File name: Pandora25s1_HoustonTX_20231205_L2Fit_fout2c9d20230101p1-8.txt File generation date: 20241218T044220.8Z Data description: Level 2 spectral fitting results file Data file version: fout2c9p1-8 Local principal investigator: Jimmy Flynn Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 25 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora25_OF_v7d20190903.txt Instrument calibration file used: Pandora25s1_CF_v9d20230101.txt Level 1 file used: Pandora25s1_HoustonTX_20231205_L1_smca1c9d20230101p1-8.txt Full location name: University Of Houston Short location name: HoustonTX Country of location: United States Location latitude [deg]: 29.7200 Location longitude [deg]: -95.3400 Location altitude [m]: 19 Local noon date: 20231205 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: Modification of session 8, but repeated E-MLE of HCHO. First and last pixel inside fitting window: 281 423 Nominal wavelengths inside fitting window [nm]: 305.0808 305.2213 305.3618 305.5022 305.6427 305.7831 305.9235 306.0640 306.2044 306.3447 306.4851 306.6255 306.7658 306.9062 307.0465 307.1868 307.3272 307.4675 307.6077 307.7480 307.8883 308.0285 308.1688 308.3090 308.4492 308.5894 308.7296 308.8698 309.0100 309.1501 309.2903 309.4304 309.5705 309.7106 309.8507 309.9908 310.1309 310.2710 310.4110 310.5511 310.6911 310.8311 310.9711 311.1111 311.2511 311.3911 311.5310 311.6710 311.8109 311.9508 312.0907 312.2306 312.3705 312.5104 312.6503 312.7901 312.9300 313.0698 313.2096 313.3494 313.4892 313.6290 313.7688 313.9085 314.0483 314.1880 314.3277 314.4675 314.6072 314.7468 314.8865 315.0262 315.1658 315.3055 315.4451 315.5847 315.7243 315.8639 316.0035 316.1431 316.2826 316.4222 316.5617 316.7013 316.8408 316.9803 317.1198 317.2592 317.3987 317.5382 317.6776 317.8170 317.9564 318.0958 318.2352 318.3746 318.5140 318.6534 318.7927 318.9320 319.0714 319.2107 319.3500 319.4893 319.6285 319.7678 319.9070 320.0463 320.1855 320.3247 320.4639 320.6031 320.7423 320.8815 321.0206 321.1598 321.2989 321.4380 321.5771 321.7162 321.8553 321.9944 322.1334 322.2725 322.4115 322.5506 322.6896 322.8286 322.9676 323.1065 323.2455 323.3845 323.5234 323.6623 323.8012 323.9402 324.0790 324.2179 324.3568 324.4957 324.6345 324.7733 324.9122 --------------------------------------------------------------------------------------- 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 20231205T141748.6Z 8739.595702 290 1 34.04 2 76.67 125.86 31.76 230.73 0.00 1 0.00 1 0 25 5.964e-01 4.426e-02 1.149e-01 3.485e-03 4.719783e-01 1.786628e-03 6.516183e-03 -6.000000e+00 3.452005e-01 224.53 -2.00 3.24 -2.00 319.82 0.00e+00 2.371212e-02 5.650981e-04 4.213949e-03 -6.000000e+00 1.573434e-02 287.06 -2.00 20.00 -2.00 319.11 0.00e+00 4.231 0.001 302.00 328.00 3 3.3111e+00 5.2326e-03 4.8104e-02 -6.0000e+00 8.5244e-01 3.0644e-01 6.1285e-03 2.2677e-02 -6.0000e+00 9.2701e-01 -5.1899e-01 4.1818e-03 1.9522e-02 -6.0000e+00 5.5035e-01 2.6395e-01 2.1570e-03 1.6746e-02 -6.0000e+00 2.3534e-01 1.5484e-04 -7.3313e-04 1.0071e-04 2.5585e-04 -6.0000e+00 1.6958e-02 6.1744e-03 0.0000e+00 12 9 9 12 1 1 99.94 24.19 0.16 0.00617 0.00067 19 6 1 5 0 1701.580 26.73 19.99 24.19 18.25 29.8 1013.87 -148508 359147 173774 109385 142067 104176 900000 123216 900000 82605 98411 221915 69785 101688 89224 113016 113212 138684 109627 125411 103084 101583 70290 59253 36096 40795 26455 27118 42701 40329 84680 59582 62856 53988 42754 50068 55634 68262 35559 20946 12819 23406 13412 22276 25662 24077 12394 23227 30774 23025 26470 14809 16041 14088 10245 5555 2628 -7212 1047 -2334 4853 4783 6073 6572 4600 3541 5044 1959 3737 1368 117 -1968 -2805 -4598 -5530 -2591 -7861 -2710 -2754 -531 -2430 -3448 -4812 -3044 -4883 -5733 -4158 -4012 -3587 -2499 -1818 -1883 -3085 -4428 -4417 -2778 -2397 -317 -508 -504 -311 -670 -988 -1402 -911 -2208 -864 -820 1233 287 443 857 738 376 71 577 431 1076 939 1226 1666 2914 2935 2865 2373 3062 2635 3509 1991 2279 1812 1226 778 1047 -638 -908 -979 -737 -1575 -1451 -980 -2299 -2357 -33184 1220 2340 2449 2077 1922 900000 1746 900000 1588 1598 1300 2051 2868 3470 4072 4452 4613 4952 4982 4916 4643 4059 3596 2591 2745 2005 2023 2834 3017 4926 5042 5721 5460 4502 4754 5269 6382 5071 3778 2654 4606 3038 4848 5612 5525 3239 5608 7055 5837 6913 4604 5200 4833 3678 2066 992 -2914 387 -900 1856 2011 2806 3290 2410 1809 2451 975 1944 802 75 -1310 -1859 -2961 -3353 -1407 -4190 -1381 -1523 -328 -1717 -2699 -4049 -2632 -4491 -5580 -4163 -4124 -3695 -2499 -1720 -1678 -2645 -3833 -4091 -2818 -2698 -386 -660 -658 -389 -788 -1099 -1566 -1065 -2729 -1102 -1094 1715 429 703 1395 1198 593 108 842 629 1611 1470 1990 2722 4660 4594 4379 3530 4405 3703 4951 3014 3691 3108 2184 1424 1970 -1259 -1854 -2033 -1545 -3330 -3016 -1967 -4501 -4504 SS 20231205T142902.7Z 8739.603503 293 1 49.54 2 74.72 127.62 33.70 234.33 0.00 1 0.00 1 0 17 1.079e-01 6.943e-03 1.387e-02 1.258e-03 4.446609e-01 6.402961e-04 4.858326e-03 -6.000000e+00 6.174170e-02 224.53 -2.00 3.24 -2.00 319.13 0.00e+00 1.615334e-03 1.631724e-04 1.760041e-04 -6.000000e+00 2.802930e-03 287.06 -2.00 20.00 -2.00 318.36 0.00e+00 3.723 0.001 302.00 328.00 3 2.4833e+00 1.7814e-03 4.2543e-02 -6.0000e+00 1.5198e-01 3.4037e-02 2.0823e-03 2.1271e-02 -6.0000e+00 1.6507e-01 -2.2035e-02 1.5488e-03 1.0503e-02 -6.0000e+00 9.8841e-02 3.8295e-03 8.1943e-04 3.4863e-03 -6.0000e+00 4.2523e-02 6.4790e-04 -5.0046e-04 3.6381e-05 3.6424e-05 -6.0000e+00 3.0181e-03 9.2339e-03 0.0000e+00 11 8 0 10 0 0 99.65 24.18 0.25 0.00923 0.00547 94 20 1 5 0 526.970 26.73 20.00 24.18 18.83 29.7 1016.67 -91169 -10122 -17197 -5430 -19290 -20850 13960 -14838 13621 -11640 -16371 1499 -11725 -5452 -8995 69696 -416 2160 1354 2216 545 1149 -2158 -375 -1051 -609 -3270 -2141 -2740 -2437 4838 1629 1696 -451 -3599 -219 1606 5508 124 -818 -1407 -54 -1545 -161 1010 832 -841 -552 1076 217 1889 1027 1103 1775 1206 1022 308 -906 524 -106 770 1055 1345 1173 224 58 261 -85 1221 754 106 432 -60 27 366 647 -973 -176 126 -551 -1057 -1343 -1786 -1245 -961 -887 -515 -260 -205 548 679 810 374 872 651 566 176 427 -269 -524 -303 -546 -60 -105 -367 -824 -693 -500 -151 228 -60 140 117 131 184 545 363 340 -127 -304 -396 -21 57 118 319 627 289 1089 389 307 178 -45 76 234 -70 -32 -68 59 -238 -347 -120 -246 -203 -4871 -269 -510 -147 -548 -597 307 -457 382 -411 -624 53 -566 -301 -616 2480 -32 177 110 187 48 100 -204 -37 -113 -68 -377 -234 -292 -270 563 223 259 -73 -576 -34 270 1055 28 -222 -426 -17 -518 -54 339 283 -292 -193 375 75 694 417 483 826 556 488 151 -449 251 -51 378 563 795 715 141 35 159 -52 762 537 79 336 -47 20 264 419 -624 -110 80 -405 -849 -1153 -1670 -1225 -960 -947 -551 -286 -226 606 700 808 352 812 656 613 207 538 -353 -687 -390 -674 -68 -122 -456 -1045 -923 -675 -218 343 -94 227 188 208 271 792 524 491 -196 -476 -629 -33 89 179 479 899 399 1508 588 490 295 -76 132 425 -130 -61 -132 118 -479 -681 -232 -455 -364 SS 20231205T143955.7Z 8739.611061 296 1 49.55 2 72.87 129.40 35.66 237.48 0.00 1 0.00 1 0 25 5.214e-02 5.782e-03 4.993e-03 6.834e-04 4.020081e-01 3.464222e-04 4.430021e-03 -6.000000e+00 2.983740e-02 224.53 -2.00 3.24 -2.00 318.61 0.00e+00 1.435039e-03 7.511811e-05 1.301320e-04 -6.000000e+00 1.354551e-03 287.06 -2.00 20.00 -2.00 317.83 0.00e+00 3.345 0.000 302.00 328.00 3 1.7353e+00 9.4206e-04 3.8272e-02 -6.0000e+00 7.3445e-02 2.1912e-02 1.0845e-03 1.9169e-02 -6.0000e+00 7.9772e-02 -1.6579e-02 7.4601e-04 9.4402e-03 -6.0000e+00 4.7766e-02 2.3045e-03 3.9291e-04 3.0258e-03 -6.0000e+00 2.0550e-02 2.0824e-03 -4.3972e-04 1.9923e-05 3.2830e-05 -6.0000e+00 1.4585e-03 9.2778e-03 0.0000e+00 10 0 0 10 0 0 99.81 24.17 0.21 0.00928 0.00597 285 60 1 5 0 173.840 26.73 20.00 24.17 19.33 29.9 1019.99 -56137 -4702 -6974 -7130 -9656 -10341 15 -5848 1307 -5830 -6968 -2643 -4401 -493 -1775 163 -449 2341 787 2535 1486 868 875 142 -641 -332 -1404 -1599 -139 -227 2828 1897 1207 -915 -1824 -532 -718 941 -85 -947 -1011 -240 -570 -327 245 20 -434 -459 -76 395 708 839 1070 1010 731 907 586 -17 420 529 1020 988 1375 1258 379 60 107 -1 1122 605 116 51 -192 -72 159 169 -347 -144 -106 -442 -806 -1255 -1839 -1504 -1024 -834 -426 -229 116 324 576 659 583 766 721 294 312 467 -83 -369 -283 -552 -120 -7 -683 -961 -632 -660 -146 572 21 42 112 141 165 457 444 259 49 -234 -517 -139 55 156 302 483 492 1107 555 303 145 -58 48 190 38 -58 -187 74 -285 -276 -187 -271 -148 -3548 -197 -309 -297 -377 -401 1 -267 62 -312 -385 -153 -306 -37 -158 16 -48 260 94 311 187 110 116 20 -98 -53 -226 -246 -20 -34 461 352 232 -186 -356 -102 -152 233 -26 -315 -372 -93 -229 -133 100 8 -180 -190 -32 170 306 395 540 543 387 495 327 -10 229 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