File name: Pandora101s1_Izana_20241027_L2Fit_fout2c22d20230904p1-8.txt File generation date: 20241028T005253.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c22p1-8 Local principal investigator: Alberto Redondas Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 101 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora101_OF_v3d20220624.txt Instrument calibration file used: Pandora101s1_CF_v22d20230904.txt Level 1 file used: Pandora101s1_Izana_20241027_L1_smca1c22d20230904p1-8.txt Full location name: Izana Atmospheric Research Center Short location name: Izana Country of location: Spain Location latitude [deg]: 28.3090 Location longitude [deg]: -16.4994 Location altitude [m]: 2360 Local noon date: 20241027 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: Based on session 12 fieldcal with sens applied First and last pixel inside fitting window: 222 363 Nominal wavelengths inside fitting window [nm]: 305.1209 305.2618 305.4026 305.5434 305.6843 305.8251 305.9659 306.1066 306.2474 306.3882 306.5289 306.6697 306.8104 306.9511 307.0918 307.2325 307.3732 307.5139 307.6545 307.7952 307.9358 308.0764 308.2170 308.3576 308.4982 308.6388 308.7794 308.9199 309.0605 309.2010 309.3415 309.4820 309.6225 309.7630 309.9035 310.0440 310.1844 310.3249 310.4653 310.6057 310.7461 310.8865 311.0269 311.1673 311.3076 311.4480 311.5883 311.7287 311.8690 312.0093 312.1496 312.2898 312.4301 312.5704 312.7106 312.8509 312.9911 313.1313 313.2715 313.4117 313.5519 313.6920 313.8322 313.9723 314.1125 314.2526 314.3927 314.5328 314.6729 314.8129 314.9530 315.0931 315.2331 315.3731 315.5131 315.6531 315.7931 315.9331 316.0731 316.2130 316.3530 316.4929 316.6329 316.7728 316.9127 317.0526 317.1924 317.3323 317.4722 317.6120 317.7518 317.8916 318.0315 318.1712 318.3110 318.4508 318.5906 318.7303 318.8701 319.0098 319.1495 319.2892 319.4289 319.5686 319.7082 319.8479 319.9875 320.1272 320.2668 320.4064 320.5460 320.6856 320.8252 320.9647 321.1043 321.2438 321.3833 321.5229 321.6624 321.8019 321.9413 322.0808 322.2203 322.3597 322.4991 322.6386 322.7780 322.9174 323.0568 323.1961 323.3355 323.4749 323.6142 323.7535 323.8928 324.0321 324.1714 324.3107 324.4500 324.5893 324.7285 324.8677 --------------------------------------------------------------------------------------- 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 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: 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 20241027T072918.3Z 9066.312018 178 1 6.43 2 87.69 106.09 32.32 117.33 0.00 1 0.00 1 0 33 1.254e-01 7.050e-02 2.571e-02 1.426e-02 6.699122e-01 7.272351e-03 8.342695e-03 -6.000000e+00 7.034245e-02 224.94 -2.00 3.19 -2.00 316.75 0.00e+00 -8.760367e-03 7.715591e-04 2.509034e-03 -6.000000e+00 3.058917e-03 277.52 -2.00 20.00 -2.00 316.00 0.00e+00 15.458 0.038 302.00 328.00 3 -2.3788e+00 1.8607e-02 1.2366e-01 -6.0000e+00 1.7410e-01 2.2933e+00 2.1059e-02 3.8268e-02 -6.0000e+00 1.8916e-01 -1.4381e+00 1.1953e-02 1.5566e-02 -6.0000e+00 1.1249e-01 4.2069e-01 5.5012e-03 1.0812e-02 -6.0000e+00 4.8916e-02 1.8979e-05 3.3439e-03 3.5643e-04 1.4087e-04 -6.0000e+00 3.2486e-03 9.3906e-03 0.0000e+00 12 9 9 12 33 33 73.89 20.87 1.50 0.00939 0.03452 11 23 1 5 0 535.280 20.87 15.00 14.41 11.27 1.7 679.21 37515 20660 18768 -9411 -19017 -27605 -17467 -15475 -8150 -12580 -13258 -583 2186 16034 18075 23225 15959 19781 5871 12160 -6255 -305 161 11073 34433 10213 -7227 -23472 -32735 -29183 -11385 -8705 -1333 -17329 -21992 -29683 -16068 -8221 12943 14323 22538 20277 10859 2573 3648 -7913 -14056 -1033 -10870 -3530 -4292 11686 2954 12559 6423 17676 7351 4046 -6238 -15055 -4999 -2558 3342 3497 2197 -6103 -1913 -7968 6121 22023 25587 15276 2870 -6688 -15332 -22852 -26629 -26442 -1569 4945 5098 9030 2289 8258 4325 11395 4236 6437 1463 859 -3526 -5866 -10829 -6029 -6119 -4064 5151 5028 6838 -121 -4598 -19000 -8879 -7824 -4908 -7594 -3154 8183 9135 11602 10741 8890 2994 -648 -5852 -3143 -4491 -1170 -867 2885 3824 6185 4025 4775 -174 -2274 -174 -1480 2286 -1669 -2231 -4831 -2937 -4074 -769 -1441 1239 1712 341 1083 1499 3916 12428 7759 6312 -3391 -6468 -10157 -6339 -5988 -3019 -4708 -4862 -201 813 5738 6833 8516 6255 7379 2427 4490 -2555 -113 63 4144 10406 3758 -2796 -9171 -12914 -11624 -4204 -3401 -501 -6990 -8342 -12235 -6481 -3638 5433 6520 10690 9702 5452 1310 1735 -4017 -7312 -465 -5458 -1738 -2304 5673 1644 6586 3654 9097 4090 2167 -3401 -8543 -2635 -1430 1929 2106 1280 -3625 -1078 -5053 3814 12835 14876 9646 1908 -4381 -9511 -13572 -15741 -16513 -882 3013 3510 6556 1866 6639 3808 9716 3954 5801 1325 721 -2840 -4537 -8751 -5057 -5864 -4358 5717 5601 7609 -136 -5302 -22542 -9238 -8586 -5556 -9189 -3856 9629 10800 14920 14966 12792 4436 -939 -8429 -4331 -6490 -1729 -1341 4298 5421 8172 5257 6542 -241 -3062 -230 -2014 3417 -2870 -4130 -9615 -6072 -9117 -1622 -3137 2660 3674 785 2319 2981 7204 SS 20241027T084314.7Z 9066.363364 209 1 3.14 2 72.50 115.95 20.54 148.71 0.00 1 0.00 1 0 25 1.147e-01 8.467e-02 5.692e-03 2.649e-03 3.526052e-01 1.293746e-03 5.776255e-03 -6.000000e+00 6.430111e-02 224.94 -2.00 3.19 -2.00 317.45 0.00e+00 5.202250e-03 1.722811e-04 2.509436e-03 -6.000000e+00 2.797145e-03 277.51 -2.00 20.00 -2.00 316.83 0.00e+00 3.282 0.000 302.00 328.00 3 3.6758e+00 3.3575e-03 2.9812e-02 -6.0000e+00 1.5914e-01 2.2133e-01 3.7838e-03 1.6610e-02 -6.0000e+00 1.7294e-01 -5.9389e-01 2.1957e-03 8.2936e-03 -6.0000e+00 1.0285e-01 4.1517e-01 1.0829e-03 2.6070e-03 -6.0000e+00 4.4694e-02 7.3133e-04 -2.2278e-03 7.2037e-05 2.7824e-05 -6.0000e+00 2.9719e-03 1.3275e-02 0.0000e+00 12 9 9 12 33 33 99.67 20.96 1.53 0.01327 -0.00347 181 708 5 5 0 17.210 20.96 15.00 14.54 11.39 1.7 679.09 31139 28377 23454 8352 -10048 -14625 -17342 -6726 -10063 -12757 -24508 -14884 -9739 4305 11796 17877 13866 15460 13187 12187 7754 2650 1782 -4227 -1031 -6530 -8482 -18688 -20003 -23724 -15560 -13433 -9465 -14666 -21408 -21602 -18347 -9659 -4901 1200 476 2999 1340 3375 -533 704 -4423 -3021 -6744 -5530 -3512 -1889 28080 21431 18117 14583 16394 15762 21732 19553 20245 13744 10282 5558 6257 9119 10071 9363 3597 -67 -1776 -1300 -1159 2144 5247 14024 -13646 -12353 13770 4922 -1866 -5970 -7402 -6040 -6183 -7125 -7510 -8228 -6141 -3958 1743 5572 9859 8602 5427 -33 -3338 -8710 9591 -11705 -8933 -4022 -142 -843 -4200 -3993 -5604 -5821 13149 15553 16385 16581 15915 -5208 -4222 -3361 -4605 -6471 -8105 12068 12752 -6091 -3440 -1841 437 2419 6000 2318 -3477 -8530 -11472 -13484 6021 6129 5057 4650 4010 3325 1325 28 -2790 -4103 7217 6870 5617 1979 -2407 -3383 -4178 -1534 -2415 -3005 -6112 -3548 -2529 1117 3171 4764 3881 4313 3765 3491 2223 830 555 -1411 -334 -2205 -2758 -6164 -6298 -7911 -5217 -4792 -3452 -5413 -7620 -7605 -6857 -3850 -2175 556 233 1466 674 1651 -269 348 -2242 -1477 -3367 -2788 -1853 -1043 12040 10175 8980 7556 8317 7829 9868 9076 9800 7767 6586 3946 4278 5552 5733 5415 2455 -49 -1402 -1040 -901 1673 3607 7879 -9344 -8347 7971 3587 -1493 -5470 -7263 -6152 -6780 -8418 -9346 -10517 -7598 -4543 1737 4883 8529 7707 5045 -36 -4305 -12063 12560 -16745 -12458 -4854 -160 -1018 -5677 -5645 -8458 -8492 18581 23206 25574 25833 23820 -8167 -6599 -5001 -7083 -9820 -13408 18545 19364 -9915 -5260 -2873 634 3247 7448 3112 -5394 -13688 -19772 -24073 9848 9588 8430 8002 7012 5885 2346 47 -4602 -7054 SS 20241027T085215.1Z 9066.369619 212 1 14.17 2 70.73 117.32 19.64 154.51 0.00 1 0.00 1 0 49 9.099e-02 5.626e-02 2.951e-03 1.702e-03 2.506290e-01 8.355373e-04 3.057199e-03 -6.000000e+00 5.071053e-02 224.94 -2.00 3.19 -2.00 316.47 0.00e+00 2.394262e-03 9.164467e-05 7.558576e-04 -6.000000e+00 2.218823e-03 277.51 -2.00 20.00 -2.00 315.82 0.00e+00 2.998 0.000 302.00 328.00 3 3.9548e+00 2.1465e-03 2.5079e-02 -6.0000e+00 1.2548e-01 2.9445e-01 2.4216e-03 1.1008e-02 -6.0000e+00 1.3665e-01 -4.2527e-01 1.3877e-03 5.2809e-03 -6.0000e+00 8.1289e-02 1.9115e-01 6.3403e-04 1.6476e-03 -6.0000e+00 3.5078e-02 8.3648e-04 4.5556e-03 4.7749e-05 1.6622e-05 -6.0000e+00 2.3594e-03 5.7781e-02 0.0000e+00 12 9 9 12 32 32 99.87 21.06 0.69 0.05778 0.09201 2802 714 1 5 0 5.030 21.06 15.00 14.57 11.94 1.7 683.06 18739 12926 4807 -15587 -21729 -23292 -15267 -9842 -10108 -16956 -18478 -9228 -1073 11742 12370 15092 11811 15745 11485 11923 5798 5353 4930 5908 5934 905 -6342 -15731 -17617 -16076 -10152 -6944 -5517 -18760 -20596 -17183 -5629 4900 12997 15646 16055 16327 13155 13965 10237 8879 3446 1670 -2032 1762 2224 5535 5379 5156 4379 3640 1988 -1246 -1471 -377 3409 6710 10255 5824 226 -7676 -10052 -7046 254 2849 3674 2232 -514 -3896 -10775 -17055 -21628 -18367 -12818 -6514 -4823 -2632 -2699 750 2486 5866 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