File name: Pandora166s1_PhiladelphiaPA_20221016_L2Fit_fout2c5d20220925p1-8.txt File generation date: 20251125T110448.1Z Data description: Level 2 spectral fitting results file Data file version: fout2c5p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 166 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora166_OF_v3d20210217.txt Instrument calibration file used: Pandora166s1_CF_v5d20220925.txt Level 1 file used: Pandora166s1_PhiladelphiaPA_20221016_L1_smca1c5d20220925p1-8.txt Full location name: Philadelphia, Pennsylvania; Philadelphia-Camden-Wilmington; North East Waste (NE Short location name: PhiladelphiaPA Country of location: United States Location latitude [deg]: 39.9919 Location longitude [deg]: -75.0811 Location altitude [m]: 6 Local noon date: 20221016 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: HCHO modification of session 4 "Field cal based on session3" First and last pixel inside fitting window: 223 365 Nominal wavelengths inside fitting window [nm]: 305.0654 305.2061 305.3468 305.4875 305.6282 305.7689 305.9096 306.0503 306.1910 306.3316 306.4722 306.6129 306.7535 306.8941 307.0347 307.1753 307.3158 307.4564 307.5969 307.7375 307.8780 308.0185 308.1590 308.2995 308.4400 308.5805 308.7209 308.8614 309.0018 309.1422 309.2827 309.4231 309.5635 309.7038 309.8442 309.9846 310.1249 310.2652 310.4056 310.5459 310.6862 310.8265 310.9668 311.1070 311.2473 311.3875 311.5278 311.6680 311.8082 311.9484 312.0886 312.2288 312.3690 312.5091 312.6493 312.7894 312.9295 313.0696 313.2097 313.3498 313.4899 313.6300 313.7700 313.9101 314.0501 314.1901 314.3301 314.4701 314.6101 314.7501 314.8901 315.0300 315.1700 315.3099 315.4498 315.5897 315.7296 315.8695 316.0094 316.1493 316.2891 316.4290 316.5688 316.7086 316.8484 316.9882 317.1280 317.2678 317.4076 317.5473 317.6871 317.8268 317.9665 318.1062 318.2459 318.3856 318.5253 318.6650 318.8046 318.9443 319.0839 319.2235 319.3631 319.5027 319.6423 319.7819 319.9215 320.0610 320.2006 320.3401 320.4796 320.6191 320.7586 320.8981 321.0376 321.1770 321.3165 321.4559 321.5954 321.7348 321.8742 322.0136 322.1530 322.2923 322.4317 322.5711 322.7104 322.8497 322.9891 323.1284 323.2677 323.4069 323.5462 323.6855 323.8247 323.9640 324.1032 324.2424 324.3816 324.5208 324.6600 324.7992 324.9383 --------------------------------------------------------------------------------------- Column 1: Two letter code of measurement routine Column 2: UT date and time for center-time of measurement, yyyymmddThhmmssZ (ISO 8601) Column 3: Fractional days since 1-Jan-2000 midnight for center-time of measurement Column 4: Routine count (1 for the first routine of the day, 2 for the second, etc.) Column 5: Repetition count (1 for the first set in the routine, 2 for the second, etc.) Column 6: Total duration of measurement set in seconds Column 7: Data processing type index Column 8: Solar zenith angle for center-time of measurement in degree Column 9: Solar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 10: Lunar zenith angle for center-time of measurement in degree Column 11: Lunar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 12: Pointing zenith angle in degree, absolute or relative (see next column), 999=tracker not used Column 13: Zenith pointing mode: zenith angle is... 0=absolute, 1=relative to sun, 2=relative to moon Column 14: Pointing azimuth in degree, increases clockwise, absolute (0=north) or relative (see next column), 999=tracker not used Column 15: Azimuth pointing mode: like zenith angle mode but also fixed scattering angles relative to sun (3) or moon (4) Column 16: Fitting result index: 0=no error or warning, 1, 2=warning, >2=error Column 17: Number of function evaluations used, 0=linear fitting or fitting not successful or no fitting done Column 18: rms of unweighted fitting residuals, -9=fitting not successful Column 19: Normalized rms of fitting residuals weighted with independent uncertainty, -9=fitting not successful or no uncertainty used Column 20: Expected rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 21: Expected normalized weighted rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 22: Ozone slant column amount [moles per square meter], -9e99=fitting not successful Column 23: Independent uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 24: Structured uncertainty of ozone slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 25: Common uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 26: rms-based uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 27: Ozone effective temperature [K] Column 28: Independent uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 29: Structured uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 30: Common uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 31: Effective ozone fitting wavelength [nm], -9=fitting not successful Column 32: Diffuse correction applied before fitting at effective fitting wavelength for ozone [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 33: Sulfur dioxide slant column amount [moles per square meter], -9e99=fitting not successful Column 34: Independent uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 35: Structured uncertainty of sulfur dioxide slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 36: Common uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 37: rms-based uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 38: Sulfur dioxide effective temperature [K] Column 39: Independent uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 40: Structured uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 41: Common uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 42: Effective sulfur dioxide fitting wavelength [nm], -9=fitting not successful Column 43: Diffuse correction applied before fitting at effective fitting wavelength for sulfur dioxide [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 44: Molecular scattering air mass factor used for molecular scattering subtraction before the fitting Column 45: Estimated uncertainty of molecular scattering air mass factor, -9=molecular scattering was not subtracted before the fitting Column 46: Lower limit used for wavelength scaling [nm] Column 47: Upper limit used for wavelength scaling [nm] Column 48: Order of smoothing polynomial Column 49: Smoothing polynomial coefficient, order 0 Column 50: Independent uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 51: Structured uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 52: Common uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 53: rms-based uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 54: Smoothing polynomial coefficient, order 1 Column 55: Independent uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 56: Structured uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 57: Common uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 58: rms-based uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 59: Smoothing polynomial coefficient, order 2 Column 60: Independent uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 61: Structured uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 62: Common uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 63: rms-based uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 64: Smoothing polynomial coefficient, order 3 Column 65: Independent uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 66: Structured uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 67: Common uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 68: rms-based uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 69: Mean value of measured data inside fitting window [same units as measurements] Column 70: Wavelength change polynomial coefficient, order 0 Column 71: Independent uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 72: Structured uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 73: Common uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 74: rms-based uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 75: L1 based wavelength change coefficient, order 0, -9=no L1 wavelength change determination Column 76: L1 based wavelength change coefficient, order 1, -9=no L1 wavelength change determination Column 77: L2Fit data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 78: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ1 limit, 0=L1 data quality above 0, 1=Spectral fitting was not successful, 2=Wavelength shift too large, 3=Normalized rms of fitting residuals weighted with independent uncertainty too large Column 79: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 80: L1 data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 81: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ1 limit, 0=Saturated data, 1=Too few dark counts measurements, 2=No temperature given or effective temperature too different from the reference temperature, 3=Dark count too high, 4=Unsuccessful dark background fitting, 5=The dark count differs significantly from the dark map for too many pixels, 6=Absolute value of estimated average residual stray light level too high, 7=Although attempted, no wavelength change could be retrieved, 8=Absolute value of retrieved wavelength shift too large, 9=Retrieved wavelength shift differs too much from the shift predicted by the effective temperature Column 82: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 83: Atmospheric variability [%], 999=no atmospheric variability was determined Column 84: Wavelength effective temperature [°C], 999=no effective temperature given Column 85: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 86: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 87: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 88: Number of bright count cycles Column 89: Number of dark count cycles Column 90: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 91: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 92: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 93: Integration time [ms] Column 94: Temperature at electronics board [°C], 999=no temperature signal Column 95: Spectrometer control temperature [°C], 999=no temperature signal Column 96: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 97: Temperature in head sensor [°C], 999=no temperature signal Column 98: Humidity in head sensor [%], -9=no humidity signal Column 99: Pressure in head sensor [hPa], -9=no pressure signal Columns 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: Normalized slant column residuals weighted with independent instrumental uncertainty for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting, 0=no independent instrumental uncertainty was given --------------------------------------------------------------------------------------- SS 20221016T123602.3Z 8324.525027 281 1 48.79 2 75.56 115.26 33.88 259.61 0.00 1 0.00 1 0 25 8.285e-02 5.499e-03 2.490e-02 1.044e-03 5.037401e-01 5.333467e-04 5.710085e-03 -6.000000e+00 4.721890e-02 226.01 -2.00 3.49 -2.00 320.27 0.00e+00 1.747613e-03 1.625607e-04 3.157632e-04 -6.000000e+00 1.914338e-03 284.90 -2.00 20.00 -2.00 319.94 0.00e+00 3.926 0.001 302.00 328.00 3 5.5283e-01 1.5116e-03 4.6896e-02 -6.0000e+00 1.1772e-01 3.5248e-02 1.8324e-03 2.5937e-02 -6.0000e+00 1.2846e-01 -1.4457e-02 1.8243e-03 1.3614e-02 -6.0000e+00 7.5623e-02 -4.9662e-03 9.6545e-04 4.2570e-03 -6.0000e+00 3.1575e-02 3.4005e-03 -3.5790e-04 3.1071e-05 4.7887e-05 -6.0000e+00 2.2787e-03 3.2001e-03 1.9671e-05 10 0 0 10 0 0 99.89 20.06 0.18 0.00320 0.00051 354 70 1 5 0 137.790 26.62 19.99 20.06 21.03 16.8 963.69 -28854 -9411 -35119 -9750 -36801 -15899 -38854 -13483 -20247 -35380 -18542 -27511 -6489 -19306 -5688 -5149 -7419 2387 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258 564 1485 129 -77 -333 -837 -393 -71 -1295 -1809 -1114 -1291 -96 407 624 280 282 183 -273 923 580 372 324 -531 -743 -51 790 187 825 -104 180 1836 602 258 -582 -589 -485 78 -358 -721 1 641 167 -367 -11 -393 219 SS 20221016T124728.6Z 8324.532970 284 1 36.97 2 73.60 117.36 36.00 261.88 0.00 1 0.00 1 0 17 6.869e-02 5.765e-03 5.150e-02 2.759e-03 4.519383e-01 1.403615e-03 5.179832e-03 -6.000000e+00 3.915611e-02 226.01 -2.00 3.49 -2.00 319.96 0.00e+00 1.593273e-03 3.874157e-04 2.441086e-04 -6.000000e+00 1.587358e-03 284.90 -2.00 20.00 -2.00 319.64 0.00e+00 3.484 0.001 302.00 328.00 3 2.5006e+00 3.9149e-03 4.1727e-02 -6.0000e+00 9.7618e-02 3.6931e-02 4.6167e-03 2.3130e-02 -6.0000e+00 1.0652e-01 2.0383e-03 4.2345e-03 1.1973e-02 -6.0000e+00 6.2708e-02 -1.1419e-02 2.2670e-03 3.6830e-03 -6.0000e+00 2.6185e-02 7.7781e-04 -3.8584e-04 8.2665e-05 4.1605e-05 -6.0000e+00 1.8894e-03 2.4551e-03 1.7041e-05 12 1 1 12 9 1 99.99 20.06 0.13 0.00246 -0.00044 76 21 1 5 0 477.880 26.62 20.00 20.06 22.00 16.7 968.96 -22730 50506 -5900 29422 -30100 -2631 -247 -5462 22876 -3347 6430 -12736 13720 -3015 -5337 -3221 -8336 2692 1612 3156 -5778 2019 -1054 3291 2374 -8071 6206 -10449 4828 -1617 10 -153 65 1864 -1658 1762 -4669 -1519 -3581 -699 -2985 -3064 -1185 -2116 497 1410 -1262 830 -1692 1967 -828 2787 252 1106 1483 1057 2028 -1618 1052 -623 1809 2086 1508 2206 652 -210 -931 -147 489 143 479 1120 208 302 204 -339 -967 -1177 -917 34 -1120 -802 -2087 -1306 -1619 -208 -254 315 973 516 832 306 165 86 12 126 330 1550 197 83 -520 -905 -357 -146 -767 -1483 -638 -812 54 449 583 377 265 405 -106 116 146 255 105 -368 -171 -4 347 230 87 -142 -301 1034 571 128 -422 -403 -239 -58 -328 -451 300 395 316 -119 -182 -165 95 -411 560 -109 394 -611 -42 -4 -106 387 -75 136 -340 342 -103 -219 -148 -434 136 88 177 -360 118 -66 211 164 -641 438 -829 324 -119 1 -14 7 197 -173 177 -544 -201 -580 -129 -625 -681 -271 -497 115 328 -303 197 -417 487 -227 809 81 377 526 388 754 -622 388 -232 679 847 680 1076 331 -103 -442 -69 248 82 300 728 136 189 119 -180 -479 -575 -479 20 -760 -604 -1711 -1117 -1475 -199 -255 324 994 514 776 267 136 70 11 124 363 1870 257 108 -644 -1040 -383 -159 -895 -1830 -816 -1091 77 682 942 629 438 642 -160 167 209 377 164 -602 -283 -7 548 352 129 -204 -417 1434 856 208 -734 -728 -445 -111 -665 -955 645 862 692 -257 -377 -330 185 SS 20221016T142940.2Z 8324.603937 350 1 48.91 2 58.26 139.43 55.06 277.88 0.00 1 0.00 1 0 17 1.632e-02 6.635e-03 7.370e-03 1.984e-03 2.504338e-01 9.891729e-04 2.986710e-03 -6.000000e+00 9.310813e-03 226.00 -2.00 3.49 -2.00 317.91 0.00e+00 4.892774e-04 1.498905e-04 6.045082e-05 -6.000000e+00 3.771385e-04 284.89 -2.00 20.00 -2.00 317.57 0.00e+00 1.894 0.000 302.00 328.00 3 3.5182e+00 2.6188e-03 2.2776e-02 -6.0000e+00 2.3213e-02 2.4254e-02 2.9424e-03 1.2656e-02 -6.0000e+00 2.5322e-02 1.3588e-02 1.8585e-03 6.3229e-03 -6.0000e+00 1.4908e-02 -1.1770e-02 9.4206e-04 1.8424e-03 -6.0000e+00 6.2299e-03 1.7435e-03 7.6343e-04 5.9248e-05 2.1009e-05 -6.0000e+00 4.4874e-04 -5.2973e-05 1.5321e-04 11 8 0 10 0 0 100.00 20.10 0.16 -0.00005 0.00568 315 63 1 5 0 155.260 26.62 20.01 20.10 23.76 17.1 982.92 4020 -179 -2877 -2009 -7973 2550 -2498 6186 3776 -112 -1101 -5635 1869 -4425 2854 -337 624 510 324 3038 -476 1527 -297 1993 218 820 -715 -1999 510 -672 2452 1051 2704 -823 -3973 -1343 -4579 202 -1357 -663 -1639 -950 -513 -1495 175 -1503 -408 -855 -1067 388 492 1109 825 1656 -3 1331 689 3 623 -48 1674 986 2137 1676 1 -341 -484 -242 848 957 103 861 431 525 530 -662 252 -880 775 -369 -895 -1171 -2685 -1484 -1236 -388 -511 175 418 393 471 142 545 522 716 290 649 892 -156 -118 -617 -533 -242 -45 -1047 -1262 -690 -1081 136 193 594 192 269 33 -372 634 257 539 36 -66 -418 -172 415 97 831 -3 558 1224 440 307 -355 -214 -414 451 -122 -196 3 307 62 -353 -73 -466 -49 358 -18 -302 -198 -748 210 -227 576 396 -13 -126 -688 236 -673 459 -61 117 99 66 619 -102 320 -65 447 52 202 -179 -479 112 -147 550 257 700 -226 -1061 -344 -1309 64 -516 -289 -785 -472 -262 -777 89 -780 -206 -424 -519 187 249 595 470 982 -2 829 438 2 390 -30 1065 676 1563 1304 1 -252 -332 -162 594 750 88 766 385 454 430 -493 169 -570 513 -275 -746 -1073 -2651 -1514 -1339 -445 -616 216 517 471 527 147 518 480 688 305 750 1128 -211 -158 -784 -629 -270 -51 -1302 -1658 -940 -1538 200 300 962 317 430 49 -521 832 336 730 52 -101 -659 -269 631 143 1163 -4 718 1563 598 445 -541 -334 -659 736 -211 -353 5 577 117 -660 -131 -821 -85 SS 20221016T143445.4Z 8324.607470 354 1 48.34 2 57.63 140.72 56.00 278.58 0.00 1 0.00 1 0 17 9.735e-03 6.141e-03 2.611e-03 7.910e-04 2.476986e-01 3.957589e-04 2.969810e-03 -6.000000e+00 5.551255e-03 226.00 -2.00 3.49 -2.00 317.58 0.00e+00 4.150097e-04 5.536211e-05 5.492404e-05 -6.000000e+00 2.249738e-04 284.89 -2.00 20.00 -2.00 317.25 0.00e+00 1.861 0.000 302.00 328.00 3 2.2777e+00 1.0423e-03 2.2438e-02 -6.0000e+00 1.3839e-02 2.9662e-02 1.1685e-03 1.2530e-02 -6.0000e+00 1.5100e-02 1.9509e-03 7.2263e-04 6.2558e-03 -6.0000e+00 8.8892e-03 -6.9778e-03 3.6166e-04 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