File name: Pandora55s1_QueensNY_20210120_L2Fit_fout2c11d20210101p1-8.txt File generation date: 20260625T175149.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c11p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora55_OF_v4d20190723.txt Instrument calibration file used: Pandora55s1_CF_v11d20210101.txt Level 1 file used: Pandora55s1_QueensNY_20210120_L1_smca1c11d20210101p1-8.txt Full location name: Queens College NYSDEC (USEPA AQS ID 36-081-0124) Short location name: QueensNY Country of location: USA Location latitude [deg]: 40.7361 Location longitude [deg]: -73.8215 Location altitude [m]: 25 Local noon date: 20210120 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: None First and last pixel inside fitting window: 261 404 Nominal wavelengths inside fitting window [nm]: 305.0145 305.1546 305.2946 305.4346 305.5746 305.7145 305.8545 305.9945 306.1344 306.2744 306.4143 306.5542 306.6941 306.8340 306.9739 307.1138 307.2536 307.3935 307.5333 307.6732 307.8130 307.9528 308.0926 308.2324 308.3722 308.5120 308.6517 308.7915 308.9312 309.0710 309.2107 309.3504 309.4901 309.6298 309.7695 309.9091 310.0488 310.1884 310.3281 310.4677 310.6073 310.7469 310.8865 311.0261 311.1657 311.3053 311.4448 311.5844 311.7239 311.8634 312.0029 312.1424 312.2819 312.4214 312.5609 312.7003 312.8398 312.9792 313.1187 313.2581 313.3975 313.5369 313.6763 313.8156 313.9550 314.0944 314.2337 314.3730 314.5124 314.6517 314.7910 314.9303 315.0695 315.2088 315.3481 315.4873 315.6265 315.7658 315.9050 316.0442 316.1834 316.3226 316.4617 316.6009 316.7401 316.8792 317.0183 317.1574 317.2966 317.4357 317.5747 317.7138 317.8529 317.9919 318.1310 318.2700 318.4090 318.5481 318.6871 318.8260 318.9650 319.1040 319.2429 319.3819 319.5208 319.6598 319.7987 319.9376 320.0765 320.2153 320.3542 320.4931 320.6319 320.7708 320.9096 321.0484 321.1872 321.3260 321.4648 321.6036 321.7423 321.8811 322.0198 322.1586 322.2973 322.4360 322.5747 322.7134 322.8520 322.9907 323.1294 323.2680 323.4066 323.5453 323.6839 323.8225 323.9611 324.0996 324.2382 324.3768 324.5153 324.6538 324.7924 324.9309 --------------------------------------------------------------------------------------- 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 100-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-387: 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 20210120T143118.1Z 7690.605070 131 1 50.15 2 70.61 141.39 110.24 61.81 0.00 1 0.00 1 0 25 4.388e-01 1.681e-02 1.594e-01 2.923e-03 5.853780e-01 1.533930e-03 6.679126e-03 -6.000000e+00 2.571118e-01 223.95 -2.00 3.51 -2.00 319.84 0.00e+00 2.716841e-03 4.821674e-04 3.325881e-04 -6.000000e+00 1.134617e-02 275.31 -2.00 20.00 -2.00 319.32 0.00e+00 2.978 0.000 302.00 328.00 3 4.1142e+00 4.3525e-03 4.2117e-02 -6.0000e+00 6.3427e-01 1.0296e-01 5.2745e-03 3.0029e-02 -6.0000e+00 6.8981e-01 -9.7239e-02 4.6509e-03 1.5655e-02 -6.0000e+00 4.1069e-01 3.4385e-02 2.4068e-03 6.1719e-03 -6.0000e+00 1.7504e-01 2.0666e-04 9.5755e-04 8.5284e-05 6.5203e-05 -6.0000e+00 1.3160e-02 -6.9300e-03 3.9446e-04 12 8 8 10 0 0 99.98 22.81 0.16 -0.00693 0.00027 27 5 1 5 0 1856.800 25.68 19.99 22.81 8.80 26.8 1042.09 900000 268200 900000 -153342 57027 40968 -67616 172666 -13798 -15813 -125896 -48174 -98337 -15764 232823 -2551 -61317 21881 95958 90828 69582 -4261 -3298 -29542 -19953 -22634 70569 -22125 -15040 -32274 -9419 12614 -8624 -6118 7426 70897 -5505 -4637 13655 10889 -3782 2447 -7132 -7533 4962 20939 -857 14523 7567 7093 -3748 2181 -2909 10005 7830 4768 9336 4106 5807 2492 1200 4648 1432 -4606 3324 -3663 5573 -116 4086 2380 -2316 -272 2318 -2881 1383 -894 2498 3198 -1439 619 -1793 1346 -1890 -1351 -3218 -1468 -2414 -1590 -2803 8 107 114 1578 692 -973 1459 -1112 -473 -789 -1806 -341 -7 -57 1265 879 -599 -640 -324 215 1139 710 -632 528 -271 -250 408 553 1380 49 334 -1307 -539 588 940 -425 542 -51 691 728 180 329 1022 619 282 740 -550 273 70 -234 -489 -441 -518 -397 -400 900000 764 900000 -6795 352 279 -1275 492 -195 -247 -5699 -1159 -4365 -404 743 -85 -3978 729 1755 1841 1774 -217 -169 -2033 -1347 -1668 2267 -1657 -1038 -2662 -687 869 -832 -632 697 3637 -584 -544 1606 1553 -703 472 -1586 -1739 1041 3868 -195 2930 1665 1637 -1014 610 -928 3068 2604 1696 3304 1537 2126 922 448 1749 602 -2240 1628 -1952 2699 -58 2043 1312 -1458 -180 1539 -1963 868 -533 1338 1622 -774 356 -1191 974 -1535 -1163 -2946 -1387 -2398 -1626 -2938 8 106 108 1400 601 -874 1385 -1185 -552 -1000 -2421 -452 -9 -67 1413 988 -708 -790 -413 285 1587 1062 -1010 862 -446 -400 626 823 2039 75 526 -2136 -876 931 1452 -646 796 -73 965 1037 274 536 1750 1107 519 1405 -1090 556 146 -490 -1023 -907 -1030 -759 -751 SS 20210120T150458.7Z 7690.628458 149 1 49.49 2 66.96 148.92 104.57 67.86 0.00 1 0.00 1 0 25 6.037e-02 6.929e-03 8.268e-03 7.164e-04 5.116924e-01 3.684567e-04 6.065869e-03 -6.000000e+00 3.530231e-02 223.95 -2.00 3.51 -2.00 318.86 0.00e+00 5.396997e-04 8.512914e-05 3.171427e-04 -6.000000e+00 1.537142e-03 275.31 -2.00 20.00 -2.00 318.30 0.00e+00 2.535 0.000 302.00 328.00 3 2.0528e+00 9.9989e-04 3.6373e-02 -6.0000e+00 8.7083e-02 3.8664e-02 1.1511e-03 2.6001e-02 -6.0000e+00 9.4720e-02 -2.3837e-02 8.6582e-04 1.3051e-02 -6.0000e+00 5.6398e-02 2.1101e-03 4.6021e-04 3.8091e-03 -6.0000e+00 2.3722e-02 2.7448e-03 -8.6209e-04 2.0936e-05 4.6198e-05 -6.0000e+00 1.7987e-03 -3.4807e-03 2.3405e-05 12 9 1 12 1 1 99.92 22.81 0.17 -0.00348 -0.00996 191 37 1 5 0 254.160 25.68 20.00 22.81 9.14 27.0 1044.64 -27062 -16089 4371 -29431 -20960 -13850 -25691 -4630 -22467 -11191 -24759 -7736 -15905 -5481 701 -4106 -4543 -4805 2170 124 1043 -2650 1046 -2631 -1194 -3822 424 -3333 -1542 -2673 -716 2370 -902 -1838 -1452 3659 -688 424 486 -517 -1488 -1273 -1815 -1880 265 211 -485 -12 780 724 848 865 671 1492 971 1002 1061 433 753 953 1328 1812 1484 407 -41 73 941 673 2052 806 164 -304 -517 -706 -790 -188 641 1096 1147 398 -133 -520 -1729 -1421 -1428 -1173 -973 -846 -705 -552 -28 527 856 1321 1617 1249 839 738 -387 -708 -551 -554 -56 841 -135 -992 -690 -823 -167 -33 -89 -394 -165 -37 134 768 1091 900 519 -313 -796 -523 -222 -195 42 130 369 1604 1049 402 305 135 323 259 351 -373 -191 70 -324 -673 -241 -206 -104 167 -631 -397 96 -908 -561 -329 -708 -116 -764 -374 -1005 -285 -734 -278 38 -279 -351 -406 184 11 98 -264 103 -284 -130 -459 50 -405 -179 -314 -88 325 -146 -329 -264 618 -125 82 112 -138 -462 -413 -627 -671 94 75 -176 -5 287 276 326 364 310 708 493 510 559 233 400 516 715 972 874 258 -27 49 627 439 1359 572 127 -246 -433 -582 -616 -138 441 729 768 284 -105 -442 -1603 -1375 -1466 -1237 -1053 -959 -791 -631 -30 551 855 1293 1604 1313 940 884 -508 -965 -748 -724 -68 980 -160 -1224 -874 -1098 -228 -47 -132 -618 -262 -59 206 1154 1598 1313 768 -480 -1246 -821 -348 -294 62 190 528 2190 1468 598 475 222 545 445 618 -684 -359 132 -623 -1296 -460 -383 -186 297 SS 20210120T151005.8Z 7690.632011 152 1 17.58 2 66.46 150.11 103.69 68.74 0.00 1 0.00 1 0 25 4.624e-02 6.855e-03 7.635e-03 7.754e-04 5.031818e-01 3.984652e-04 5.981390e-03 -6.000000e+00 2.703579e-02 223.95 -2.00 3.51 -2.00 318.73 0.00e+00 4.950865e-04 8.793012e-05 3.189075e-04 -6.000000e+00 1.177257e-03 275.31 -2.00 20.00 -2.00 318.17 0.00e+00 2.486 0.000 302.00 328.00 3 1.2643e+00 1.0752e-03 3.5700e-02 -6.0000e+00 6.6691e-02 3.9096e-02 1.2313e-03 2.5528e-02 -6.0000e+00 7.2542e-02 -2.6744e-02 8.9989e-04 1.2797e-02 -6.0000e+00 4.3193e-02 3.7461e-03 4.7809e-04 3.7204e-03 -6.0000e+00 1.8166e-02 6.4005e-03 -9.3119e-04 2.2611e-05 4.4950e-05 -6.0000e+00 1.3776e-03 -3.2622e-03 1.0647e-05 12 9 1 12 1 1 99.82 22.81 0.17 -0.00326 -0.01026 145 80 1 5 0 119.210 25.68 19.99 22.81 9.32 26.9 1045.19 -20481 -15801 -6173 -23720 -13704 -18190 -14371 -10360 -13676 -9680 -15614 -7296 -10958 -2707 -2293 -1555 -3684 -1358 1388 -201 545 -982 544 -1862 -871 -2245 -232 -2800 -1350 -983 -355 861 1112 -1392 -1229 557 -745 396 99 -557 -1749 -925 -1536 -1296 15 165 -348 -323 105 358 1059 622 841 1384 1134 821 1001 454 466 834 1403 1533 1624 799 -249 233 770 1237 1574 883 145 -443 -657 -621 -594 -201 480 846 1352 222 -137 -575 -1582 -1386 -1399 -1288 -1064 -694 -567 -633 -58 579 747 1557 1672 1274 943 686 -309 -791 -514 -556 7 917 -45 -1099 -599 -782 -203 -68 -212 -360 -264 -25 51 841 1118 877 506 -253 -767 -614 -251 -336 159 201 446 1523 1085 343 443 107 368 275 301 -247 -279 156 -447 -584 -323 -192 -130 161 -545 -473 -182 -837 -413 -545 -427 -331 -513 -383 -695 -321 -527 -146 -150 -119 -325 -128 136 -21 59 -110 61 -210 -106 -296 -31 -377 -174 -126 -48 132 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