File name: Pandora75s1_EssexMD_20240726_L2Fit_fout2c3d20230525p1-8.txt File generation date: 20250116T080246.8Z 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_20240726_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: 20240726 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 20240726T133013.4Z 8973.562655 306 1 2.52 2 51.55 96.11 63.17 253.46 0.00 1 0.00 1 0 17 1.192e-02 8.352e-03 5.640e-03 3.206e-03 2.295508e-01 1.721191e-03 2.677071e-03 -6.000000e+00 7.259506e-03 232.37 -2.00 3.48 -2.00 315.74 0.00e+00 9.208038e-04 1.761233e-04 1.253644e-04 -6.000000e+00 3.272145e-04 290.74 -2.00 20.00 -2.00 314.94 0.00e+00 1.604 0.000 302.00 328.00 3 3.5880e+00 4.4789e-03 1.9992e-02 -6.0000e+00 1.8166e-02 3.2836e-02 4.9814e-03 1.1738e-02 -6.0000e+00 1.9610e-02 -6.7597e-03 2.8399e-03 5.6379e-03 -6.0000e+00 1.1707e-02 -5.2750e-03 1.2515e-03 1.5808e-03 -6.0000e+00 4.8699e-03 2.2181e-03 7.4925e-04 1.0118e-04 2.1583e-05 -6.0000e+00 3.6940e-04 -2.7981e-03 1.0137e-05 12 9 1 12 1 1 -582014.81 23.70 0.46 -0.00280 0.00283 3 13 1 5 0 629.000 26.41 20.00 23.70 31.38 4.6 1033.85 562 1142 804 962 -4207 -2756 -4067 -1905 -2677 70 -3303 -1618 20 477 1236 242 904 -405 30 650 1514 1003 2027 1387 1794 1461 -905 -471 -84 -167 873 526 405 -1646 -3241 -2549 -1895 -2238 30 -1339 -487 -485 -499 -169 -548 621 99 73 -156 -321 263 1406 286 1683 798 1163 1161 -146 94 844 2157 1543 2126 1757 564 -641 -579 -49 406 1421 367 1347 102 458 -393 -495 -1039 -1633 -2263 -1515 -1697 -1715 -2045 -1526 -623 -458 -332 830 455 652 320 -244 -329 -370 -112 -31 336 323 17 -162 -996 -1735 -565 -492 -1085 -641 -614 -341 294 668 1098 778 244 -28 57 -65 -84 163 1087 183 362 257 789 517 1030 408 44 -82 5 215 99 -660 51 22 -25 440 583 238 272 -86 -810 -977 -948 134 272 197 225 -1032 -630 -966 -484 -688 19 -910 -448 6 159 424 92 360 -169 12 266 625 417 847 606 814 686 -433 -215 -36 -75 372 240 196 -834 -1612 -1240 -980 -1243 18 -886 -351 -347 -368 -126 -409 455 72 55 -114 -235 188 1054 229 1317 650 962 972 -124 78 698 1813 1320 1941 1690 520 -589 -522 -43 352 1349 365 1388 102 461 -372 -448 -905 -1362 -1962 -1366 -1625 -1802 -2200 -1650 -712 -535 -407 1038 548 787 375 -276 -343 -391 -118 -34 389 409 22 -205 -1249 -2044 -660 -590 -1341 -801 -805 -449 404 928 1582 1128 342 -39 74 -84 -108 209 1473 255 515 363 1081 708 1331 526 55 -103 7 288 134 -923 73 32 -38 663 904 378 432 -135 -1231 -1444 -1436 SS 20240726T134201.6Z 8973.570851 315 1 6.71 2 49.29 98.21 65.28 255.61 0.00 1 0.00 1 0 17 1.125e-02 8.229e-03 4.963e-03 2.834e-03 2.222138e-01 1.521682e-03 2.599208e-03 -6.000000e+00 6.847888e-03 232.36 -2.00 3.48 -2.00 315.70 0.00e+00 7.257220e-04 1.539450e-04 1.205807e-04 -6.000000e+00 3.088255e-04 290.74 -2.00 20.00 -2.00 314.91 0.00e+00 1.530 0.000 302.00 328.00 3 4.4251e+00 3.9588e-03 1.9177e-02 -6.0000e+00 1.7135e-02 3.9511e-02 4.4028e-03 1.1356e-02 -6.0000e+00 1.8504e-02 -7.0019e-03 2.5100e-03 5.4695e-03 -6.0000e+00 1.1046e-02 -4.1374e-03 1.1037e-03 1.5002e-03 -6.0000e+00 4.5893e-03 1.0437e-03 -8.0084e-05 8.9333e-05 2.0876e-05 -6.0000e+00 3.4882e-04 5.1648e-03 3.7021e-05 12 9 1 12 1 1 96.41 23.70 0.47 0.00516 0.00456 4 6 1 5 0 1340.220 26.41 20.00 23.70 31.86 4.6 1037.11 -873 1685 703 -739 -3406 -3493 -458 -704 -420 -4223 -2430 32 -488 -1462 362 -479 -839 951 704 125 1437 1830 1289 110 1307 1846 -1246 -314 -434 15 1252 -162 1522 -2263 -2128 -2956 -1696 -1763 417 684 -863 198 93 -904 248 -66 123 165 -235 543 254 687 1050 1017 1056 1020 823 504 -171 -22 441 2212 1399 2066 945 -848 -826 -325 173 1266 1128 1183 533 467 157 -666 -1344 -1565 -1814 -1572 -1781 -2170 -2230 -1754 -1331 -601 167 290 431 818 384 -270 -219 -216 -321 310 98 279 555 -209 -1036 -1196 -1005 -678 -769 -883 -333 -77 402 773 896 874 180 -203 277 53 195 211 740 166 847 195 496 346 660 59 -43 1050 372 64 -45 -665 -328 70 -39 414 260 152 262 -33 -435 -791 -1174 -206 423 183 -186 -801 -777 -101 -170 -111 -1223 -697 9 -139 -474 129 -189 -322 371 284 52 603 766 550 49 604 874 -606 -144 -188 6 534 -75 729 -1151 -1043 -1438 -872 -965 246 464 -612 146 71 -701 190 -50 91 119 -167 383 187 531 803 814 871 857 701 429 -145 -19 382 1892 1293 1989 913 -781 -751 -286 150 1200 1103 1210 550 466 155 -600 -1175 -1305 -1565 -1407 -1776 -2256 -2355 -1946 -1494 -714 207 354 524 1001 438 -297 -235 -223 -346 344 115 340 707 -264 -1308 -1411 -1196 -788 -955 -1109 -436 -105 548 1108 1278 1249 260 -274 360 68 249 269 1000 229 1185 272 674 471 851 77 -54 1302 488 86 -62 -914 -459 102 -57 631 393 235 404 -52 -667 -1181 -1739 SS 20240726T140714.3Z 8973.588360 328 1 51.44 2 44.50 103.06 69.84 260.01 0.00 1 0.00 1 0 17 1.707e-02 9.955e-03 4.704e-03 2.402e-03 2.041820e-01 1.278645e-03 2.371688e-03 -6.000000e+00 1.039097e-02 232.36 -2.00 3.48 -2.00 316.12 0.00e+00 1.058924e-03 1.429318e-04 1.486591e-04 -6.000000e+00 4.685163e-04 290.74 -2.00 20.00 -2.00 315.29 0.00e+00 1.400 0.000 302.00 328.00 3 6.1965e+00 3.3465e-03 1.7564e-02 -6.0000e+00 2.6001e-02 5.6778e-02 3.7326e-03 1.0436e-02 -6.0000e+00 2.8075e-02 -2.1360e-03 2.1333e-03 5.0132e-03 -6.0000e+00 1.6760e-02 -5.6865e-03 9.5498e-04 1.4340e-03 -6.0000e+00 6.9660e-03 2.0647e-04 3.3600e-04 7.5969e-05 1.8057e-05 -6.0000e+00 5.2911e-04 3.1322e-03 5.0467e-05 12 9 8 11 40 0 99.98 23.70 0.49 0.00313 0.00566 18 3 1 5 0 2857.370 26.41 19.99 23.70 33.51 4.5 1046.85 -2661 837 4960 343 -7184 -2484 -494 -44 -7159 530 -3319 -3312 -2745 5168 482 -3078 -846 1048 1038 -8 3901 3934 568 1292 594 1611 -654 -2189 -1922 2308 -1017 -2243 -4 -1780 -2239 -2562 -2076 -1908 139 290 -782 737 233 590 -151 122 50 -390 -709 262 863 212 1288 2276 1928 2028 63 149 89 -346 467 2775 1825 2078 538 -2374 -1124 -581 883 885 766 1583 312 -93 87 -552 -1805 -1889 -2152 -2619 -1791 -2684 -1893 -1275 -900 -351 141 998 940 1183 291 -514 -521 -769 -646 198 393 387 431 276 -681 -1398 -1143 -1253 -1312 -1102 -376 270 268 1180 1801 924 98 106 -391 775 -340 -86 499 233 490 406 948 482 136 -92 -28 915 121 -125 -376 -506 -497 -141 158 229 47 498 -199 338 -170 -746 -895 -557 184 1069 74 -1513 -470 -94 -9 -1726 124 -812 -823 -732 1427 156 -1023 -288 361 369 -3 1405 1415 214 500 240 663 -274 -885 -800 894 -418 -988 -2 -764 -930 -1154 -904 -949 80 191 -522 509 166 423 -109 87 35 -265 -472 187 583 152 962 1756 1535 1640 52 124 73 -285 392 2423 1723 1887 491 -2256 -980 -489 766 847 737 1578 316 -91 86 -499 -1502 -1492 -1753 -2356 -1773 -2706 -2020 -1426 -1069 -411 172 1249 1176 1422 352 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