File name: Pandora132s1_Berlin_20240519_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T215319.5Z 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_20240519_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: 20240519 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 20240519T043228.8Z 8905.189222 175 1 50.61 2 78.89 71.77 116.64 302.19 0.00 1 0.00 1 0 17 6.843e-01 1.099e-02 2.065e-01 3.992e-03 8.027213e-01 2.243504e-03 9.573910e-03 -6.000000e+00 3.967105e-01 231.43 -2.00 3.85 -2.00 321.82 0.00e+00 6.216651e-03 1.180176e-03 1.921947e-03 -6.000000e+00 1.698247e-02 276.74 -2.00 20.00 -2.00 321.34 0.00e+00 5.008 0.003 302.00 328.00 3 1.3053e+00 7.9731e-03 6.9711e-02 -6.0000e+00 9.9598e-01 2.0538e-01 1.1893e-02 4.9889e-02 -6.0000e+00 1.0814e+00 -2.8697e-01 1.3042e-02 2.8186e-02 -6.0000e+00 6.3986e-01 1.1612e-01 5.9982e-03 1.1939e-02 -6.0000e+00 2.6801e-01 4.2303e-04 2.1709e-05 1.0968e-04 1.5804e-04 -6.0000e+00 1.8823e-02 -2.5207e-02 0.0000e+00 12 8 8 10 0 0 91.36 17.72 0.29 -0.02521 -0.02504 232 49 4 8 0 213.500 15.00 17.72 22.01 21.58 21.98 30.6 1000.20 900000 -223960 -249875 -211153 -283348 -220104 -247820 -172599 -240515 -108578 -239445 -134752 -155103 -124608 -69447 -100241 -1004 -96721 19504 -75691 -2331 -66433 -61617 -55891 -89970 -7456 -77814 -44444 -63730 -34439 -38309 -25267 -19153 -27813 1113 -35910 -5697 -17550 7633 -8023 11369 -1428 3159 9866 -5768 14373 1442 10065 8647 18949 9102 8589 9233 4214 16294 2789 11025 4791 7431 4737 4427 8608 6269 10703 4756 8784 3579 4294 3416 4134 4583 1750 4393 -386 4076 -1903 -942 -4671 1556 133 -527 181 -2372 -87 -1658 151 -573 836 1284 40 1795 -1315 451 -2237 124 -1770 -285 96 -318 -289 -1060 -1315 -1891 99 -1784 -1572 -1002 -1691 46 -159 426 -114 537 -329 -164 -356 197 285 -36 70 27 924 909 899 786 78 114 692 907 -22 427 -144 16 -136 5 -330 -107 645 -65 46 212 -702 -637 900000 -1823 -2830 -1569 -4011 -1636 -2631 -977 -2979 -423 -3389 -892 -1691 -1358 -568 -1366 -6 -1657 114 -1208 -18 -983 -911 -849 -2066 -78 -1666 -675 -1216 -563 -820 -590 -492 -823 24 -1118 -146 -615 256 -372 487 -75 167 503 -352 744 89 603 565 1232 741 796 942 492 1789 366 1361 621 908 588 579 1216 1052 1950 885 1564 676 857 781 1078 1297 525 1248 -107 972 -434 -225 -1116 408 43 -201 78 -1157 -44 -910 86 -345 507 765 23 952 -680 226 -1237 77 -1328 -247 95 -341 -308 -1050 -1160 -1546 81 -1579 -1468 -985 -1814 54 -214 637 -182 855 -512 -244 -515 289 438 -58 115 43 1401 1322 1265 1070 103 148 964 1452 -40 865 -314 37 -337 13 -837 -275 1658 -166 122 518 -1617 -1438 SS 20240519T043859.2Z 8905.193740 178 1 51.50 2 77.95 72.99 117.46 303.69 0.00 1 0.00 1 0 17 6.072e-01 8.197e-03 1.437e-01 2.901e-03 7.562342e-01 1.599619e-03 9.082065e-03 -6.000000e+00 3.519486e-01 231.43 -2.00 3.85 -2.00 321.61 0.00e+00 5.649620e-03 8.024435e-04 2.113299e-03 -6.000000e+00 1.497834e-02 276.74 -2.00 20.00 -2.00 321.12 0.00e+00 4.645 0.002 302.00 328.00 3 1.1761e+00 5.5190e-03 6.4926e-02 -6.0000e+00 8.8366e-01 1.3751e-01 8.0353e-03 4.6306e-02 -6.0000e+00 9.5914e-01 -1.7148e-01 8.7490e-03 2.6686e-02 -6.0000e+00 5.6759e-01 6.4347e-02 4.0746e-03 1.1196e-02 -6.0000e+00 2.3616e-01 7.0813e-04 6.2390e-05 8.0048e-05 1.4597e-04 -6.0000e+00 1.6603e-02 -2.5557e-02 0.0000e+00 11 8 0 10 0 0 70.68 17.71 0.30 -0.02556 -0.02509 329 70 2 8 0 150.560 15.00 17.71 22.74 21.58 21.98 30.7 1003.18 -226116 -226825 -162693 -182991 -167827 -146046 -231399 -183518 -182210 -154294 -201417 -148808 -137260 -80422 -93889 -56153 -66354 -90565 -68770 -55778 -47876 -56610 -49618 -42719 -25576 -43487 -55553 -55159 -50621 -15670 -31156 -19227 -10174 -1521 -18606 -25866 -12882 -13174 742 17 -469 2440 3681 3629 -1019 4943 2459 3817 2642 4863 6975 5593 7137 5532 6019 2467 5099 3648 2377 6135 4743 7033 4658 7026 4899 4155 2532 2669 3675 3193 2388 2327 1683 770 -156 -1112 365 -2263 -455 -16 -280 -1183 -2464 -1524 -1492 -1756 231 -241 956 282 985 -363 -766 -583 -637 -683 -403 578 -102 -429 -550 -882 -616 -226 -810 -1620 -850 -907 117 241 489 258 275 -137 -149 -59 375 183 85 97 -88 457 823 339 418 -122 5 601 488 42 -3 -169 -216 92 -202 -244 -80 623 -45 -71 140 -383 -310 -1803 -2158 -879 -1176 -863 -661 -2440 -1506 -1649 -1135 -2564 -1347 -1475 -660 -1142 -572 -863 -1691 -1128 -852 -691 -897 -772 -677 -369 -787 -1147 -1123 -1017 -253 -732 -495 -279 -40 -568 -856 -419 -522 31 1 -27 146 230 234 -71 334 177 287 215 425 675 620 862 739 848 376 775 556 356 878 723 1178 838 1395 1047 886 549 612 945 948 779 784 556 239 -44 -287 88 -594 -136 -6 -118 -574 -1323 -861 -898 -1125 152 -162 630 179 580 -204 -424 -343 -430 -541 -371 602 -115 -483 -571 -818 -527 -196 -755 -1609 -886 -1021 146 339 760 423 452 -218 -226 -87 558 286 141 164 -146 715 1230 493 585 -164 6 850 791 77 -7 -365 -453 206 -483 -610 -204 1585 -113 -172 341 -881 -698 SS 20240519T044411.2Z 8905.197352 180 1 51.23 2 77.19 73.98 118.11 304.91 0.00 1 0.00 1 0 17 5.160e-01 9.644e-03 1.812e-01 2.227e-03 7.231103e-01 1.212476e-03 8.646427e-03 -6.000000e+00 2.990732e-01 231.43 -2.00 3.85 -2.00 321.42 0.00e+00 3.451872e-03 5.867923e-04 2.116495e-03 -6.000000e+00 1.272791e-02 276.74 -2.00 20.00 -2.00 320.94 0.00e+00 4.389 0.002 302.00 328.00 3 1.0358e+00 4.0668e-03 6.1610e-02 -6.0000e+00 7.5090e-01 1.1010e-01 5.8181e-03 4.4098e-02 -6.0000e+00 8.1504e-01 -1.3150e-01 6.2909e-03 2.4655e-02 -6.0000e+00 4.8231e-01 4.6397e-02 2.9615e-03 8.9568e-03 -6.0000e+00 2.0068e-01 1.0765e-03 -5.8723e-05 6.1536e-05 1.1122e-04 -6.0000e+00 1.4108e-02 -2.5735e-02 0.0000e+00 12 8 8 10 0 0 33.74 17.71 0.25 -0.02573 -0.02618 422 90 2 8 0 117.200 15.00 17.71 23.08 21.58 21.98 30.7 1004.93 -255792 -61679 -220388 -130947 -168743 -187449 -89606 -216653 41194 -207550 5345 -161579 -24911 -70811 -52767 -9837 -75868 23514 -73697 19325 -65362 4961 -38285 -28707 -16247 -47585 -7420 -61045 1011 -39603 931 -5552 -7580 -1484 -15678 4728 -20860 7390 -12745 14642 2619 7942 7120 -472 13650 -5228 14609 -5642 10956 2815 8422 5972 4331 7821 2170 8835 964 6290 819 4778 5619 3681 6142 3085 6460 290 5344 -341 3802 1177 2755 2374 -239 2650 -1849 548 -3692 -1111 -1649 -457 -971 -2036 -907 -2683 -164 -1958 788 -197 1032 604 785 646 -1797 19 -1820 75 -402 780 40 -343 80 -1720 -210 -1269 -601 -1885 -269 -759 145 552 12 544 -263 200 -491 423 262 247 472 -182 287 -90 1143 12 991 -258 -122 866 144 147 -323 206 -493 126 -134 -220 -61 416 160 -354 393 -671 -139 -3585 -146 -2741 -646 -1133 -1517 -331 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