File name: Pandora143s1_LibertyTX_20250506_L2Fit_fout2c9d20230920p1-8.txt File generation date: 20250507T062932.4Z Data description: Level 2 spectral fitting results file Data file version: fout2c9p1-8 Local principal investigator: Yuxuan Wang Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 143 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora143_OF_v1d20230920.txt Instrument calibration file used: Pandora143s1_CF_v9d20230920.txt Level 1 file used: Pandora143s1_LibertyTX_20250506_L1_smca1c9d20230920p1-8.txt Full location name: Sam Houston Regional Library and Research Center Short location name: LibertyTX Country of location: United States Location latitude [deg]: 30.0965 Location longitude [deg]: -94.7635 Location altitude [m]: 3 Local noon date: 20250506 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: 242 384 Nominal wavelengths inside fitting window [nm]: 305.0307 305.1715 305.3123 305.4532 305.5940 305.7348 305.8756 306.0164 306.1572 306.2979 306.4387 306.5794 306.7201 306.8609 307.0016 307.1423 307.2829 307.4236 307.5643 307.7049 307.8456 307.9862 308.1268 308.2674 308.4080 308.5486 308.6892 308.8297 308.9703 309.1108 309.2513 309.3919 309.5324 309.6729 309.8133 309.9538 310.0943 310.2347 310.3752 310.5156 310.6560 310.7964 310.9368 311.0772 311.2175 311.3579 311.4982 311.6386 311.7789 311.9192 312.0595 312.1998 312.3401 312.4804 312.6206 312.7609 312.9011 313.0413 313.1815 313.3217 313.4619 313.6021 313.7423 313.8824 314.0226 314.1627 314.3028 314.4429 314.5830 314.7231 314.8632 315.0033 315.1433 315.2834 315.4234 315.5634 315.7034 315.8434 315.9834 316.1234 316.2633 316.4033 316.5432 316.6831 316.8231 316.9630 317.1029 317.2427 317.3826 317.5225 317.6623 317.8022 317.9420 318.0818 318.2216 318.3614 318.5012 318.6409 318.7807 318.9204 319.0602 319.1999 319.3396 319.4793 319.6190 319.7587 319.8983 320.0380 320.1776 320.3173 320.4569 320.5965 320.7361 320.8757 321.0153 321.1548 321.2944 321.4339 321.5734 321.7129 321.8524 321.9919 322.1314 322.2709 322.4104 322.5498 322.6892 322.8287 322.9681 323.1075 323.2469 323.3862 323.5256 323.6650 323.8043 323.9436 324.0829 324.2223 324.3616 324.5008 324.6401 324.7794 324.9186 --------------------------------------------------------------------------------------- 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 20250506T140701.7Z 9257.588214 154 1 24.00 2 57.92 88.34 141.10 0.09 0.00 1 0.00 1 0 17 1.694e-01 3.626e-02 7.547e-02 1.566e-02 2.434704e-01 7.747590e-03 2.851824e-03 -6.000000e+00 9.430140e-02 230.56 -2.00 3.25 -2.00 317.51 0.00e+00 -1.726584e-03 1.179371e-03 9.437474e-04 -6.000000e+00 4.229160e-03 289.34 -2.00 20.00 -2.00 316.64 0.00e+00 1.876 0.000 302.00 328.00 3 8.0676e+00 2.0654e-02 2.2380e-02 -6.0000e+00 2.3570e-01 6.3566e-02 2.3339e-02 1.3352e-02 -6.0000e+00 2.5508e-01 2.0846e-02 1.4211e-02 5.5688e-03 -6.0000e+00 1.5211e-01 -8.7386e-03 7.1537e-03 2.6818e-03 -6.0000e+00 6.5727e-02 1.8457e-05 7.8374e-04 4.1463e-04 2.1083e-05 -6.0000e+00 4.0492e-03 -5.8575e-03 0.0000e+00 12 8 8 10 0 0 2.75 24.43 1.90 -0.00586 0.00003 6 6 2 8 0 4000.000 19.99 24.43 29.66 25.90 26.21 29.3 1067.04 68672 24262 -1053 -23240 133592 45293 -2686 -17033 -11123 5808 30778 -18100 19481 -25681 30563 -2252 7736 -31584 51761 -6936 5668 20890 -130 18585 5002 11347 -11297 19717 -25353 -6752 -138 5574 3154 33186 10473 -28401 8069 1469 17601 -2380 4801 -6218 3530 4962 839 144 424 -797 -6658 737 -1103 3689 5479 4239 -4498 5837 -639 -3930 6385 -5476 7803 -993 3169 3013 -389 2722 -175 -2528 -4607 1619 2155 3277 -4705 5781 -6482 -249 -6691 -4905 3052 -6473 -846 -3554 2859 -5240 -1038 2044 6036 1720 4456 3099 3687 -574 -4386 -242 -1912 -1420 -539 281 -2519 -201 4016 -3061 -9127 -2897 -2166 -3746 193 -1364 2436 -195 1796 -1017 3388 -2318 4371 -31 2472 -843 2370 -1452 -146 2588 1733 1938 172 624 -1196 2422 -1279 2754 -1596 -1821 -1499 -4333 4234 151 714 -1852 3119 -893 1799 -1521 -2203 3649 2187 -124 -3240 3677 2670 -261 -2191 -1558 741 3048 -2811 2305 -5324 4230 -469 1524 -9251 7130 -1733 1300 4109 -31 3970 1318 2973 -3674 4497 -8174 -1736 -34 1428 901 7494 2747 -10099 2146 486 6093 -1168 2429 -3646 1939 2708 473 82 237 -436 -3747 382 -606 2088 3231 2656 -3150 3802 -454 -2883 4175 -3914 5007 -733 2444 2496 -338 2144 -128 -1794 -3491 1323 1931 3044 -4723 5145 -6111 -201 -5138 -3446 2020 -5230 -729 -3447 2791 -5699 -1148 2354 7105 2182 5534 3812 4253 -629 -4507 -227 -1896 -1531 -632 359 -3538 -277 5056 -3746 -11027 -3389 -2731 -5082 262 -1939 3472 -301 2872 -1700 5321 -3587 5875 -41 3104 -1127 3278 -2217 -227 3918 2570 2778 240 832 -1524 2930 -1691 3784 -2390 -2778 -2290 -6986 6666 260 1251 -3373 5514 -1614 3075 -2567 -3629 SS 20250506T144523.1Z 9257.614851 172 1 28.00 2 49.62 93.23 140.23 14.39 0.00 1 0.00 1 0 33 1.234e-01 4.136e-02 4.496e-02 1.454e-02 2.052189e-01 7.225892e-03 2.510429e-03 -6.000000e+00 6.959488e-02 230.56 -2.00 3.25 -2.00 316.91 0.00e+00 1.555529e-04 9.759211e-04 8.777698e-04 -6.000000e+00 3.096271e-03 289.34 -2.00 20.00 -2.00 316.10 0.00e+00 1.541 0.000 302.00 328.00 3 7.3066e+00 1.9120e-02 1.8251e-02 -6.0000e+00 1.7402e-01 4.9585e-02 2.1498e-02 9.7088e-03 -6.0000e+00 1.8750e-01 1.7858e-02 1.2703e-02 4.6672e-03 -6.0000e+00 1.1171e-01 -1.3189e-02 6.2342e-03 1.3119e-03 -6.0000e+00 4.9376e-02 5.9301e-05 1.3637e-02 3.8493e-04 1.0507e-05 -6.0000e+00 2.9593e-03 -1.0452e-01 0.0000e+00 12 8 8 10 0 0 93.09 24.38 1.57 -0.10452 -0.00204 7 7 5 8 0 4000.000 19.99 24.38 31.17 25.90 26.21 29.3 1077.35 900000 12167 35 -17921 101180 5739 24560 -10335 -6484 -4563 24822 -13356 15778 -6894 20190 13961 -16085 -15977 17332 4405 -571 14322 -10256 1058 -7389 17401 -1638 6289 -12954 4023 15433 -4065 14429 30193 15891 -28175 13110 -37247 8183 4391 2299 -4225 423 8932 -1542 7450 -5945 1712 -9291 2284 1902 5913 6725 9799 512 1829 9551 -8010 6844 -7120 5322 591 3670 4742 1997 2728 -2460 1257 -6844 7795 -2875 4077 -5434 3806 -3548 -2801 -2370 -4464 2626 320 3104 -1473 5834 -6352 2400 -1195 4808 -280 753 1978 -939 4433 -3912 1321 -558 984 -3259 -2207 -3363 -1372 999 -3002 -6578 -1407 -2648 -3637 2245 -3309 1727 -2418 2751 -835 2228 -3366 4169 424 4544 -224 -924 -249 -432 6141 1923 2941 -1055 3095 -2628 3284 1622 1405 -1142 -490 1675 -2743 5597 -418 580 -2625 1395 -1748 1392 -2321 -2523 900000 1681 6 -3231 5154 665 2439 -1630 -1124 -824 3307 -2497 2428 -1498 3861 3104 -4925 -4975 4075 1211 -170 3663 -3295 319 -2579 5032 -568 1908 -4362 1096 3861 -1322 4262 8058 4532 -11398 3767 -19964 3459 2250 1316 -2679 263 5190 -984 4390 -3903 1011 -5892 1276 1103 3537 4215 6241 365 1309 6522 -6432 4704 -5475 3712 457 2988 4082 1790 2256 -1919 894 -5448 6184 -2765 3862 -5644 3550 -3359 -2400 -1807 -3208 1780 247 2614 -1418 5595 -7018 2587 -1426 5767 -364 975 2484 -1140 4699 -4032 1221 -543 1028 -3873 -2841 -4693 -1891 1274 -3635 -7702 -1611 -3328 -4900 2972 -4754 2457 -3758 4300 -1370 3456 -5140 5466 536 5443 -290 -1278 -368 -662 8875 2805 4118 -1462 3975 -3337 3863 2041 1900 -1653 -718 2408 -4215 8412 -698 984 -4661 2428 -3094 2331 -3860 -4084 SS 20250506T145903.7Z 9257.624348 177 1 26.91 2 46.67 95.14 139.46 19.27 0.00 1 0.00 1 0 17 1.697e-02 8.304e-03 9.836e-03 4.059e-03 1.959241e-01 2.007045e-03 2.193656e-03 -6.000000e+00 9.456439e-03 230.56 -2.00 3.25 -2.00 316.78 0.00e+00 -2.224849e-05 2.537790e-04 3.267089e-05 -6.000000e+00 4.239633e-04 289.34 -2.00 20.00 -2.00 315.94 0.00e+00 1.455 0.000 302.00 328.00 3 5.1800e+00 5.2898e-03 1.7407e-02 -6.0000e+00 2.3635e-02 1.3236e-02 5.9271e-03 9.4789e-03 -6.0000e+00 2.5571e-02 1.0778e-02 3.4646e-03 4.6106e-03 -6.0000e+00 1.5249e-02 -6.8212e-03 1.6764e-03 1.2824e-03 -6.0000e+00 6.5955e-03 5.5791e-04 -4.7303e-04 1.0671e-04 1.2836e-05 -6.0000e+00 4.0554e-04 -1.1806e-02 0.0000e+00 11 8 0 10 0 0 100.00 24.35 0.54 -0.01181 -0.01536 77 77 5 8 0 349.440 20.01 24.35 31.44 25.90 26.21 29.4 1080.52 -2829 212 -35 -4752 681 -4237 5184 632 2405 -6883 2468 -4085 3415 -1560 3977 202 -665 -3252 2380 63 -234 2512 -868 2418 -93 2935 -453 1262 -1301 -412 2385 306 2183 2474 1113 -6182 813 -5701 1542 -335 1223 -1836 -1122 -1700 -685 138 -1791 705 -2215 573 451 1636 990 1452 -411 816 1295 -712 1951 -679 1586 -186 1424 1743 1025 -810 -343 -1132 -444 1241 -690 905 -791 860 -596 -267 -591 748 961 10 50 -591 -908 -2023 -1010 -971 95 -929 933 621 900 293 324 1086 53 -252 -610 683 -120 183 -574 -344 -756 492 260 -1294 -379 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