File name: Pandora75s1_EssexMD_20240704_L2Fit_fout2c1d20221230p1-8.txt File generation date: 20240708T145242.4Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 75 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora75_OF_v3d20220127.txt Instrument calibration file used: Pandora75s1_CF_v104d20221230.txt Level 1 file used: Pandora75s1_EssexMD_20240704_L1_smca1c1d20221230p1-8.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: 20240704 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-data based on session 103 First and last pixel inside fitting window: 196 337 Nominal wavelengths inside fitting window [nm]: 305.0663 305.2078 305.3493 305.4908 305.6322 305.7737 305.9151 306.0566 306.1980 306.3394 306.4807 306.6221 306.7635 306.9048 307.0461 307.1874 307.3287 307.4700 307.6112 307.7524 307.8937 308.0349 308.1761 308.3172 308.4584 308.5996 308.7407 308.8818 309.0229 309.1640 309.3051 309.4461 309.5872 309.7282 309.8692 310.0102 310.1512 310.2921 310.4331 310.5740 310.7149 310.8558 310.9967 311.1376 311.2784 311.4193 311.5601 311.7009 311.8417 311.9825 312.1233 312.2640 312.4048 312.5455 312.6862 312.8269 312.9676 313.1083 313.2489 313.3896 313.5302 313.6708 313.8114 313.9520 314.0925 314.2331 314.3736 314.5141 314.6547 314.7951 314.9356 315.0761 315.2165 315.3570 315.4974 315.6378 315.7782 315.9186 316.0590 316.1993 316.3397 316.4800 316.6203 316.7606 316.9009 317.0411 317.1814 317.3216 317.4619 317.6021 317.7423 317.8825 318.0227 318.1628 318.3030 318.4431 318.5832 318.7233 318.8634 319.0035 319.1436 319.2836 319.4237 319.5637 319.7037 319.8437 319.9837 320.1237 320.2636 320.4036 320.5435 320.6834 320.8233 320.9632 321.1031 321.2430 321.3828 321.5227 321.6625 321.8023 321.9421 322.0819 322.2217 322.3615 322.5012 322.6409 322.7807 322.9204 323.0601 323.1998 323.3395 323.4791 323.6188 323.7584 323.8980 324.0376 324.1772 324.3168 324.4564 324.5960 324.7355 324.8750 --------------------------------------------------------------------------------------- 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 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: 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 20240704T105145.5Z 8951.452610 113 1 52.07 2 79.20 69.28 61.95 75.90 0.00 1 0.00 1 0 25 3.794e-01 1.529e-02 3.630e-01 1.119e-02 6.049963e-01 6.628279e-03 7.415323e-03 -6.000000e+00 2.352102e-01 232.81 -2.00 3.48 -2.00 321.37 0.00e+00 4.393487e-03 3.338200e-03 5.052990e-03 -6.000000e+00 1.112852e-02 289.49 -2.00 20.00 -2.00 320.76 0.00e+00 5.134 0.002 302.00 328.00 3 3.1294e+00 2.3714e-02 6.4972e-02 -6.0000e+00 5.8948e-01 1.8839e-01 3.1708e-02 4.3878e-02 -6.0000e+00 6.3277e-01 -3.0313e-01 2.9043e-02 2.1918e-02 -6.0000e+00 3.7723e-01 1.1718e-01 1.3806e-02 6.0004e-03 -6.0000e+00 1.6182e-01 7.2543e-05 -1.2799e-03 3.6762e-04 1.3998e-04 -6.0000e+00 1.1876e-02 -3.6037e-02 2.4193e-04 12 9 8 11 24 0 97.76 23.60 0.83 -0.03604 -0.04565 30 5 1 5 0 1735.390 26.32 20.00 23.60 32.08 4.3 1041.21 -93127 33668 900000 -137565 900000 -80483 3306 -167476 -149223 -63083 102914 900000 20750 -86419 -85396 152122 26113 53807 -7886 117428 4657 -53199 -38324 58842 93275 33928 35600 -26445 26346 -16040 4812 -44912 -31823 -24604 -27526 -40716 15010 -4368 10000 21456 -26590 -6824 24064 27049 23216 19845 20404 17973 26623 11281 21341 -18812 10507 10234 18083 -6607 2356 8193 7533 217 153 1153 5012 -6462 5119 1598 4525 5587 7599 6976 6148 1175 -3376 -190 1739 -5674 -8177 -5742 -4456 -3289 -428 609 445 -1242 -1180 843 2121 2220 3079 -1534 1653 -539 -2295 -1758 -285 -141 2114 1435 -323 -526 -2493 -1701 -1024 -818 240 -670 -1149 -1182 201 -542 284 -977 -795 -151 -828 -637 -1424 1057 1552 1867 621 868 1536 2508 1246 330 -1620 289 -902 -300 -827 -1250 -35 217 -218 828 286 77 853 535 -877 -1361 -1016 367 900000 -2250 900000 -878 36 -3653 -2983 -688 1122 900000 226 -1728 -2095 1659 311 587 -156 1281 88 -1793 -1140 700 1017 572 600 -813 470 -461 129 -2315 -1641 -1268 -1446 -2422 551 -225 535 1212 -2742 -622 1694 1904 1726 1554 1618 1497 2112 1107 2073 -3021 1375 1451 2510 -1218 406 1332 1210 37 27 221 1137 -1818 1345 430 1170 1468 2130 2221 2172 458 -1370 -71 588 -1875 -2595 -1791 -1511 -1284 -189 302 242 -736 -748 558 1457 1569 2159 -1089 1067 -334 -1397 -1093 -193 -109 1845 1427 -352 -576 -2635 -1640 -918 -736 227 -678 -1242 -1375 252 -757 429 -1570 -1275 -233 -1222 -908 -2063 1561 2410 3000 1010 1373 2337 3641 1758 454 -2241 411 -1433 -527 -1590 -2573 -74 492 -529 2085 743 205 2226 1351 -2132 -3174 SS 20240704T110219.7Z 8951.459951 116 1 35.48 2 77.28 70.81 60.02 77.24 0.00 1 0.00 1 0 17 3.939e-01 1.568e-02 2.069e-01 7.556e-03 5.410258e-01 4.266381e-03 7.649957e-03 -6.000000e+00 2.439734e-01 232.81 -2.00 3.48 -2.00 320.76 0.00e+00 4.469011e-03 1.765815e-03 6.629709e-03 -6.000000e+00 1.078036e-02 289.49 -2.00 20.00 -2.00 320.09 0.00e+00 4.416 0.001 302.00 328.00 3 3.3463e+00 1.3676e-02 6.0997e-02 -6.0000e+00 6.1177e-01 1.4929e-01 1.7374e-02 5.0036e-02 -6.0000e+00 6.5666e-01 -1.9895e-01 1.4743e-02 2.0030e-02 -6.0000e+00 3.9137e-01 7.0040e-02 7.2627e-03 4.0121e-03 -6.0000e+00 1.6676e-01 1.2150e-04 -1.1119e-03 2.4064e-04 1.1137e-04 -6.0000e+00 1.2147e-02 -3.5488e-02 1.7931e-04 12 9 9 12 25 1 97.21 23.60 0.57 -0.03549 -0.04384 15 4 1 5 0 2216.930 26.32 20.00 23.60 32.27 4.3 1042.54 -164424 24589 -73022 -151213 -143351 -127468 -98577 239600 -34068 -73156 21299 -136462 -65480 -40838 -49090 -22689 -15750 45020 7864 45935 -41607 38912 -40142 7157 -10600 -20872 -14702 -37854 -8801 -18646 -12 -8052 16226 -8799 36844 6156 -9330 -2231 12140 -1436 2725 3494 -3397 8994 6817 10649 8323 8014 4983 -405 5766 2457 2137 3375 6703 9117 5980 10742 1782 -1820 4878 4863 6394 8514 5044 2181 294 -470 901 5680 4935 4924 2341 2045 380 -5196 -1935 -7484 -5486 -4120 -1343 -1472 -213 17 -1045 515 -1448 974 -648 608 -1573 374 -2691 -1427 -1796 -943 528 -1005 -261 -958 -346 -2596 -1925 -2181 -1008 -1881 -1291 -566 -258 1751 1135 749 -113 -184 -674 193 -365 383 1394 673 1599 1244 1580 864 55 591 175 479 -147 243 -940 -813 -596 146 -21 -108 578 329 83 -291 257 -1668 -4543 181 -1125 -5064 -4128 -2988 -1783 1765 -388 -1323 157 -5301 -1491 -903 -1447 -608 -443 754 205 861 -1923 808 -1882 220 -412 -937 -630 -2003 -342 -837 -1 -426 761 -566 1481 334 -637 -181 1020 -163 333 456 -498 1199 944 1444 1171 1151 760 -69 998 483 458 768 1556 2136 1476 2525 450 -475 1233 1336 1927 2754 1754 765 103 -169 346 2339 2247 2347 1140 952 166 -2178 -733 -2994 -2348 -2009 -734 -909 -142 12 -800 413 -1246 842 -569 509 -1259 275 -1951 -1040 -1437 -851 537 -1168 -322 -1186 -403 -2846 -1972 -2262 -1098 -2191 -1584 -738 -364 2656 1703 1173 -176 -276 -1061 290 -556 605 2304 1165 2749 2097 2573 1364 84 862 252 716 -243 439 -1691 -1547 -1186 306 -48 -253 1376 797 200 -682 570 -3612 SS 20240704T111214.9Z 8951.466839 119 1 51.72 2 75.46 72.24 58.20 78.50 0.00 1 0.00 1 0 17 1.465e-01 8.777e-03 1.400e-02 1.029e-03 4.890929e-01 5.655502e-04 5.831014e-03 -6.000000e+00 9.070764e-02 232.81 -2.00 3.48 -2.00 319.48 0.00e+00 1.615407e-03 1.603191e-04 1.676235e-03 -6.000000e+00 4.007996e-03 289.49 -2.00 20.00 -2.00 318.71 0.00e+00 3.899 0.001 302.00 328.00 3 1.6426e+00 1.6122e-03 4.7299e-02 -6.0000e+00 2.2745e-01 7.1249e-03 1.8946e-03 2.7308e-02 -6.0000e+00 2.4414e-01 -6.0197e-02 1.4565e-03 1.3076e-02 -6.0000e+00 1.4551e-01 1.7686e-02 7.5983e-04 3.4948e-03 -6.0000e+00 6.2003e-02 1.2096e-03 -1.0746e-03 3.1700e-05 4.7068e-05 -6.0000e+00 4.5160e-03 -3.5832e-02 1.7739e-04 11 8 0 10 0 0 95.24 23.60 0.42 -0.03583 -0.04391 175 28 1 5 0 295.490 26.32 20.00 23.60 32.29 4.3 1042.94 -60354 -48252 -32769 -43529 -61206 -42519 -51863 -47275 -45103 -38550 -46424 -37466 -29237 -24881 -16569 -9780 -6589 -7529 -181 -3926 1703 1158 -4629 -2733 -4762 404 -1548 -3495 -7020 -10661 -2919 -4445 -894 -3628 -4459 -4868 -5411 -2442 -1579 -1098 1046 1088 810 2312 1397 1870 1579 410 761 1216 1292 1893 2658 2776 1679 1288 963 689 374 548 870 1683 2653 2533 1616 693 142 190 732 2131 1482 1311 1146 246 -246 -1276 -2308 -3100 -2511 -2441 -2107 -2486 -1714 -1498 -402 -206 815 953 986 920 334 48 -789 -1009 -836 -140 349 624 173 -508 -1012 -1772 -966 -743 -912 -1259 -620 -321 495 948 1042 642 206 -172 -225 -130 216 374 586 500 496 659 873 464 328 -124 -47 74 -2 -182 -358 -622 -350 18 -4 150 414 419 118 -31 -498 -798 -1296 -1075 -677 -1000 -1572 -874 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