File name: Pandora75s1_EssexMD_20240730_L2Fit_fout2c3d20230525p1-8.txt File generation date: 20250116T080251.4Z 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 v1.8.70 Instrument operation file used: Pandora75_OF_v3d20220127.txt Instrument calibration file used: Pandora75s1_CF_v3d20230525.txt Level 1 file used: Pandora75s1_EssexMD_20240730_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: 20240730 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 20240730T162741.9Z 8977.685902 423 1 52.01 2 23.16 152.13 44.65 268.94 0.00 1 0.00 1 0 17 1.157e-01 4.502e-02 3.221e-02 1.394e-02 1.277388e-01 7.352353e-03 1.704051e-03 -6.000000e+00 7.028772e-02 232.22 -2.00 3.48 -2.00 316.53 0.00e+00 -1.306227e-03 8.798935e-04 5.461894e-04 -6.000000e+00 3.176654e-03 290.83 -2.00 20.00 -2.00 315.65 0.00e+00 1.087 0.000 302.00 328.00 3 8.9541e+00 1.9287e-02 1.2784e-02 -6.0000e+00 1.7580e-01 -7.1759e-02 2.1523e-02 7.4554e-03 -6.0000e+00 1.8994e-01 7.6913e-02 1.2378e-02 3.1291e-03 -6.0000e+00 1.1343e-01 -2.7977e-02 5.6171e-03 1.8877e-03 -6.0000e+00 4.7018e-02 2.1411e-05 -7.6216e-04 4.4335e-04 2.5620e-05 -6.0000e+00 3.5843e-03 4.8714e-02 1.3618e-03 12 9 8 11 8 0 72.62 23.65 0.04 0.04871 0.04299 13 2 2 5 0 4000.000 26.32 20.01 23.65 35.02 4.5 1056.34 4021 7175 78030 28747 -16774 -4838 25100 7315 -26296 22474 -11576 8729 -19283 49433 -1175 -18237 -4050 -7530 5406 -4971 10819 14063 -4924 -6066 3269 3125 -1110 -8099 -7476 47603 4906 -12528 6309 -3007 12690 1455 -2650 -5079 8657 12714 -5920 10528 6393 5360 -4544 247 2932 -2143 -3447 3515 2494 -861 6497 9504 8471 7385 -3577 -3466 -3744 -5782 776 14821 4578 -3573 2670 -19711 1052 -3815 7288 -1725 -2680 4875 -1877 -2473 -795 3526 -3156 3088 -1326 -8140 -2709 -5693 1422 2322 -1021 -2655 -1098 1896 813 3626 2017 -2792 1261 -226 -1208 5338 1020 -3700 5950 3142 -82 -1729 -740 -5236 -6613 -2121 -4021 3884 923 541 8600 3081 -422 132 1511 3898 -2059 -1467 -2154 3069 3357 995 1038 -793 -3709 -5951 3070 4157 4284 155 923 -5275 -5956 -310 -624 -2945 -2615 3829 -341 2595 603 1541 168 765 1427 7809 4511 -3772 -903 3535 1347 -7505 4193 -3061 1877 -5742 8062 -349 -6895 -1376 -2698 1743 -1824 3462 4379 -1880 -2436 1252 1239 -459 -3422 -2910 10117 1594 -5015 2183 -1163 4045 507 -1022 -2291 4011 6551 -4045 6413 4163 3556 -3312 170 1909 -1411 -2215 2072 1519 -569 4182 6188 5736 5146 -2820 -2732 -2933 -4622 596 11502 3807 -3351 2320 -19873 871 -3178 5626 -1603 -2494 4421 -1839 -2375 -777 3000 -2595 2233 -1013 -7225 -2511 -5927 1468 2505 -1106 -3129 -1345 2331 1013 4243 2451 -3241 1282 -222 -1232 5492 1199 -4948 7537 4031 -103 -2073 -850 -6512 -8943 -2906 -5875 5458 1390 853 12869 4841 -654 188 1949 4625 -2577 -1904 -3016 4346 4891 1481 1509 -1124 -5127 -7983 3605 4826 5165 204 1246 -7715 -8912 -454 -965 -4880 -4454 6245 -582 4226 976 2411 264 SS 20240730T183555.5Z 8977.774948 509 1 16.37 2 27.77 226.63 68.28 286.75 0.00 1 0.00 1 0 17 9.551e-03 7.849e-03 2.182e-04 1.671e-04 1.591889e-01 9.073523e-05 1.889146e-03 -6.000000e+00 5.811356e-03 232.22 -2.00 3.48 -2.00 314.34 0.00e+00 5.289510e-04 7.079012e-06 5.253872e-05 -6.000000e+00 2.622529e-04 290.83 -2.00 20.00 -2.00 313.69 0.00e+00 1.130 0.000 302.00 328.00 3 4.9223e-01 2.3302e-04 1.4011e-02 -6.0000e+00 1.4536e-02 1.1913e-02 2.5739e-04 8.1682e-03 -6.0000e+00 1.5696e-02 -1.7043e-03 1.4727e-04 3.9298e-03 -6.0000e+00 9.3722e-03 -5.7598e-03 6.2031e-05 1.0761e-03 -6.0000e+00 3.8973e-03 9.0564e-02 1.7487e-04 5.2430e-06 1.7203e-05 -6.0000e+00 2.9602e-04 2.6933e-03 6.6335e-05 12 9 1 12 1 1 99.91 23.68 0.48 0.00269 0.00401 878 453 1 5 0 18.550 26.41 20.00 23.68 35.86 4.5 1062.70 771 374 -658 -1836 -2386 -1631 -705 294 291 -1161 -1912 -1542 -688 -138 431 206 179 786 1302 1324 1286 1183 1483 1395 1246 1068 240 -420 -97 368 679 1100 563 -1353 -2953 -2930 -2508 -1436 -341 -556 -818 -508 -359 -218 -108 6 -255 -515 -529 -54 408 758 961 1000 765 838 765 360 280 583 1047 1585 1814 1417 556 -299 -557 -264 576 1145 689 710 695 486 83 -676 -1277 -1596 -1636 -1507 -1793 -1912 -1982 -1692 -842 -445 204 585 472 439 352 -43 -450 -179 -54 77 448 556 144 -288 -865 -1283 -829 -457 -828 -956 -539 -303 374 775 823 625 409 107 -79 -50 108 398 508 402 402 521 538 634 644 341 219 373 341 138 -142 -381 -228 49 84 108 339 243 63 -24 -448 -907 -1032 304 159 -288 -771 -910 -620 -271 121 122 -518 -859 -692 -306 -67 217 112 101 451 719 747 737 677 855 831 771 678 153 -255 -55 210 390 658 335 -832 -1771 -1721 -1564 -958 -250 -428 -690 -427 -309 -189 -93 5 -213 -433 -430 -44 334 649 823 891 672 746 689 324 249 518 953 1521 1777 1394 566 -285 -511 -244 525 1096 693 747 734 499 83 -646 -1161 -1434 -1434 -1380 -1747 -1956 -2161 -1867 -948 -515 247 704 569 528 407 -47 -472 -187 -56 86 507 661 180 -355 -1051 -1466 -945 -535 -1005 -1188 -676 -395 489 1056 1121 850 550 138 -97 -60 129 493 649 530 528 681 710 799 796 415 257 437 416 172 -184 -488 -297 66 115 150 485 355 90 -34 -631 -1251 -1456 SS 20240730T184115.9Z 8977.778657 513 1 51.87 2 28.53 228.78 69.23 287.45 0.00 1 0.00 1 0 17 9.537e-03 7.818e-03 1.168e-04 8.805e-05 1.606560e-01 4.783191e-05 1.902874e-03 -6.000000e+00 5.802933e-03 232.22 -2.00 3.48 -2.00 314.44 0.00e+00 5.384754e-04 3.809615e-06 5.441370e-05 -6.000000e+00 2.618736e-04 290.83 -2.00 20.00 -2.00 313.78 0.00e+00 1.138 0.000 302.00 328.00 3 3.4806e-01 1.2290e-04 1.4116e-02 -6.0000e+00 1.4515e-02 1.1238e-02 1.3571e-04 8.2348e-03 -6.0000e+00 1.5673e-02 -1.7154e-03 7.7678e-05 3.9604e-03 -6.0000e+00 9.3586e-03 -5.9340e-03 3.2827e-05 1.0845e-03 -6.0000e+00 3.8917e-03 1.0348e-01 1.4025e-04 2.7696e-06 1.7184e-05 -6.0000e+00 2.9559e-04 2.6978e-03 6.5368e-05 11 8 0 10 0 0 99.41 23.69 0.47 0.00270 0.00375 3588 584 1 5 0 14.370 26.41 20.00 23.69 36.18 4.6 1065.06 695 295 -716 -1850 -2445 -1685 -767 250 297 -1090 -1954 -1575 -782 -178 452 162 173 703 1263 1326 1273 1154 1499 1370 1270 1090 230 -434 -113 332 636 1213 552 -1301 -2885 -2848 -2417 -1446 -305 -532 -807 -481 -359 -250 -132 25 -294 -483 -467 11 463 815 1010 1024 779 867 769 333 268 584 1086 1574 1821 1386 532 -237 -559 -231 558 1108 666 706 659 484 55 -705 -1323 -1652 -1680 -1540 -1782 -1912 -1994 -1710 -841 -493 171 545 467 436 361 -33 -420 -140 -57 107 459 586 165 -261 -855 -1262 -812 -439 -837 -948 -542 -325 365 766 793 569 383 91 -77 -40 129 414 502 407 399 532 537 611 670 331 238 380 342 121 -151 -397 -233 51 91 109 360 251 62 -22 -455 -897 -1038 278 119 -296 -735 -947 -607 -279 98 127 -461 -833 -671 -352 -82 230 84 93 383 702 754 735 666 870 822 747 658 139 -265 -64 180 348 691 331 -808 -1747 -1690 -1521 -971 -214 -409 -650 -404 -308 -217 -113 21 -244 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