File name: Pandora75s1_EssexMD_20260215_L2Fit_fout2c3d20230525p1-8.txt File generation date: 20260216T052420.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 75 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora75_OF_v3d20220127.txt Instrument calibration file used: Pandora75s1_CF_v3d20230525.txt Level 1 file used: Pandora75s1_EssexMD_20260215_L1_smca1c3d20230525p1-8.txt Full location name: MDE Essex Monitoring Site Short location name: EssexMD Country of location: United States Location latitude [deg]: 39.3109 Location longitude [deg]: -76.4745 Location altitude [m]: 12 Local noon date: 20260215 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: OoB session based on session 2 First and last pixel inside fitting window: 196 338 Nominal wavelengths inside fitting window [nm]: 305.0305 305.1717 305.3128 305.4540 305.5951 305.7363 305.8774 306.0185 306.1596 306.3007 306.4418 306.5828 306.7239 306.8649 307.0060 307.1470 307.2880 307.4290 307.5700 307.7110 307.8519 307.9929 308.1338 308.2747 308.4157 308.5566 308.6975 308.8384 308.9792 309.1201 309.2610 309.4018 309.5426 309.6834 309.8243 309.9651 310.1058 310.2466 310.3874 310.5281 310.6689 310.8096 310.9503 311.0910 311.2317 311.3724 311.5131 311.6537 311.7944 311.9350 312.0757 312.2163 312.3569 312.4975 312.6381 312.7786 312.9192 313.0598 313.2003 313.3408 313.4813 313.6218 313.7623 313.9028 314.0433 314.1838 314.3242 314.4646 314.6051 314.7455 314.8859 315.0263 315.1667 315.3070 315.4474 315.5877 315.7281 315.8684 316.0087 316.1490 316.2893 316.4296 316.5699 316.7101 316.8504 316.9906 317.1308 317.2710 317.4112 317.5514 317.6916 317.8318 317.9719 318.1121 318.2522 318.3923 318.5324 318.6725 318.8126 318.9527 319.0927 319.2328 319.3728 319.5129 319.6529 319.7929 319.9329 320.0729 320.2128 320.3528 320.4927 320.6327 320.7726 320.9125 321.0524 321.1923 321.3322 321.4721 321.6119 321.7518 321.8916 322.0314 322.1712 322.3110 322.4508 322.5906 322.7304 322.8701 323.0099 323.1496 323.2893 323.4290 323.5687 323.7084 323.8481 323.9877 324.1274 324.2670 324.4067 324.5463 324.6859 324.8255 324.9650 --------------------------------------------------------------------------------------- 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 20260215T143741.7Z 9542.609510 127 1 51.60 2 64.14 135.12 64.73 160.44 0.00 1 0.00 1 0 17 6.092e-02 9.742e-03 1.412e-02 2.249e-03 3.675038e-01 1.161175e-03 4.280142e-03 -6.000000e+00 3.601491e-02 225.01 -2.00 3.48 -2.00 318.31 0.00e+00 1.881977e-03 2.235575e-04 5.609823e-04 -6.000000e+00 1.576390e-03 276.60 -2.00 20.00 -2.00 317.69 0.00e+00 2.279 0.000 302.00 328.00 3 5.1344e+00 3.1123e-03 2.9248e-02 -6.0000e+00 8.8971e-02 1.0146e-02 3.5345e-03 1.8286e-02 -6.0000e+00 9.6895e-02 -9.1516e-03 2.3402e-03 9.2895e-03 -6.0000e+00 5.7685e-02 -1.9357e-03 1.2040e-03 3.0311e-03 -6.0000e+00 2.3937e-02 1.9995e-04 -1.2543e-04 7.0923e-05 3.4926e-05 -6.0000e+00 1.8840e-03 1.5366e-02 2.9151e-06 12 9 8 11 32 0 97.42 22.98 0.75 0.01537 0.01442 16 3 1 5 0 3224.860 25.79 19.99 22.98 12.98 7.7 928.42 -54007 1672 20370 6246 -7027 -17146 12282 -6238 -16086 -5076 -13654 -6843 3823 13355 679 -6335 602 498 2163 -4913 4092 3918 1845 -744 -3380 -1850 1400 -6853 -5472 6606 -2860 -7 387 -3647 -468 -1371 -2520 -5849 -536 1939 -1148 2256 1478 860 -537 972 -226 -267 42 1147 -148 873 1519 2230 1624 1417 272 -579 -1295 99 1494 3775 2492 1437 1214 -117 -634 -280 2196 1236 -186 1691 236 391 -835 -793 -1781 -1087 -1765 -2671 -1328 -2199 -1851 -1597 -1103 -240 -1 789 350 1347 207 470 -883 -662 -979 351 656 323 521 22 -1140 -1666 -504 -752 -1117 -1461 -749 279 541 1039 1053 455 316 -435 -243 254 -47 -34 688 174 774 506 1087 515 378 -605 -9 818 310 -144 -768 -570 -157 -144 243 -155 494 666 151 186 -449 -594 -1077 -4027 80 849 290 -345 -899 501 -338 -1062 -319 -967 -483 278 1046 71 -802 77 68 306 -776 604 583 288 -126 -618 -346 254 -1306 -992 1078 -556 -1 88 -897 -109 -321 -648 -1639 -170 696 -470 949 650 387 -247 443 -104 -122 19 534 -75 429 794 1226 935 839 165 -354 -786 59 913 2431 1774 1018 870 -81 -458 -201 1651 966 -161 1489 209 331 -664 -619 -1298 -771 -1344 -2138 -1184 -2035 -1837 -1675 -1229 -263 -1 922 409 1496 232 485 -868 -648 -1029 405 791 404 683 29 -1502 -2043 -583 -893 -1419 -1969 -989 385 795 1532 1640 724 488 -638 -353 351 -65 -50 1050 263 1172 754 1662 758 531 -822 -12 1096 448 -226 -1205 -927 -263 -239 423 -282 919 1256 284 339 -793 -1012 -1827 SS 20260215T144322.6Z 9542.613456 130 1 52.97 2 63.38 136.41 64.37 161.80 0.00 1 0.00 1 0 17 5.681e-02 9.627e-03 1.133e-02 2.079e-03 3.571592e-01 1.071155e-03 4.169902e-03 -6.000000e+00 3.358256e-02 225.01 -2.00 3.48 -2.00 318.16 0.00e+00 1.725475e-03 1.965775e-04 4.911244e-04 -6.000000e+00 1.469947e-03 276.60 -2.00 20.00 -2.00 317.53 0.00e+00 2.219 0.000 302.00 328.00 3 5.0935e+00 2.8653e-03 2.8455e-02 -6.0000e+00 8.2962e-02 9.7195e-03 3.2516e-03 1.7773e-02 -6.0000e+00 9.0352e-02 -1.2313e-02 2.1006e-03 8.9822e-03 -6.0000e+00 5.3790e-02 -4.3103e-04 1.0705e-03 2.8745e-03 -6.0000e+00 2.2320e-02 2.2457e-04 -4.1594e-05 6.5786e-05 3.4265e-05 -6.0000e+00 1.7568e-03 1.5365e-02 -4.3541e-07 12 9 8 11 32 0 95.19 22.98 0.63 0.01537 0.01505 19 3 1 5 0 2787.750 25.90 20.00 22.98 13.16 7.7 929.28 -46835 -10490 10985 4507 -23651 -13746 5104 -12929 -17824 -2715 -6501 -7458 2865 14650 1160 -6026 -2610 -1823 3031 -2268 3225 2886 432 671 -2840 -3459 -1797 -5394 -3541 7306 309 -2016 2230 -4072 -1239 -2395 -2081 1037 824 1245 -990 1179 1179 1013 -595 1633 -264 -191 405 487 936 1207 1722 2656 1472 1720 -52 -600 6 -908 1705 3163 2246 1433 995 -114 -297 158 922 1187 332 1350 85 36 -705 -1231 -1478 -2101 -2346 -3141 -1636 -2168 -1992 -1200 -1121 -500 516 1114 568 1743 -137 43 -805 -1009 -941 25 665 309 618 -108 -1243 -1495 -866 -825 -1260 -1094 -529 312 439 924 1098 568 327 -282 -337 596 -147 141 753 223 764 479 907 424 275 -527 523 607 380 -112 -455 -639 -203 -72 -37 87 389 445 68 188 -367 -720 -840 -3694 -644 568 240 -1544 -783 251 -841 -1344 -187 -480 -591 234 1254 133 -836 -378 -278 464 -380 523 473 74 121 -561 -714 -366 -1097 -681 1276 62 -461 532 -1073 -309 -603 -567 289 273 478 -430 531 550 482 -290 780 -128 -92 194 240 447 619 938 1517 885 1058 -33 -382 4 -571 1082 2132 1537 1053 739 -82 -204 117 668 955 292 1227 78 32 -577 -917 -1105 -1547 -1702 -2588 -1498 -2051 -2022 -1281 -1191 -562 602 1326 677 1970 -147 45 -806 -1009 -1006 28 813 392 820 -142 -1556 -1853 -1020 -995 -1628 -1399 -708 437 616 1382 1729 911 511 -417 -494 826 -206 205 1090 339 1167 722 1320 631 391 -722 689 821 552 -166 -715 -1043 -342 -120 -65 159 689 800 121 345 -651 -1235 -1428 SS 20260215T144844.9Z 9542.617186 133 1 51.96 2 62.67 137.64 64.05 163.10 0.00 1 0.00 1 0 17 4.880e-02 9.019e-03 1.005e-02 1.961e-03 3.492494e-01 1.008492e-03 4.090470e-03 -6.000000e+00 2.883944e-02 225.01 -2.00 3.48 -2.00 318.08 0.00e+00 1.818375e-03 1.804434e-04 4.029803e-04 -6.000000e+00 1.262640e-03 276.60 -2.00 20.00 -2.00 317.45 0.00e+00 2.166 0.000 302.00 328.00 3 5.0340e+00 2.6899e-03 2.7812e-02 -6.0000e+00 7.1244e-02 6.4573e-03 3.0493e-03 1.7417e-02 -6.0000e+00 7.7596e-02 -5.9818e-03 1.9540e-03 8.7634e-03 -6.0000e+00 4.6194e-02 -3.9569e-03 9.9164e-04 2.8235e-03 -6.0000e+00 1.9165e-02 2.5348e-04 -2.3418e-04 6.2099e-05 3.3502e-05 -6.0000e+00 1.5091e-03 1.5402e-02 -5.3537e-05 11 9 0 11 32 0 84.91 22.99 0.67 0.01540 0.01364 21 3 1 5 0 2473.850 25.90 20.00 22.99 13.27 7.7 930.00 -41253 -7818 15860 -1362 -14506 -13348 -1258 -13007 -14559 -3301 -5863 228 -975 13005 -483 -1887 -422 166 1927 -471 2017 3203 1566 -374 -1108 -1651 -4224 -3531 50 1978 1510 -237 2884 -3063 -2061 -1586 -3135 -5937 170 1105 -610 1753 1788 -248 161 773 789 -809 -496 -475 629 1149 1912 1504 1054 1199 -170 -612 -635 467 1271 2470 1762 1657 1277 -324 -23 -228 1573 1469 628 1985 152 48 -256 -1183 -1816 -1431 -2233 -2570 -1536 -2220 -2151 -1381 -746 -160 385 407 547 915 725 306 -727 -936 -369 322 418 143 664 -129 -941 -1620 -688 -977 -1186 -1328 -585 259 552 967 1250 406 246 -438 -209 81 -137 275 753 49 165 507 878 508 458 -251 169 649 568 105 -405 -390 -347 -139 -33 8 624 448 100 -3 -338 -632 -901 -3329 -505 843 -83 -932 -817 -71 -913 -1144 -246 -462 18 -89 1211 -60 -268 -64 26 318 -83 353 557 284 -73 -229 -355 -934 -747 10 386 319 -56 721 -765 -546 -417 -826 -1866 60 447 -277 824 798 -115 75 359 364 -376 -230 -226 315 615 1084 906 663 772 -112 -405 -415 302 844 1612 1261 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