File name: Pandora55s1_QueensNY_20210306_L2Fit_fout2c11d20210101p1-8.txt File generation date: 20260625T181120.5Z 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_20210306_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: 20210306 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 20210306T132759.1Z 7735.561101 270 1 50.23 2 67.99 118.89 71.55 209.74 0.00 1 0.00 1 0 25 9.810e-02 8.431e-03 2.273e-02 1.688e-03 4.738696e-01 8.736250e-04 5.598200e-03 -6.000000e+00 5.774838e-02 225.77 -2.00 3.51 -2.00 319.01 0.00e+00 8.249290e-04 2.101646e-04 4.883487e-04 -6.000000e+00 2.510013e-03 276.53 -2.00 20.00 -2.00 318.43 0.00e+00 2.645 0.000 302.00 328.00 3 3.5229e+00 2.3935e-03 3.6053e-02 -6.0000e+00 1.4298e-01 6.1267e-02 2.7670e-03 2.4549e-02 -6.0000e+00 1.5530e-01 -4.0302e-03 2.1034e-03 1.2160e-02 -6.0000e+00 9.2411e-02 -6.7660e-03 1.1106e-03 3.6403e-03 -6.0000e+00 3.8755e-02 5.8454e-04 -4.2833e-04 5.0656e-05 4.2897e-05 -6.0000e+00 2.9243e-03 -7.5262e-05 8.7800e-05 11 9 0 11 8 0 99.94 22.82 0.17 -0.00008 -0.00329 74 14 1 5 0 678.720 25.68 19.99 22.82 6.18 26.6 1018.47 -12657 9322 74371 -54035 1529 -14345 -10896 14991 -815 -14260 -32923 541 -23333 10324 17949 -2257 -23190 -2709 7004 15052 9823 5059 -921 -4058 -1341 -6169 12805 -5052 2157 -7980 -876 6354 -4822 -5665 -1465 12302 -1825 -175 581 2446 -5170 -1093 -4317 -986 -1385 3417 -1321 1066 968 1389 1640 -1861 -237 1673 2962 315 2003 517 1159 1318 1483 2454 559 -667 -404 -451 1401 -134 2217 1040 -303 -776 261 -1155 265 -222 1092 1295 1053 246 245 92 -1474 -817 -2060 -982 -1305 -694 -1160 -285 -467 391 782 1597 1613 1313 734 495 -22 -696 -180 -846 128 1015 542 -896 -529 -434 -394 308 -117 -435 -202 -144 -208 612 1073 1170 370 -223 -1303 -625 54 -296 201 -100 403 1189 1188 60 522 232 192 292 295 -256 -23 36 -421 -465 -291 -148 54 14 -276 192 919 -2144 35 -361 -274 330 -23 -500 -1435 18 -1128 436 845 -148 -2042 -215 540 1139 808 442 -86 -414 -143 -732 1311 -602 234 -947 -104 792 -749 -954 -241 1752 -304 -32 125 606 -1542 -340 -1447 -331 -471 1129 -456 363 333 489 605 -758 -102 757 1399 157 1016 268 595 665 749 1278 317 -412 -263 -296 880 -84 1385 705 -227 -617 211 -932 203 -160 727 815 670 168 186 77 -1346 -784 -2077 -1025 -1426 -783 -1331 -323 -515 410 773 1517 1547 1339 816 599 -28 -947 -243 -1100 157 1183 641 -1112 -680 -577 -544 444 -178 -693 -328 -232 -325 915 1548 1687 549 -343 -2079 -998 85 -456 300 -147 572 1638 1656 89 815 380 324 503 524 -472 -43 69 -822 -909 -559 -276 97 25 SS 20210306T133404.2Z 7735.565326 273 1 48.35 2 66.99 120.12 72.12 211.02 0.00 1 0.00 1 0 25 6.342e-02 7.707e-03 1.854e-02 1.647e-03 4.551871e-01 8.522151e-04 5.354114e-03 -6.000000e+00 3.736618e-02 225.77 -2.00 3.51 -2.00 318.87 0.00e+00 2.923372e-04 1.966141e-04 4.730487e-04 -6.000000e+00 1.623480e-03 276.53 -2.00 20.00 -2.00 318.29 0.00e+00 2.538 0.000 302.00 328.00 3 3.5510e+00 2.3258e-03 3.4547e-02 -6.0000e+00 9.2518e-02 4.8338e-02 2.6775e-03 2.3458e-02 -6.0000e+00 1.0046e-01 6.9144e-03 1.9903e-03 1.1619e-02 -6.0000e+00 5.9781e-02 -1.1643e-02 1.0499e-03 3.4435e-03 -6.0000e+00 2.5094e-02 6.4948e-04 5.9857e-04 4.9646e-05 4.0357e-05 -6.0000e+00 1.8906e-03 -1.6310e-03 2.5507e-04 12 9 1 12 1 1 99.99 22.81 0.10 -0.00163 0.00287 80 16 1 5 0 594.600 25.68 19.99 22.81 6.26 26.4 1018.16 -13209 18200 30787 -40048 -10253 2882 -7436 13514 -7147 -10260 -20651 1010 -12897 6545 21871 -2416 -13443 -442 8460 7467 5453 2117 2959 -2624 -1736 -1296 10772 -2297 -3079 -3777 1096 4879 -3925 -5678 -1385 10435 -417 -1289 1847 1354 -4287 -2169 -3814 -2245 -1382 1345 -1293 237 -110 1688 1488 -1875 -695 2016 2034 563 1497 277 1162 1643 1572 2106 435 -566 -244 -558 1173 -41 2431 791 -675 -694 220 -1031 63 101 1479 1858 792 472 -380 311 -1323 -696 -1682 -933 -1260 -797 -1007 -237 -343 417 1219 1593 1449 1387 613 565 106 -575 -398 -585 139 867 97 -943 -522 -284 -198 104 -29 -531 -82 -214 -305 531 883 1035 409 -185 -1166 -649 -146 -291 84 -78 199 1272 1012 394 495 268 157 210 270 -447 128 352 -439 -524 -2 -376 -89 83 -333 399 645 -1591 -296 71 -207 344 -247 -396 -919 39 -638 321 1109 -176 -1197 -38 707 665 511 208 295 -290 -204 -162 1236 -292 -383 -469 138 663 -646 -1020 -243 1613 -73 -255 417 360 -1350 -724 -1352 -807 -497 477 -470 86 -40 621 573 -794 -314 946 1005 291 790 149 618 860 823 1140 255 -361 -163 -377 758 -26 1548 550 -516 -562 181 -847 50 74 1004 1192 514 328 -294 263 -1223 -674 -1710 -986 -1391 -906 -1167 -271 -382 441 1215 1528 1403 1425 686 686 138 -783 -539 -758 170 1015 115 -1175 -676 -379 -273 150 -44 -847 -133 -344 -475 789 1268 1483 602 -284 -1847 -1032 -228 -446 126 -114 282 1744 1407 577 767 436 263 360 474 -815 240 671 -847 -1014 -3 -697 -160 146 SS 20210306T140238.4Z 7735.585167 292 1 50.87 2 62.45 126.18 75.07 216.83 0.00 1 0.00 1 0 25 1.717e-02 6.315e-03 5.621e-03 8.010e-04 3.887600e-01 4.127309e-04 4.628093e-03 -6.000000e+00 1.010973e-02 225.78 -2.00 3.51 -2.00 318.48 0.00e+00 -2.568835e-05 8.329445e-05 2.763663e-04 -6.000000e+00 4.393316e-04 276.53 -2.00 20.00 -2.00 317.88 0.00e+00 2.151 0.000 302.00 328.00 3 2.5356e+00 1.1122e-03 2.9368e-02 -6.0000e+00 2.5031e-02 2.5678e-02 1.2665e-03 1.9897e-02 -6.0000e+00 2.7184e-02 1.1487e-02 8.6807e-04 9.9009e-03 -6.0000e+00 1.6176e-02 -1.1378e-02 4.5229e-04 2.8371e-03 -6.0000e+00 6.7870e-03 2.8830e-03 1.8889e-04 2.4586e-05 3.4487e-05 -6.0000e+00 5.1171e-04 -1.7484e-03 1.3883e-04 10 0 0 10 0 0 100.00 22.81 0.13 -0.00175 -0.00033 652 123 1 5 0 77.180 25.68 20.00 22.81 6.89 26.4 1019.97 -3101 -3483 2036 -11886 -3230 -6140 -939 3265 459 -1908 -6149 2000 -1587 2025 1078 23 -4234 1174 652 1023 520 1101 1131 -97 527 -748 1154 -2113 679 455 2285 2595 982 -1968 -1378 1988 -44 553 -283 -315 -2551 -1469 -1946 -1385 -1180 -464 -1138 -647 -518 316 864 -70 491 936 973 351 874 515 545 1101 1602 1559 1013 593 -616 4 477 641 1757 946 -90 -413 -589 -771 -357 -61 862 1223 1583 573 318 -349 -1313 -1099 -1268 -956 -874 -473 -693 -565 -176 414 748 1592 1723 1427 968 782 -238 -674 -374 -601 11 946 104 -842 -423 -760 -219 33 -224 -448 -321 -126 -100 573 813 808 584 -238 -685 -596 -233 -395 150 45 439 1354 924 271 499 74 282 245 272 -275 -188 217 -399 -385 -158 -224 -88 79 -121 -155 92 -601 -143 -265 -40 146 24 -108 -378 119 -108 155 97 2 -492 138 81 133 70 150 156 -14 82 -124 193 -356 108 71 366 454 192 -420 -295 404 -9 130 -79 -102 -943 -578 -801 -582 -497 -196 -481 -272 -217 134 377 -33 244 489 534 200 509 303 320 634 923 928 646 407 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