File name: Pandora75s1_EssexMD_20240805_L2Fit_fout2c3d20230525p1-8.txt File generation date: 20250116T080330.3Z 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_20240805_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: 20240805 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 20240805T111525.1Z 8983.469041 69 1 51.89 2 78.81 77.41 89.12 70.05 0.00 1 0.00 1 0 17 4.088e-01 1.428e-02 1.533e-01 4.013e-03 6.296104e-01 2.240160e-03 7.853078e-03 -6.000000e+00 2.501867e-01 232.02 -2.00 3.48 -2.00 320.97 0.00e+00 3.326877e-03 1.051158e-03 5.950852e-03 -6.000000e+00 1.171329e-02 290.96 -2.00 20.00 -2.00 320.25 0.00e+00 4.971 0.002 302.00 328.00 3 3.0858e+00 7.6243e-03 6.6234e-02 -6.0000e+00 6.2506e-01 7.6049e-02 1.0050e-02 5.0300e-02 -6.0000e+00 6.7550e-01 -1.6349e-01 9.0740e-03 2.0537e-02 -6.0000e+00 4.0254e-01 6.0503e-02 4.3599e-03 4.5904e-03 -6.0000e+00 1.6773e-01 8.9524e-05 -3.8748e-04 1.2366e-04 1.0682e-04 -6.0000e+00 1.2933e-02 5.8429e-03 -6.4321e-05 12 9 8 11 8 0 22.50 23.61 1.00 0.00584 0.00293 35 6 1 5 0 1482.570 26.32 19.99 23.61 34.42 4.6 1052.14 -150283 8542 900000 900000 -211904 -90837 900000 -97499 -181157 -155055 -135651 -73528 -41281 900000 -56012 -85328 -26634 -35483 -53257 -79658 68330 70000 13615 -3257 -27938 9200 -46751 -31770 -43802 98018 -8027 -39461 -1891 -14321 3838 -13798 17565 -8040 36178 13128 -1890 24131 7370 12180 -1754 8412 7196 -4491 -1282 14021 541 4468 5282 14630 9873 14358 895 -2245 -299 -533 -1094 7748 4442 4868 6139 -6018 1415 1530 5897 5502 2319 5477 -621 -2069 45 419 565 -2464 -1264 -3635 -1906 -3009 -1458 -1254 -1459 -386 -630 1454 503 854 1100 -1375 -1064 -1800 -2001 -72 911 -589 681 -417 -1714 -2527 -867 -778 -2368 -2209 -1197 129 977 1055 2250 766 -144 -178 -305 933 -566 -142 354 534 1234 1067 1201 541 120 -1581 601 733 359 -605 -310 -801 -1071 -24 21 82 282 891 -74 761 -563 -125 -825 -1549 33 900000 900000 -4897 -614 900000 -832 -3993 -2866 -2218 -732 -404 900000 -1008 -2469 -490 -791 -1541 -3177 641 657 234 -71 -841 201 -1828 -1056 -1644 958 -264 -2099 -79 -728 162 -701 714 -497 1740 945 -179 1906 726 1181 -200 885 785 -569 -165 1661 81 716 923 2529 1904 2763 202 -524 -67 -120 -257 1827 1218 1472 1923 -2116 460 515 2087 2214 1058 2534 -303 -974 19 161 205 -936 -527 -1815 -989 -1794 -939 -864 -1079 -301 -517 1200 418 683 825 -994 -745 -1314 -1626 -66 874 -649 795 -492 -1935 -2638 -910 -823 -2472 -2444 -1394 160 1314 1451 3340 1210 -229 -274 -449 1314 -818 -214 559 870 1986 1673 1818 793 184 -2384 875 1123 566 -1073 -596 -1536 -2173 -51 48 182 641 2042 -170 1665 -1268 -267 -1751 SS 20240805T112111.8Z 8983.473053 72 1 51.31 2 77.72 78.28 88.12 70.94 0.00 1 0.00 1 0 17 3.316e-01 1.090e-02 1.165e-01 2.661e-03 5.852213e-01 1.450126e-03 7.151075e-03 -6.000000e+00 2.014660e-01 232.02 -2.00 3.48 -2.00 320.58 0.00e+00 3.304311e-03 5.971149e-04 4.071293e-03 -6.000000e+00 9.107477e-03 290.96 -2.00 20.00 -2.00 319.83 0.00e+00 4.563 0.002 302.00 328.00 3 2.8369e+00 4.6539e-03 5.7943e-02 -6.0000e+00 5.0364e-01 3.8035e-02 5.9247e-03 3.9097e-02 -6.0000e+00 5.4404e-01 -9.8987e-02 5.1018e-03 1.7803e-02 -6.0000e+00 3.2492e-01 3.0825e-02 2.5137e-03 4.1613e-03 -6.0000e+00 1.3508e-01 1.7705e-04 -2.7743e-04 8.1020e-05 9.2902e-05 -6.0000e+00 1.0277e-02 5.8693e-03 -7.3832e-06 12 8 8 10 0 0 7.82 23.61 0.84 0.00587 0.00378 53 9 1 5 0 967.940 26.32 20.01 23.61 34.84 4.6 1055.14 -169490 -114295 34501 -3551 -158850 -107777 5785 -130278 -96259 -116948 -96606 -67585 -49337 -15452 -27166 -48157 -31536 -24228 -36823 -42403 2986 17839 1059 -27918 -18844 5642 -31993 -24750 -20763 -5249 -17839 -20804 4682 -12584 -6687 -10268 -4040 -466 4802 2328 -1768 13069 3757 6043 518 4633 1092 -2772 269 2468 3218 2376 4020 9409 7016 5624 2182 -925 -814 177 -1125 4454 2241 4481 2251 -2105 1068 1283 2827 3644 1762 2874 1332 -763 678 -1938 -1465 -1667 -2680 -2860 -2018 -2685 -1390 -824 -1371 208 179 1280 495 981 233 -401 -857 -1412 -1277 -102 742 -115 489 -421 -1406 -1870 -1143 -977 -2117 -1656 -1060 43 327 1337 1614 460 433 -282 -290 -42 96 9 210 635 617 877 874 503 464 -677 81 241 281 -83 -427 -265 -706 -207 -117 -19 322 614 -2 255 -218 -453 -507 -3118 -1429 106 -16 -3185 -1271 26 -2274 -1474 -2397 -1730 -1017 -755 -212 -522 -1362 -859 -679 -1271 -1639 76 398 29 -1101 -729 180 -1519 -1079 -867 -200 -889 -1252 249 -852 -425 -682 -276 -36 426 251 -225 1550 516 837 77 679 169 -460 45 432 614 507 924 2219 1799 1524 628 -275 -238 51 -342 1402 808 1582 849 -820 398 492 1168 1687 913 1542 722 -403 325 -868 -613 -706 -1264 -1572 -1274 -1932 -991 -625 -1119 178 161 1171 456 868 195 -317 -657 -1117 -1113 -101 768 -135 613 -531 -1693 -2078 -1284 -1021 -2375 -1962 -1324 57 437 1956 2559 719 722 -455 -445 -62 143 14 345 1077 1046 1445 1394 775 686 -976 114 355 458 -139 -786 -517 -1364 -421 -254 -40 705 1359 -3 577 -470 -937 -1034 SS 20240805T112627.4Z 8983.476706 75 1 51.33 2 76.72 79.07 87.19 71.75 0.00 1 0.00 1 0 17 2.555e-01 9.406e-03 4.715e-02 1.906e-03 5.515243e-01 1.027908e-03 6.470146e-03 -6.000000e+00 1.552626e-01 232.02 -2.00 3.48 -2.00 320.22 0.00e+00 1.714045e-03 3.773315e-04 2.671650e-03 -6.000000e+00 7.018159e-03 290.96 -2.00 20.00 -2.00 319.45 0.00e+00 4.244 0.001 302.00 328.00 3 2.6154e+00 3.1369e-03 5.2573e-02 -6.0000e+00 3.8814e-01 4.0735e-03 3.8821e-03 3.2637e-02 -6.0000e+00 4.1926e-01 -6.0328e-02 3.2401e-03 1.5087e-02 -6.0000e+00 2.5040e-01 1.6802e-02 1.6341e-03 3.7769e-03 -6.0000e+00 1.0411e-01 3.1246e-04 -1.7005e-04 5.8394e-05 6.2594e-05 -6.0000e+00 7.9192e-03 5.4134e-03 4.7639e-06 12 9 8 11 8 0 28.60 23.61 0.78 0.00541 0.00414 78 13 1 5 0 658.020 26.32 20.00 23.61 35.18 4.6 1057.51 -115699 -77562 -8429 -37531 -110426 -86634 -75186 -77104 -109432 -86997 -62603 -63354 -36237 -42781 -19280 -35017 -15982 -20813 -23649 -30947 3898 3183 -13264 -7056 -9782 -3788 -21549 -14523 -18748 -2038 -9239 -13050 1546 -7946 -4793 -9854 -6602 -3975 3261 -385 987 4248 2710 4487 353 4625 2346 -1258 234 2929 -69 2406 2075 5789 3262 3974 1374 -357 285 322 1323 3032 3712 3000 2398 -1186 763 566 862 2287 1089 1987 705 31 598 -574 -1636 -2048 -1627 -2927 -1364 -2510 -1491 -1667 -786 -269 790 1490 778 894 323 -495 -649 -1219 -1300 -2 643 330 144 -194 -1135 -1972 -1202 -1149 -1357 -1416 -726 -297 301 1024 1174 627 364 29 -556 -54 10 328 507 200 641 656 742 738 333 -360 -145 289 365 -96 -307 -336 -445 -174 8 -29 341 500 -72 294 -273 -400 -678 -1760 -944 -56 -363 -2094 -1272 -1048 -1233 -2726 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