File name: Pandora55s1_QueensNY_20210208_L2Fit_fout2c11d20210101p1-8.txt File generation date: 20260625T175421.8Z Data description: Level 2 spectral fitting results file Data file version: fout2c11p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora55_OF_v4d20190723.txt Instrument calibration file used: Pandora55s1_CF_v11d20210101.txt Level 1 file used: Pandora55s1_QueensNY_20210208_L1_smca1c11d20210101p1-8.txt Full location name: Queens College NYSDEC (USEPA AQS ID 36-081-0124) Short location name: QueensNY Country of location: USA Location latitude [deg]: 40.7361 Location longitude [deg]: -73.8215 Location altitude [m]: 25 Local noon date: 20210208 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are latency correction, matrix method stray light correction (replaced by simple method) Data caveats: None First and last pixel inside fitting window: 261 404 Nominal wavelengths inside fitting window [nm]: 305.0145 305.1546 305.2946 305.4346 305.5746 305.7145 305.8545 305.9945 306.1344 306.2744 306.4143 306.5542 306.6941 306.8340 306.9739 307.1138 307.2536 307.3935 307.5333 307.6732 307.8130 307.9528 308.0926 308.2324 308.3722 308.5120 308.6517 308.7915 308.9312 309.0710 309.2107 309.3504 309.4901 309.6298 309.7695 309.9091 310.0488 310.1884 310.3281 310.4677 310.6073 310.7469 310.8865 311.0261 311.1657 311.3053 311.4448 311.5844 311.7239 311.8634 312.0029 312.1424 312.2819 312.4214 312.5609 312.7003 312.8398 312.9792 313.1187 313.2581 313.3975 313.5369 313.6763 313.8156 313.9550 314.0944 314.2337 314.3730 314.5124 314.6517 314.7910 314.9303 315.0695 315.2088 315.3481 315.4873 315.6265 315.7658 315.9050 316.0442 316.1834 316.3226 316.4617 316.6009 316.7401 316.8792 317.0183 317.1574 317.2966 317.4357 317.5747 317.7138 317.8529 317.9919 318.1310 318.2700 318.4090 318.5481 318.6871 318.8260 318.9650 319.1040 319.2429 319.3819 319.5208 319.6598 319.7987 319.9376 320.0765 320.2153 320.3542 320.4931 320.6319 320.7708 320.9096 321.0484 321.1872 321.3260 321.4648 321.6036 321.7423 321.8811 322.0198 322.1586 322.2973 322.4360 322.5747 322.7134 322.8520 322.9907 323.1294 323.2680 323.4066 323.5453 323.6839 323.8225 323.9611 324.0996 324.2382 324.3768 324.5153 324.6538 324.7924 324.9309 --------------------------------------------------------------------------------------- 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 100-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-387: 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 20210208T142918.9Z 7709.603691 183 1 51.84 2 66.78 137.41 66.58 181.24 0.00 1 0.00 1 0 17 3.404e-01 5.557e-02 1.994e-02 2.456e-03 3.611861e-01 1.252432e-03 4.327906e-03 -6.000000e+00 1.994903e-01 224.64 -2.00 3.51 -2.00 318.12 0.00e+00 1.912170e-02 2.244840e-04 5.989414e-04 -6.000000e+00 8.665353e-03 275.27 -2.00 20.00 -2.00 317.56 0.00e+00 2.517 0.000 302.00 328.00 3 4.5735e+00 3.3256e-03 3.3072e-02 -6.0000e+00 4.9286e-01 1.9994e-01 3.7346e-03 3.0595e-02 -6.0000e+00 5.3593e-01 -2.8292e-01 2.3279e-03 1.2311e-02 -6.0000e+00 3.1893e-01 1.4989e-01 1.2019e-03 1.5705e-02 -6.0000e+00 1.3387e-01 2.5749e-04 -1.1815e-03 7.3610e-05 1.4658e-04 -6.0000e+00 1.0146e-02 -7.5648e-05 1.9512e-05 12 9 8 11 8 0 -48.25 22.82 0.26 -0.00008 -0.00895 15 3 1 5 0 3455.190 25.68 20.01 22.82 2.74 25.8 1028.50 64710 121417 232926 62578 75483 94507 62505 100720 57688 23124 7672 27141 15703 51168 79791 44838 26664 -98956 72506 61349 66964 49290 42972 23265 15321 6547 19839 381 6841 12446 21395 34376 19563 21897 22182 43777 14132 12790 16770 8399 -86 738 -3435 2 5184 12853 7325 15300 14339 14489 11980 8310 6540 9986 8319 3403 1306 -3156 -3747 -4332 -2087 3352 1178 -408 2877 775 6387 1663 4777 451 -2237 -2431 -1630 -5266 -2885 -4172 -2736 -402 -3565 -982 -2527 374 -2475 -2440 -4783 -3364 -4230 -2851 -3638 -1726 -1543 -2062 -1145 -1542 -2818 -1277 -1933 -435 232 -459 955 1185 784 1739 187 -352 -627 -226 -65 1540 1150 -324 887 -96 -202 101 826 1615 1188 755 -89 758 1591 1960 1131 1800 692 2082 1460 833 2222 1748 1554 1113 657 -7 121 -467 -922 -1844 -1120 -1658 -1374 -2354 3748 4838 3502 4528 4457 4170 3443 3799 3258 1771 660 1994 1469 4264 6281 5722 4430 -50922 8907 8653 9061 7678 6782 4198 2875 1299 3454 78 1315 2342 4035 6497 4691 5440 5475 8539 3561 3491 4945 2958 -35 314 -1572 1 2362 5662 3438 6802 6437 6556 5666 4226 3550 5477 4738 2021 787 -1947 -2295 -2651 -1284 2079 800 -301 2166 594 4518 1172 3295 340 -1849 -2112 -1435 -4693 -2437 -3370 -2035 -280 -2536 -728 -2090 330 -2383 -2454 -5055 -3667 -4841 -3347 -4369 -2044 -1783 -2284 -1189 -1535 -2824 -1333 -2190 -529 301 -623 1280 1524 958 2039 225 -439 -815 -303 -90 2201 1726 -509 1403 -151 -306 147 1154 2244 1698 1125 -137 1177 2440 2949 1669 2575 970 2816 2001 1194 3321 2722 2486 1812 1101 -12 215 -848 -1693 -3413 -2036 -2955 -2379 -4035 SS 20210208T143515.0Z 7709.607812 186 1 49.95 2 66.03 138.74 66.61 182.65 0.00 1 0.00 1 0 25 1.306e-01 1.244e-02 1.788e-02 2.409e-03 3.668454e-01 1.236705e-03 4.375593e-03 -6.000000e+00 7.657290e-02 224.64 -2.00 3.51 -2.00 318.12 0.00e+00 -3.588961e-04 2.249161e-04 1.236545e-04 -6.000000e+00 3.325034e-03 275.27 -2.00 20.00 -2.00 317.53 0.00e+00 2.444 0.000 302.00 328.00 3 4.6510e+00 3.2940e-03 3.0630e-02 -6.0000e+00 1.8918e-01 3.7920e-02 3.7326e-03 1.8612e-02 -6.0000e+00 2.0568e-01 2.2152e-03 2.4668e-03 9.3104e-03 -6.0000e+00 1.2240e-01 -8.5043e-03 1.2755e-03 2.6838e-03 -6.0000e+00 5.1403e-02 2.7494e-04 -4.3990e-04 7.3999e-05 3.2771e-05 -6.0000e+00 3.8921e-03 -2.1010e-03 5.8907e-05 12 9 8 11 32 0 -42.64 22.82 0.52 -0.00210 -0.00541 15 3 1 5 0 3329.030 25.68 20.00 22.82 2.88 25.8 1028.49 -23930 25117 119603 -30643 -7569 18312 -3297 48860 13003 -14348 -18471 -1573 -9882 2654 32265 -6714 -26114 5245 17226 9009 13729 1361 2860 -5001 -5963 -3713 12147 -2266 -4602 -4266 -338 6943 -5047 -5698 -1718 16407 -3117 -5040 5675 1467 -3707 -1270 -3710 -1895 -1222 5128 -3545 3782 981 2509 -138 -848 -1807 2952 1016 2072 3680 1746 3157 474 160 3250 886 -2356 -229 -2001 2371 -351 3232 668 -1170 -143 982 -1176 -1097 43 929 2792 -381 744 -1240 582 -1098 -951 -1826 -1058 -1229 -455 -1405 -659 -162 -562 706 615 202 1128 1229 492 -510 -939 -751 -185 -380 830 826 -500 -63 -302 55 509 657 -1014 -363 -180 -313 275 1083 1077 577 -56 -1397 -219 280 789 28 599 -337 921 551 58 838 478 -126 360 572 -182 -204 46 -38 -935 389 -543 -68 -527 -1424 1071 2217 -2308 -431 778 -176 1760 741 -1142 -1586 -120 -898 248 2663 -896 -4513 723 2240 1320 1984 223 471 -924 -1187 -765 2212 -460 -917 -829 -66 1377 -1219 -1467 -431 3418 -790 -1442 1724 535 -1571 -566 -1753 -901 -582 2334 -1718 1721 455 1163 -67 -439 -1003 1663 607 1264 2272 1103 1968 297 101 2066 610 -1768 -176 -1555 1719 -251 2279 512 -981 -126 877 -1058 -954 35 705 1972 -273 557 -1033 520 -1064 -964 -1937 -1164 -1414 -538 -1697 -789 -188 -627 738 617 203 1181 1381 598 -664 -1271 -1011 -238 -465 977 988 -627 -81 -406 76 731 985 -1591 -577 -282 -473 398 1504 1491 821 -82 -2155 -339 428 1183 41 855 -471 1244 750 82 1247 741 -200 582 948 -312 -361 83 -70 -1719 701 -962 -117 -897 SS 20210208T150127.6Z 7709.626014 202 1 51.16 2 62.96 144.88 67.10 188.88 0.00 1 0.00 1 0 25 2.611e-02 7.454e-03 4.911e-03 1.339e-03 3.309194e-01 6.880294e-04 3.990568e-03 -6.000000e+00 1.530190e-02 224.64 -2.00 3.51 -2.00 317.45 0.00e+00 -1.664025e-04 1.027574e-04 1.075151e-04 -6.000000e+00 6.646342e-04 275.27 -2.00 20.00 -2.00 316.86 0.00e+00 2.187 0.000 302.00 328.00 3 3.9201e+00 1.8074e-03 2.7487e-02 -6.0000e+00 3.7805e-02 2.5713e-02 2.0333e-03 1.6750e-02 -6.0000e+00 4.1107e-02 -7.7110e-03 1.2479e-03 8.3505e-03 -6.0000e+00 2.4462e-02 -1.1070e-03 6.2080e-04 2.3853e-03 -6.0000e+00 1.0270e-02 7.7745e-04 -5.6285e-04 4.1046e-05 3.0097e-05 -6.0000e+00 7.7819e-04 -2.6517e-03 -4.8313e-05 11 8 0 10 0 0 88.66 22.82 0.19 -0.00265 -0.00688 37 7 1 5 0 1382.290 25.68 20.01 22.82 3.93 25.9 1028.24 -10531 -1632 9020 -14352 -5164 -4684 -4476 7522 3132 -5994 -6936 -1492 -4273 864 5142 -1113 -8033 2871 4426 2698 2283 860 2612 193 -1083 -2103 3197 -2644 -471 -1020 567 2906 -369 -3711 -920 5369 -1020 -1418 2004 161 -1518 -634 -2186 -821 -1073 744 -2080 269 -449 457 649 -178 329 1506 1905 904 1916 960 1214 1024 1154 1871 878 -452 -725 -712 700 116 1746 851 -334 -272 4 -1008 -73 -750 932 1314 760 406 -504 -144 -1174 -1301 -1587 -839 -1109 -626 -997 -408 -131 249 487 1049 1072 1267 415 550 -254 -542 -627 -517 -135 1014 275 -674 -363 -504 -94 263 11 -502 -126 -208 -307 280 728 840 579 -50 -733 -380 66 150 226 249 312 1182 904 192 575 113 431 202 305 -208 -28 171 -323 -619 -133 -324 -154 -360 -936 -150 788 -1528 -473 -404 -392 650 314 -699 -842 -177 -568 125 817 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