File name: Pandora75s1_EssexMD_20250313_L2Fit_fout2c3d20230525p1-8.txt File generation date: 20250314T052008.0Z 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 v1.8.74 Instrument operation file used: Pandora75_OF_v3d20220127.txt Instrument calibration file used: Pandora75s1_CF_v3d20230525.txt Level 1 file used: Pandora75s1_EssexMD_20250313_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: 20250313 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 20250313T182541.2Z 9203.767838 483 1 52.47 2 44.94 205.34 131.08 30.13 0.00 1 0.00 1 0 25 1.827e-02 1.012e-02 4.650e-03 2.468e-03 1.912819e-01 1.290160e-03 2.251287e-03 -6.000000e+00 1.087090e-02 226.27 -2.00 3.48 -2.00 315.98 0.00e+00 1.060092e-03 1.359625e-04 1.296161e-04 -6.000000e+00 4.759474e-04 278.15 -2.00 20.00 -2.00 315.39 0.00e+00 1.411 0.000 302.00 328.00 3 6.3045e+00 3.3287e-03 1.6982e-02 -6.0000e+00 2.6920e-02 4.1732e-02 3.7211e-03 9.5167e-03 -6.0000e+00 2.9269e-02 -8.4280e-04 2.1299e-03 4.6578e-03 -6.0000e+00 1.7425e-02 -4.4237e-03 9.5395e-04 1.4172e-03 -6.0000e+00 7.2348e-03 1.9130e-04 4.2541e-04 7.8501e-05 1.7602e-05 -6.0000e+00 5.6524e-04 6.5128e-03 7.2289e-05 12 8 8 10 0 0 99.98 23.65 0.62 0.00651 0.00971 23 4 1 5 0 2281.060 26.32 20.00 23.65 19.30 5.9 967.94 -12532 -792 5641 -178 -4753 -2822 1971 640 -1314 -1024 -3606 -3995 -1102 2433 2309 -1392 370 204 1139 649 2887 3332 1983 1384 -125 788 -986 -1961 -2467 3626 79 118 176 -2765 -2790 -1608 -2231 -807 433 915 -1278 633 950 437 -263 824 -241 -949 -931 -27 -607 -468 1211 2117 1863 2037 392 -476 -667 151 694 3050 2341 1239 569 -395 -393 -1450 857 831 1181 1493 16 191 -300 -436 -1690 -1534 -2178 -2797 -2040 -2010 -2329 -1313 -924 -328 -31 947 589 935 536 -780 -1207 -959 -977 425 514 396 702 155 -875 -1255 -825 -1043 -1466 -902 -541 433 624 1191 1302 587 354 -415 -257 564 -126 31 82 635 832 574 1162 560 420 -371 124 -255 610 341 -412 -539 -203 -56 -170 -270 386 622 -41 501 -284 -946 -1191 -3059 -186 1267 -40 -1019 -559 381 136 -311 -253 -915 -1032 -298 711 754 -512 140 79 452 241 1170 1342 818 594 -51 329 -416 -874 -1036 1389 32 51 80 -1309 -1270 -711 -1062 -394 245 592 -924 432 662 309 -187 574 -181 -696 -664 -19 -444 -360 882 1594 1444 1601 316 -386 -535 120 566 2583 2136 1193 544 -355 -328 -1188 718 768 1181 1554 17 195 -287 -379 -1473 -1268 -1865 -2426 -1946 -2094 -2394 -1409 -1053 -397 -40 1225 764 1162 620 -833 -1290 -988 -1046 488 600 504 929 203 -1092 -1469 -927 -1211 -1829 -1183 -741 570 858 1709 1931 875 507 -556 -341 701 -157 40 114 861 1153 792 1674 777 553 -469 150 -310 773 457 -579 -776 -298 -79 -252 -420 613 1005 -66 793 -440 -1433 -1791 SS 20250313T190136.8Z 9203.792787 508 1 51.57 2 48.52 216.66 127.35 40.16 0.00 1 0.00 1 0 25 2.579e-02 1.164e-02 6.039e-03 2.940e-03 2.062859e-01 1.534766e-03 2.433632e-03 -6.000000e+00 1.534147e-02 226.27 -2.00 3.48 -2.00 316.22 0.00e+00 1.070661e-03 1.695603e-04 1.829826e-04 -6.000000e+00 6.717540e-04 278.15 -2.00 20.00 -2.00 315.60 0.00e+00 1.507 0.000 302.00 328.00 3 6.4826e+00 3.9718e-03 1.8194e-02 -6.0000e+00 3.7991e-02 4.8948e-02 4.4438e-03 1.0241e-02 -6.0000e+00 4.1307e-02 -5.4260e-03 2.5575e-03 5.0275e-03 -6.0000e+00 2.4592e-02 -2.2929e-03 1.1617e-03 1.5045e-03 -6.0000e+00 1.0209e-02 1.4127e-04 3.0835e-04 9.3757e-05 1.8922e-05 -6.0000e+00 7.9780e-04 7.8675e-03 8.2161e-05 12 9 8 11 8 0 99.95 23.67 0.55 0.00787 0.01018 13 2 1 5 0 3966.240 26.41 20.00 23.67 19.83 5.9 971.12 -17071 -3636 11173 6763 -7296 -3576 2065 -1091 -4151 -1419 -4452 -1951 68 8450 1878 -1055 -1682 463 1212 611 3359 3899 791 751 -387 573 327 -2272 -3930 4038 -2302 1274 752 -1567 -1554 -1421 -2726 -498 2082 1743 -1466 1550 1330 -723 -888 72 -1107 -1750 -879 232 -152 -1335 1385 3261 1910 1785 569 -1383 -544 -548 525 3350 2433 1032 1287 -967 -253 -1012 1799 73 196 2059 -27 116 205 -248 -2155 -1980 -821 -3381 -1879 -2167 -1274 -1509 -1840 -199 289 661 859 1606 55 -722 -1165 -1733 -1386 229 591 -141 1528 176 -897 -1367 -997 -729 -1105 -1103 -508 678 651 1317 1688 1153 236 -179 -723 973 112 -97 143 267 722 664 1122 609 223 -756 -203 -418 709 109 -824 -483 -685 -396 -135 -359 409 921 -95 452 -170 -845 -633 -3822 -774 2092 1258 -1418 -632 353 -209 -896 -313 -1015 -441 16 2096 557 -351 -590 164 439 228 1241 1430 303 298 -161 243 138 -936 -1546 1426 -892 504 317 -688 -656 -589 -1226 -228 1092 1055 -1003 1079 953 -534 -656 52 -796 -1229 -596 155 -106 -993 1055 2545 1424 1354 441 -1090 -419 -423 413 2726 2140 962 1184 -849 -205 -805 1459 66 193 2083 -28 115 191 -210 -1842 -1608 -680 -2899 -1762 -2228 -1385 -1600 -2088 -237 360 845 1094 1953 63 -824 -1230 -1782 -1480 262 687 -180 2000 229 -1117 -1597 -1211 -840 -1367 -1442 -691 953 892 1885 2495 1713 340 -258 -967 1211 140 -127 199 393 1005 988 1620 846 295 -960 -247 -512 903 148 -1173 -703 -1020 -567 -203 -565 657 1500 -156 724 -266 -1289 -954 SS 20250313T191215.4Z 9203.800178 511 1 52.19 2 49.79 219.74 126.07 42.92 0.00 1 0.00 1 0 17 1.144e-02 8.075e-03 2.089e-03 1.184e-03 2.101174e-01 6.210707e-04 2.470311e-03 -6.000000e+00 6.805490e-03 226.27 -2.00 3.48 -2.00 315.68 0.00e+00 8.761146e-04 6.120779e-05 8.801692e-05 -6.000000e+00 2.979686e-04 278.15 -2.00 20.00 -2.00 315.09 0.00e+00 1.546 0.000 302.00 328.00 3 4.9752e+00 1.5976e-03 1.8626e-02 -6.0000e+00 1.6853e-02 3.3843e-02 1.7832e-03 1.0449e-02 -6.0000e+00 1.8323e-02 -7.2869e-03 1.0219e-03 5.1194e-03 -6.0000e+00 1.0909e-02 -2.9349e-03 4.5314e-04 1.5059e-03 -6.0000e+00 4.5290e-03 6.1510e-04 2.2758e-04 3.7412e-05 2.0123e-05 -6.0000e+00 3.5388e-04 6.2938e-03 4.8768e-05 11 8 0 10 0 0 99.87 23.68 0.50 0.00629 0.00800 26 4 1 5 0 2007.200 26.41 20.01 23.68 20.15 5.9 972.62 -4171 115 -2038 -654 -3569 -2035 -110 -956 -982 -2364 -2567 -1961 -645 133 244 180 -286 550 1507 1476 2261 1955 1537 855 1101 1251 -508 -1587 -1058 1078 330 1049 664 -1802 -2847 -2625 -2413 -1260 274 56 -766 103 69 -138 85 218 -38 -333 -580 262 452 400 1246 1532 1006 1058 648 136 -149 285 821 2148 1991 1305 787 -376 -813 -535 822 872 615 443 806 162 -30 -1018 -1468 -1619 -1954 -2097 -1949 -1970 -1853 -1636 -1182 -249 242 641 624 716 325 -241 -323 -490 -455 77 578 418 456 -114 -958 -1346 -676 -542 -723 -1053 -523 -70 495 703 958 564 387 -104 -147 149 97 258 679 595 584 455 799 520 525 41 354 142 271 -16 -309 -422 -235 -96 50 101 364 294 99 129 -450 -866 -1034 -1000 29 -532 -160 -817 -433 -23 -225 -252 -647 -708 -548 -193 44 83 67 -112 221 618 622 960 832 666 387 517 603 -247 -744 -464 450 143 478 321 -911 -1401 -1269 -1246 -681 171 38 -529 74 51 -103 64 161 -27 -252 -430 192 343 299 974 1248 848 906 563 118 -128 245 722 1860 1851 1278 767 -346 -701 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