File name: Pandora159s1_Wakkerstroom_20200703_L2Fit_fout2c6d20191220p1-8.txt File generation date: 20240926T160113.4Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 Local principal investigator: B. Scholes Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 159 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora159_OF_v5d20191004.txt Instrument calibration file used: Pandora159s1_CF_v6d20191220.txt Level 1 file used: Pandora159s1_Wakkerstroom_20200703_L1_smca1c6d20191220p1-8.txt Full location name: Global Change Institute, University of Witwatersrand field site in Wakkerstroom Short location name: Wakkerstroom Country of location: South Africa Location latitude [deg]: -27.3493 Location longitude [deg]: 30.1438 Location altitude [m]: 1760 Local noon date: 20200703 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: Update session 4 based on session2 for SO2 First and last pixel inside fitting window: 222 364 Nominal wavelengths inside fitting window [nm]: 305.0490 305.1898 305.3306 305.4713 305.6121 305.7529 305.8936 306.0343 306.1750 306.3157 306.4564 306.5971 306.7378 306.8785 307.0191 307.1597 307.3004 307.4410 307.5816 307.7222 307.8628 308.0033 308.1439 308.2845 308.4250 308.5655 308.7060 308.8465 308.9870 309.1275 309.2680 309.4084 309.5489 309.6893 309.8297 309.9701 310.1105 310.2509 310.3913 310.5317 310.6720 310.8124 310.9527 311.0930 311.2333 311.3736 311.5139 311.6542 311.7944 311.9347 312.0749 312.2152 312.3554 312.4956 312.6358 312.7760 312.9161 313.0563 313.1964 313.3366 313.4767 313.6168 313.7569 313.8970 314.0371 314.1771 314.3172 314.4572 314.5973 314.7373 314.8773 315.0173 315.1573 315.2973 315.4372 315.5772 315.7171 315.8570 315.9969 316.1369 316.2767 316.4166 316.5565 316.6964 316.8362 316.9760 317.1159 317.2557 317.3955 317.5352 317.6750 317.8148 317.9545 318.0943 318.2340 318.3737 318.5134 318.6531 318.7928 318.9325 319.0721 319.2118 319.3514 319.4910 319.6307 319.7703 319.9098 320.0494 320.1890 320.3285 320.4681 320.6076 320.7471 320.8866 321.0261 321.1656 321.3051 321.4445 321.5840 321.7234 321.8628 322.0023 322.1417 322.2810 322.4204 322.5598 322.6991 322.8385 322.9778 323.1171 323.2564 323.3957 323.5350 323.6743 323.8135 323.9528 324.0920 324.2312 324.3704 324.5096 324.6488 324.7880 324.9272 --------------------------------------------------------------------------------------- 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 --------------------------------------------------------------------------------------- SU 20200703T051810.7Z 7489.220958 6 1 49.49 2 85.29 61.15 116.07 225.55 0.00 1 0.00 1 0 25 6.185e-01 5.622e-02 5.387e-01 5.439e-02 9.215513e-01 3.154530e-02 9.463157e-03 -6.000000e+00 3.575502e-01 225.16 -2.00 3.06 -2.00 322.10 0.00e+00 9.188378e-03 1.421527e-02 3.944638e-03 -6.000000e+00 1.755883e-02 276.97 -2.00 20.00 -2.00 321.64 0.00e+00 10.315 0.007 302.00 328.00 3 1.1600e+00 1.1139e-01 9.4612e-02 -6.0000e+00 8.8723e-01 1.6276e+00 1.2843e-01 4.4016e-02 -6.0000e+00 9.6895e-01 -1.9357e+00 8.2171e-02 2.1918e-02 -6.0000e+00 5.7383e-01 7.5801e-01 4.4754e-02 7.3981e-03 -6.0000e+00 2.4567e-01 1.2869e-05 -1.3163e-03 1.4885e-03 1.6246e-04 -6.0000e+00 1.7337e-02 1.1031e-03 0.0000e+00 12 8 8 10 0 0 20.06 15.59 0.52 0.00110 -0.00879 18 4 4 8 0 2714.240 15.05 15.59 -1.88 18.73 18.73 11.9 811.92 -20334 93937 900000 74830 323909 -114264 -51560 3533 900000 -35230 15928 900000 900000 -40914 900000 126582 34340 165534 26186 900000 -5190 900000 -2548 203004 -4730 900000 100363 155616 -11636 -25490 900000 40675 109928 -27276 900000 -66151 98061 -65569 900000 -44646 32134 147549 42541 36694 -21304 900000 -15171 55038 51457 142383 125691 93920 35094 61440 65989 -21866 31973 32316 214794 -67831 157619 -3637 -12378 22248 3983 4400 -5150 27200 22734 35520 21596 43135 -12348 9606 -11308 29542 21876 54894 -10224 29014 23767 1011 18235 -20071 11254 -7389 15907 -10910 3193 -7348 8617 -996 4301 11134 3272 8475 -6092 9060 -6220 6612 -5720 295 5498 -2974 -5622 -11202 -9699 -15975 4210 1960 3971 362 1636 -2558 6032 -4117 7373 -2179 789 1003 -2127 6242 -2735 726 1657 3676 6 8755 1712 1253 -344 -578 -4622 1201 2212 -3337 281 -216 1700 -1510 3573 -1082 -1118 -1768 4970 900000 3960 17139 -14879 -3352 187 900000 -1864 843 900000 900000 -3206 900000 6698 1936 8759 1638 900000 -390 900000 -156 10742 -283 900000 5311 8234 -616 -1529 900000 2152 5817 -2710 900000 -7910 5189 -8576 900000 -6136 2270 7807 2829 2545 -2503 900000 -1655 3124 3144 7534 6651 4970 3381 4854 5158 -3994 3452 3343 11365 -16058 8340 -497 -2084 3067 704 771 -981 3911 3722 5849 4419 7369 -3473 2020 -2577 4019 2957 5594 -2220 5224 5346 327 5512 -9308 4050 -3356 6015 -5469 1384 -3400 3198 -382 1536 3942 1433 4204 -4131 6201 -5521 5326 -4922 214 3372 -1913 -3946 -8844 -7971 -15092 3668 2023 4617 479 2224 -3626 7585 -5548 8958 -3056 1138 1489 -3205 8212 -3746 938 2060 4373 7 10096 2457 2122 -673 -1234 -11004 2901 5667 -9544 791 -616 4749 -4164 8668 -2530 -2462 SU 20200703T053213.6Z 7489.230713 9 1 49.27 2 82.58 59.37 118.13 222.92 0.00 1 0.00 1 0 25 5.136e-01 8.194e-03 3.003e-01 5.092e-03 7.357522e-01 2.792280e-03 7.127886e-03 -6.000000e+00 2.929617e-01 225.16 -2.00 3.06 -2.00 321.69 0.00e+00 4.967474e-03 1.473855e-03 3.609647e-03 -6.000000e+00 1.290284e-02 276.97 -2.00 20.00 -2.00 321.23 0.00e+00 7.190 0.002 302.00 328.00 3 8.9815e-01 9.9269e-03 7.1425e-02 -6.0000e+00 7.2692e-01 1.4433e-01 1.5077e-02 4.8001e-02 -6.0000e+00 7.9216e-01 -1.8267e-01 1.7048e-02 2.0310e-02 -6.0000e+00 4.6766e-01 6.5102e-02 7.9045e-03 8.8013e-03 -6.0000e+00 1.9932e-01 3.0447e-04 -1.2185e-03 1.4302e-04 7.4624e-05 -6.0000e+00 1.3938e-02 1.2637e-03 0.0000e+00 11 8 0 10 0 0 40.93 16.91 0.31 0.00126 -0.00789 133 29 4 8 0 370.390 15.01 16.91 0.51 19.75 19.75 11.2 823.52 -258899 900000 -219975 -123579 -206553 -182987 900000 -171371 900000 -150275 -128620 -130148 -59727 -50117 106875 -75059 -50558 -70667 11919 4928 -3513 37079 -69163 -1836 -43248 -34071 -72035 19464 -68710 66573 -18191 9341 -30350 -5066 -7054 -23282 6506 -13387 31473 -7480 6010 -1818 1018 -34 -3206 -3678 -3596 -1368 -2251 890 -3020 5297 4429 9846 870 4525 784 6322 -3941 -542 1009 1370 8221 3461 8326 159 3225 806 4776 -802 1209 1383 1526 5343 -1501 119 937 319 653 2750 -608 908 -2258 -741 -1598 -1073 -507 -939 238 -635 1346 -72 2780 199 1140 469 349 567 -769 -271 -198 36 718 907 -1700 -762 -1745 -690 -1303 -473 -620 -550 -197 -221 597 1091 1259 -158 22 -396 -680 282 355 -23 474 223 918 1558 440 389 177 163 -91 573 -346 -241 -235 186 -273 -506 107 -177 357 -2687 900000 -2084 -613 -1584 -1181 900000 -1191 900000 -1044 -766 -904 -296 -274 530 -857 -527 -1017 83 39 -31 221 -1236 -18 -708 -541 -1560 184 -1569 430 -334 162 -849 -121 -186 -641 158 -429 875 -338 271 -97 56 -2 -195 -232 -235 -92 -163 67 -267 490 460 1062 110 578 108 822 -551 -72 135 201 1298 659 1638 34 661 175 1103 -227 375 451 494 1572 -431 30 219 76 175 865 -235 401 -1144 -395 -914 -652 -323 -621 156 -406 791 -40 1451 110 702 341 298 559 -782 -280 -210 35 610 756 -1556 -735 -1791 -752 -1573 -589 -871 -833 -304 -333 849 1475 1851 -225 33 -628 -1073 422 555 -35 693 315 1243 2161 699 653 331 329 -195 1297 -848 -625 -626 500 -738 -1328 261 -403 773 SU 20200703T053805.9Z 7489.234790 12 1 49.76 2 81.46 58.60 118.95 221.78 0.00 1 0.00 1 0 25 3.259e-01 6.055e-03 2.033e-01 2.780e-03 6.631729e-01 1.498937e-03 6.544111e-03 -6.000000e+00 1.837978e-01 225.16 -2.00 3.06 -2.00 321.39 0.00e+00 4.198593e-03 7.267158e-04 2.787270e-03 -6.000000e+00 8.012537e-03 276.97 -2.00 20.00 -2.00 320.89 0.00e+00 6.363 0.002 302.00 328.00 3 7.3106e-01 5.0771e-03 6.2408e-02 -6.0000e+00 4.5493e-01 5.1114e-02 7.2938e-03 3.9653e-02 -6.0000e+00 4.9513e-01 -4.7272e-02 8.0551e-03 1.7298e-02 -6.0000e+00 2.9456e-01 7.3819e-03 3.8244e-03 7.5864e-03 -6.0000e+00 1.2561e-01 7.3470e-04 -1.0270e-03 7.9074e-05 6.5728e-05 -6.0000e+00 8.6988e-03 1.2070e-03 0.0000e+00 10 0 0 10 0 0 61.96 17.23 0.27 0.00121 -0.00651 221 48 2 8 0 223.120 15.00 17.23 1.52 19.96 19.96 11.3 829.57 81641 -78169 -76143 -128649 -115722 -93231 -140040 -138191 -78592 -112042 -105965 -71678 -51611 -23459 -18103 -34101 -35977 -22097 -5523 -25796 -27188 -29931 -13528 -12039 -39419 -19930 -6877 -4987 -18617 -34356 -8288 7552 -10860 -12254 4672 -8687 -4960 -4524 -2051 -3162 -2147 3126 -2080 -1531 -603 4314 151 -1132 1430 3069 2991 2977 2811 2148 3404 2200 1149 -1184 -222 -1202 2461 661 3157 2693 920 992 2229 1911 1513 1532 -164 -414 -494 374 -744 -220 -556 -229 1279 64 -28 -786 -2099 -1612 -1179 -1389 -249 -81 -70 610 897 1382 957 1616 565 695 684 590 -248 -285 -408 -58 563 830 -1588 -1191 -502 -540 -167 -143 -536 -299 -67 371 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