 -1334 44 -10 -615 -267 -663 -807 -439 13 -22 -47 833 452 -9 -80 -356 -791 13 -151 193 -66 -899 -364 -506 -75 -65 -349 -1021 -622 -427 -142 166 -86 112 165 262 557 569 13 494 642 362 278 110 -263 -532 -448 110 -58 478 -943 -1758 -1155 -1334 -1211 -189 81 -73 34 190 218 348 353 327 -42 -151 56 592 478 651 1122 486 638 399 507 67 71 848 1445 1886 2396 1128 -404 -554 -1274 71 939 436 1084 532 1061 373 -644 -1705 -2452 -1954 -1956 -2095 -1507 -2503 -2047 -1367 -374 231 742 1945 1286 461 204 -1158 -1096 -688 -949 -309 917 890 -292 -915 -1480 -2114 -1100 -1154 -1645 -893 -580 204 1773 2526 2487 2257 1693 140 -145 -178 1 687 783 540 1157 535 637 679 47 -1721 54 -12 -849 -365 -944 -1172 -651 21 -34 -76 1363 757 -15 -130 -558 -1210 SU 20250803T141450.9Z 9346.593645 1296 1 2.28 2 54.01 89.65 166.41 76.37 0.00 1 0.00 1 0 17 1.578e-02 1.152e-02 6.891e-03 4.154e-03 2.207945e-01 2.165726e-03 2.473685e-03 -6.000000e+00 9.245215e-03 229.80 -2.00 3.24 -2.00 315.51 0.00e+00 9.036866e-04 2.137838e-04 1.920050e-04 -6.000000e+00 4.238971e-04 294.49 -2.00 20.00 -2.00 314.71 0.00e+00 1.697 0.000 302.00 328.00 3 3.5419e+00 5.5840e-03 1.9923e-02 -6.0000e+00 2.2984e-02 1.4863e-02 6.1977e-03 1.0459e-02 -6.0000e+00 2.4781e-02 -1.8263e-03 3.5580e-03 5.0569e-03 -6.0000e+00 1.4849e-02 -6.8713e-03 1.6227e-03 1.4068e-03 -6.0000e+00 6.4134e-03 2.1791e-03 1.3497e-04 1.1968e-04 1.8357e-05 -6.0000e+00 4.3987e-04 1.4816e-02 0.0000e+00 12 9 9 12 5 1 999.00 33.56 0.37 0.01482 0.01583 2 8 1 5 0 759.530 41.25 20.01 33.56 34.47 4.0 1040.52 1792 -2673 -2344 -2324 -1290 -473 -2881 -1469 160 -4046 -6027 -2767 -3090 1472 4171 127 -941 2416 1645 1940 1924 1912 1009 894 129 3223 876 -373 -115 -1775 267 44 329 -1677 -2892 -3673 -3802 -911 -425 -547 -1264 586 260 -245 1177 948 959 -1216 -53 -1025 715 585 1660 1361 1447 1930 1308 569 167 147 983 1546 2109 2450 699 -554 -1811 -2025 769 1531 577 1962 252 1051 -527 -1236 -1899 -2729 -2480 -1929 -3064 -1425 -2307 -1715 -1497 -955 -239 530 970 1386 491 784 -1100 -1463 -1586 -696 -62 148 713 -10 -261 -1307 -1912 -973 207 -665 -970 -181 318 1747 1554 1880 1583 1545 97 8 -2 -67 57 531 412 1057 424 238 496 310 -1097 -172 -109 -145 -582 -770 -930 -445 -764 41 -49 992 219 187 391 -444 -1002 465 -738 -666 -629 -333 -113 -729 -403 44 -1239 -1876 -835 -1020 488 1524 50 -392 1001 712 864 877 866 465 404 61 1539 432 -178 -54 -815 124 20 164 -890 -1481 -1810 -1992 -498 -259 -372 -913 437 191 -184 869 700 732 -921 -39 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