File name: Pandora132s1_Berlin_20210617_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T151051.7Z 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_20210617_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: 20210617 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 20210617T172941.5Z 7838.728952 5 1 51.16 2 74.84 288.82 45.39 191.14 0.00 1 0.00 1 0 25 1.906e-01 6.832e-03 5.734e-02 2.043e-03 5.293350e-01 1.093466e-03 7.816148e-03 -6.000000e+00 1.118261e-01 233.55 -2.00 3.85 -2.00 320.68 0.00e+00 2.406040e-03 4.382254e-04 7.848870e-03 -6.000000e+00 4.846237e-03 280.16 -2.00 20.00 -2.00 320.08 0.00e+00 3.750 0.001 302.00 328.00 3 1.7860e+00 3.4412e-03 5.6333e-02 -6.0000e+00 2.8196e-01 -8.4208e-03 4.3674e-03 4.9774e-02 -6.0000e+00 3.0506e-01 -3.7386e-02 4.0607e-03 2.8914e-02 -6.0000e+00 1.8061e-01 9.5183e-03 1.9956e-03 9.7024e-03 -6.0000e+00 7.6405e-02 1.2507e-03 1.5207e-02 6.1442e-05 1.8192e-04 -6.0000e+00 5.2537e-03 2.2280e-01 0.0000e+00 12 9 1 12 4 4 51.65 46.83 1.93 0.22280 0.33707 379 80 2 8 0 130.480 34.61 46.83 37.41 49.86 50.45 27.9 1059.24 -36440 -46678 -100262 -44111 -92876 -95945 -26389 -74055 -37676 -45926 -30031 -41784 -10379 -9906 5203 -1397 11831 -7369 -14641 -4592 -1179 -22956 -27639 -17722 -7686 -4262 -5710 -2488 -3240 -11292 -1239 -9014 2558 -7865 10918 -3284 1394 409 -85 -4915 -1585 2004 2603 640 2318 3719 1235 2514 2666 -1051 2001 1898 1269 -1403 -405 1828 444 -379 3357 3277 3063 1070 1854 2004 1102 3116 937 242 -491 974 512 -717 -312 388 -1332 -132 -1381 -1178 -1114 -2049 -926 -150 -668 277 -71 325 -198 83 235 268 1899 619 -153 752 453 -1018 -1085 -282 8 288 1102 -1573 -1181 -1253 -390 -278 223 113 -274 78 23 170 911 1201 169 48 -526 -783 44 39 131 289 181 842 1655 264 -168 -117 -154 110 197 318 -325 93 195 -305 -439 -212 -26 303 -123 900000 900000 -277 -363 -1271 -369 -1312 -1758 -263 -1239 -473 -750 -526 -1024 -221 -237 117 -36 287 -226 -487 -142 -38 -997 -1338 -794 -305 -159 -222 -106 -163 -711 -76 -591 145 -530 718 -305 149 50 -11 -723 -232 288 379 96 349 567 202 441 519 -233 464 467 328 -385 -111 479 116 -102 945 1036 1080 407 685 707 392 1174 413 120 -260 510 259 -341 -133 150 -512 -54 -660 -655 -703 -1434 -682 -117 -509 222 -59 272 -162 70 183 196 1355 484 -137 695 476 -1189 -1291 -316 8 294 1115 -1588 -1268 -1416 -462 -355 312 173 -444 125 36 247 1247 1625 240 73 -844 -1277 70 60 193 408 246 1195 2360 379 -270 -204 -284 212 398 684 -744 220 466 -737 -1038 -476 -56 619 -257 900000 900000 SS 20210617T173552.2Z 7838.733243 8 1 50.61 2 75.73 289.96 45.61 193.21 0.00 1 0.00 1 0 25 1.924e-01 6.963e-03 9.411e-02 2.452e-03 5.572469e-01 1.318538e-03 8.396101e-03 -6.000000e+00 1.128663e-01 233.55 -2.00 3.85 -2.00 320.83 0.00e+00 2.652067e-03 5.600729e-04 8.871052e-03 -6.000000e+00 4.891534e-03 280.16 -2.00 20.00 -2.00 320.25 0.00e+00 3.968 0.001 302.00 328.00 3 1.8378e+00 4.2354e-03 6.1571e-02 -6.0000e+00 2.8458e-01 2.8948e-03 5.4719e-03 5.5978e-02 -6.0000e+00 3.0790e-01 -4.8853e-02 5.2468e-03 3.1566e-02 -6.0000e+00 1.8229e-01 1.3415e-02 2.5535e-03 1.0168e-02 -6.0000e+00 7.7114e-02 9.3596e-04 1.4719e-02 7.2956e-05 2.0467e-04 -6.0000e+00 5.3026e-03 2.2298e-01 0.0000e+00 12 9 1 12 4 4 4.63 42.50 1.82 0.22298 0.33359 319 68 2 8 0 154.740 30.82 42.50 38.90 45.97 46.64 25.9 1060.90 -46754 -63858 -77410 -13653 -90157 -37056 -95971 -100175 -48709 19715 -3915 -3224 -36752 1187 -15522 -18832 -29652 20814 -573 2042 -21371 -8918 -16761 -3093 -3542 -19376 6614 1248 4361 -16662 -1477 -11455 1697 -19038 -1240 -722 -5394 3255 -3669 -3325 -3036 1788 -824 -3040 -1500 1876 3122 6270 4651 2033 2538 3488 2978 905 -976 557 -2273 2211 2303 3592 2321 756 236 1204 2121 2677 1872 152 125 39 808 351 1008 -663 -644 1018 -357 -2788 -972 -2421 -1520 -1022 -173 -406 428 94 309 841 912 -554 1368 456 -355 518 645 -971 -290 -59 -162 546 480 -1005 -1950 -1010 -562 264 314 154 -223 -52 105 -213 1066 1225 332 122 -806 -836 -296 330 224 312 -336 837 1365 676 -200 174 -154 -66 154 59 -333 55 563 -552 -275 74 -286 281 -80 900000 900000 -305 -458 -606 -65 -960 -292 -1491 -1700 -536 132 -42 -43 -826 21 -353 -482 -900 398 -14 49 -695 -279 -605 -100 -113 -704 191 43 174 -952 -79 -668 84 -1242 -80 -57 -535 338 -443 -422 -397 226 -109 -420 -208 260 448 952 799 395 531 768 688 221 -244 135 -557 529 596 1033 756 266 82 399 698 946 765 71 62 19 382 155 398 -244 -231 387 -160 -1494 -583 -1624 -1077 -768 -138 -313 340 76 264 674 677 -392 946 345 -309 514 660 -1108 -336 -65 -162 545 476 -1080 -2053 -1109 -651 327 430 231 -357 -84 162 -310 1455 1654 470 184 -1293 -1358 -466 498 327 438 -501 1183 1944 965 -323 305 -287 -128 317 128 -774 131 1362 -1355 -658 167 -614 580 -170 900000 900000 SS 20210617T174055.0Z 7838.736748 10 1 49.99 2 76.45 290.89 45.81 194.90 0.00 1 0.00 1 0 25 2.777e-01 7.255e-03 1.321e-01 3.197e-03 5.825308e-01 1.726156e-03 9.381165e-03 -6.000000e+00 1.629758e-01 233.55 -2.00 3.85 -2.00 321.01 0.00e+00 3.950945e-03 7.727617e-04 1.078946e-02 -6.000000e+00 7.060794e-03 280.16 -2.00 20.00 -2.00 320.44 0.00e+00 4.164 0.002 302.00 328.00 3 2.0322e+00 5.6713e-03 6.9195e-02 -6.0000e+00 4.1093e-01 1.5397e-02 7.4533e-03 6.6588e-02 -6.0000e+00 4.4457e-01 -6.3544e-02 7.3246e-03 3.6664e-02 -6.0000e+00 2.6321e-01 1.8236e-02 3.5331e-03 1.1333e-02 -6.0000e+00 1.1137e-01 6.2033e-04 1.3724e-02 9.5041e-05 2.5317e-04 -6.0000e+00 7.6557e-03 2.2147e-01 0.0000e+00 12 9 1 12 4 4 11.17 39.42 1.54 0.22147 0.32460 245 52 2 8 0 201.530 28.94 39.42 39.49 42.17 42.79 25.1 1061.73 -60242 -163628 -120901 -35084 -113151 -16073 -108321 -34221 -126428 -90743 -9214 -19942 -14092 -12373 28637 -27674 -28750 -19190 -30440 7211 4642 1708 -17690 16296 -18313 -3842 -14489 -10101 -9187 -15482 6324 11502 -1061 -15963 3818 -2834 952 771 -1755 -8444 3304 -561 -3001 79 2296 2937 -1017 -482 3976 4365 -806 2987 1370 1608 -726 1259 -179 1932 2942 3566 4386 1657 2471 2339 2764 4236 1950 -1048 567 270 -369 -619 775 -69 1666 -998 577 -1538 -1080 -2441 -2130 -396 -1032 478 -630 489 650 -62 820 544 1357 254 -400 196 19 -193 -704 -273 59 -290 517 -1321 -1638 -1162 -623 -46 883 -216 152 -76 -375 471 559 839 156 297 -361 -559 -256 184 359 185 53 401 1493 459 -187 -131 143 -68 -1 290 -461 316 252 -148 -678 260 -232 217 -204 900000 900000 -358 -2550 -1165 -149 -1186 -80 -1485 -235 -2364 -1442 -83 -255 -206 -204 348 -647 -726 -461 -825 137 97 40 -535 361 -565 -101 -438 -334 -361 -758 274 470 -48 -881 202 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