File name: Pandora132s1_Berlin_20221105_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T183704.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c13p1-8 Local principal investigator: Thomas Ruhtz Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 132 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora132_OF_v1d20200910.txt Instrument calibration file used: Pandora132s1_CF_v13d20210422.txt Level 1 file used: Pandora132s1_Berlin_20221105_L1_smca1c13d20210422p1-8.txt Full location name: Institute of Space Sciences FU Berlin Short location name: Berlin Country of location: Germany Location latitude [deg]: 52.4600 Location longitude [deg]: 13.3100 Location altitude [m]: 100 Local noon date: 20221105 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: Modification of session 11, but different RefDay (April 2021). First and last pixel inside fitting window: 243 385 Nominal wavelengths inside fitting window [nm]: 305.1071 305.2480 305.3889 305.5298 305.6707 305.8116 305.9524 306.0932 306.2341 306.3749 306.5157 306.6565 306.7973 306.9380 307.0788 307.2195 307.3603 307.5010 307.6417 307.7824 307.9231 308.0638 308.2044 308.3451 308.4857 308.6264 308.7670 308.9076 309.0482 309.1888 309.3293 309.4699 309.6104 309.7510 309.8915 310.0320 310.1725 310.3130 310.4534 310.5939 310.7344 310.8748 311.0152 311.1556 311.2960 311.4364 311.5768 311.7172 311.8575 311.9979 312.1382 312.2785 312.4188 312.5591 312.6994 312.8397 312.9800 313.1202 313.2604 313.4007 313.5409 313.6811 313.8213 313.9615 314.1016 314.2418 314.3819 314.5221 314.6622 314.8023 314.9424 315.0825 315.2225 315.3626 315.5026 315.6427 315.7827 315.9227 316.0627 316.2027 316.3427 316.4827 316.6226 316.7626 316.9025 317.0424 317.1823 317.3222 317.4621 317.6020 317.7418 317.8817 318.0215 318.1613 318.3012 318.4410 318.5807 318.7205 318.8603 319.0000 319.1398 319.2795 319.4192 319.5589 319.6986 319.8383 319.9780 320.1177 320.2573 320.3969 320.5366 320.6762 320.8158 320.9554 321.0949 321.2345 321.3741 321.5136 321.6531 321.7927 321.9322 322.0717 322.2111 322.3506 322.4901 322.6295 322.7689 322.9084 323.0478 323.1872 323.3266 323.4659 323.6053 323.7447 323.8840 324.0233 324.1627 324.3020 324.4413 324.5805 324.7198 324.8591 324.9983 --------------------------------------------------------------------------------------- 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: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Temperature at electronics board 1 [°C], 999=no temperature signal Column 98: Temperature at electronics board 2 [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: 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 20221105T080010.7Z 8344.333457 209 1 19.35 2 77.44 138.17 128.92 349.81 0.00 1 0.00 1 0 17 3.906e-01 1.521e-02 2.331e-01 6.935e-03 6.142247e-01 3.681250e-03 7.908448e-03 -6.000000e+00 2.229817e-01 221.93 -2.00 3.85 -2.00 320.74 0.00e+00 4.776548e-03 1.430189e-03 1.911530e-03 -6.000000e+00 1.003108e-02 272.48 -2.00 20.00 -2.00 320.29 0.00e+00 4.473 0.002 302.00 328.00 3 2.8164e+00 1.1151e-02 5.6174e-02 -6.0000e+00 5.5068e-01 1.8101e-01 1.4397e-02 3.5703e-02 -6.0000e+00 6.0021e-01 -1.6777e-01 1.4579e-02 2.1305e-02 -6.0000e+00 3.5435e-01 6.8053e-02 7.3599e-03 8.7900e-03 -6.0000e+00 1.5450e-01 1.8731e-04 -7.9220e-04 1.9938e-04 1.0650e-04 -6.0000e+00 1.0923e-02 2.7855e-03 0.0000e+00 12 9 9 12 1 1 99.98 17.43 0.29 0.00279 -0.00317 23 13 2 8 0 798.820 14.99 17.43 15.30 21.98 22.29 26.1 986.32 900000 -102908 -1302 -109684 -90771 -36960 -162460 900000 -154405 900000 -82752 -17930 -89410 -59144 31698 -64128 178545 -42642 153468 -64588 -4946 -22968 18494 6845 -37036 20938 -49034 132138 -50235 49746 -20279 23004 13754 5667 11350 -17386 37168 -10583 29729 -6113 14611 3177 -719 15287 -2340 17242 -1062 19041 -4752 9605 7514 7597 3893 3420 9656 -1760 9487 -4606 5540 1299 -2216 8189 526 7908 -174 8166 -2850 4744 -479 1978 962 -847 3462 -1956 6503 -4892 1213 -5327 -37 -1790 -3338 1369 -5049 398 -2162 1309 -619 -37 627 358 858 -2028 1136 -2533 780 -1587 427 497 -218 904 -2273 -260 -2465 1181 -2092 -631 -967 -978 643 -122 1081 -471 1317 -974 591 -689 -121 1309 648 1175 -939 1277 406 933 455 226 595 -238 874 -834 738 -836 294 -129 -31 -698 -66 935 -408 601 -939 -268 900000 900000 -1517 -9 -1685 -1060 -250 -4192 900000 -4554 900000 -1322 -176 -2307 -1454 390 -2403 1207 -1572 1037 -3294 -140 -776 432 193 -1729 566 -2651 1250 -2716 1210 -1084 947 701 320 579 -1196 1667 -923 2101 -717 1535 398 -98 1803 -335 2076 -157 2387 -791 1493 1325 1484 859 811 2249 -475 2314 -1271 1341 327 -611 2279 164 2525 -62 2571 -989 1600 -192 878 464 -425 1612 -896 2472 -1882 457 -2239 -16 -903 -1976 866 -3671 290 -1722 1068 -538 -32 536 292 647 -1473 779 -1910 645 -1555 471 567 -265 1059 -2727 -274 -2512 1202 -2356 -738 -1199 -1202 860 -183 1738 -793 2139 -1539 866 -993 -176 1984 1045 1924 -1539 1963 606 1339 683 325 841 -364 1377 -1490 1396 -1686 616 -289 -69 -1603 -153 2166 -943 1310 -2098 -563 900000 SS 20221105T080604.9Z 8344.337557 212 1 15.39 2 76.85 139.50 129.03 351.63 0.00 1 0.00 1 0 25 2.816e-01 7.700e-03 1.540e-01 4.885e-03 5.876394e-01 2.493148e-03 7.177856e-03 -6.000000e+00 1.570389e-01 221.93 -2.00 3.85 -2.00 320.68 0.00e+00 2.940299e-03 9.683523e-04 6.418762e-04 -6.000000e+00 6.828991e-03 272.48 -2.00 20.00 -2.00 320.18 0.00e+00 4.286 0.002 302.00 328.00 3 2.3381e+00 7.4634e-03 5.3144e-02 -6.0000e+00 3.8621e-01 8.2828e-02 9.5723e-03 3.2875e-02 -6.0000e+00 4.2297e-01 -5.5375e-02 9.6629e-03 1.7616e-02 -6.0000e+00 2.5151e-01 1.7205e-02 4.8615e-03 6.6419e-03 -6.0000e+00 1.0591e-01 3.8888e-04 -3.2260e-05 1.3873e-04 7.3756e-05 -6.0000e+00 7.6947e-03 1.4341e-03 0.0000e+00 12 9 1 12 1 1 99.97 17.43 0.20 0.00143 0.00119 36 26 4 8 0 410.310 14.98 17.43 15.40 21.98 22.29 26.1 986.80 -62094 -95784 17831 -129260 -112279 -114748 -130447 -99789 -97783 -55389 -60584 -60832 -4727 -11963 32895 309 -8403 -11999 -11862 -24841 -10508 8971 -11163 -14410 -4383 -12576 -21833 -24633 -14774 -14472 7429 7242 887 -1383 -9795 -6260 -6812 1634 4638 -3409 6880 -1686 474 178 -1464 4667 1123 634 3755 3309 3220 6069 1974 4878 3299 2344 2583 -1167 782 1366 2839 2558 1595 2624 1371 -410 181 189 401 640 315 52 -261 956 1066 -2473 -1227 -2352 38 -1624 -443 -1811 -2000 -2345 -912 388 299 771 1243 242 810 278 -238 281 -614 -138 208 713 409 -48 -745 -1354 -330 -56 -1396 -1237 -962 -602 286 675 487 261 352 278 -601 59 -94 -5 136 -93 61 499 615 132 460 -188 325 665 416 96 -193 -248 -593 147 179 -467 184 523 96 -194 210 -512 -287 -503 -1232 85 -2278 -1551 -1640 -2424 -1569 -1677 -660 -808 -956 -54 -188 407 6 -204 -332 -350 -876 -325 231 -372 -542 -161 -521 -988 -1115 -612 -662 326 376 55 -90 -667 -421 -523 140 471 -397 799 -227 65 25 -212 651 166 97 584 557 604 1227 453 1166 840 625 698 -322 206 358 776 784 559 996 536 -158 68 75 179 324 172 27 -142 480 484 -1052 -492 -994 18 -918 -262 -1215 -1446 -1802 -737 329 265 690 1088 203 628 202 -170 211 -526 -135 234 890 498 -57 -884 -1453 -333 -58 -1591 -1483 -1215 -812 389 1016 793 437 577 432 -888 85 -136 -7 221 -155 99 776 921 192 693 -272 462 1010 658 169 -367 -493 -1152 302 388 -1061 422 1207 219 -423 430 -1077 -600 SS 20221105T081057.6Z 8344.340944 214 1 51.31 2 76.37 140.60 129.10 353.13 0.00 1 0.00 1 0 25 2.109e-01 5.488e-03 3.478e-02 1.065e-03 5.768698e-01 5.468590e-04 7.013851e-03 -6.000000e+00 1.176097e-01 221.93 -2.00 3.85 -2.00 320.79 0.00e+00 1.758883e-03 2.175904e-04 6.776198e-04 -6.000000e+00 5.113756e-03 272.48 -2.00 20.00 -2.00 320.30 0.00e+00 4.146 0.002 302.00 328.00 3 3.4025e-01 1.6516e-03 5.1671e-02 -6.0000e+00 2.8924e-01 6.6778e-02 2.1447e-03 3.2234e-02 -6.0000e+00 3.1676e-01 -2.5989e-02 2.1957e-03 1.7293e-02 -6.0000e+00 1.8835e-01 -2.8240e-03 1.1005e-03 5.9701e-03 -6.0000e+00 7.9330e-02 3.3265e-03 -7.5624e-05 3.0803e-05 6.3600e-05 -6.0000e+00 5.7617e-03 4.2539e-04 0.0000e+00 10 0 0 10 0 0 97.59 17.43 0.23 0.00043 -0.00014 797 169 2 8 0 61.360 14.99 17.43 15.40 21.98 22.29 26.2 987.21 -79861 -63732 -66940 -65393 -73716 -87874 -75524 -68725 -60113 -63466 -52100 -53679 -34612 -28368 -22792 -11702 -16360 -11346 -11598 -4774 -9886 -9334 -9997 -7955 -9159 -9820 -13997 -13139 -11551 -7195 -1205 -1827 973 -2441 -5276 -4099 -3391 -265 -13 120 -415 710 908 586 1364 1200 929 1055 1492 1840 2160 2256 1808 1318 1278 1662 502 847 -279 428 1093 1856 2404 2710 479 275 153 -956 1594 691 1034 825 330 328 -888 -696 -1751 -2066 -870 -1066 -1287 -1413 -1974 -1352 -587 -316 710 427 1228 628 911 -7 -675 177 -372 96 325 896 203 46 -355 -1229 -355 -248 -1096 -1280 -518 -678 466 444 565 151 218 -75 -175 96 293 129 210 -343 -144 70 637 122 627 -281 -13 751 273 -42 -315 -319 -382 95 -61 -291 147 428 14 -48 201 -519 -22 -705 -543 -612 -557 -636 -886 -753 -743 -668 -778 -606 -742 -500 -489 -457 -244 -398 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