File name: Pandora55s1_QueensNY_20210531_L2Fit_fout2c11d20210101p1-8.txt File generation date: 20260625T185801.2Z 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_20210531_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: 20210531 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 20210531T115704.6Z 7821.497969 252 1 6.11 2 64.02 82.53 68.67 212.88 0.00 1 0.00 1 0 25 2.025e-02 7.024e-03 1.212e-02 2.700e-03 3.720374e-01 1.421773e-03 4.422530e-03 -6.000000e+00 1.219214e-02 232.04 -2.00 3.51 -2.00 317.74 0.00e+00 9.533163e-05 2.337384e-04 2.110535e-04 -6.000000e+00 5.370923e-04 285.23 -2.00 20.00 -2.00 316.96 0.00e+00 2.269 0.000 302.00 328.00 3 2.8889e+00 3.8121e-03 3.0167e-02 -6.0000e+00 3.0553e-02 2.2656e-02 4.2887e-03 1.9543e-02 -6.0000e+00 3.2994e-02 -4.0670e-03 2.6519e-03 9.4647e-03 -6.0000e+00 1.9635e-02 -1.0075e-03 1.3247e-03 2.5871e-03 -6.0000e+00 8.1904e-03 1.8493e-03 -5.6057e-04 8.1752e-05 3.1874e-05 -6.0000e+00 6.0516e-04 4.3509e-03 -2.9643e-06 12 9 1 12 1 1 92.02 22.67 0.27 0.00435 0.00014 8 14 1 5 0 658.550 25.58 20.00 22.67 17.18 28.2 1051.79 -8996 -683 -4900 -7549 -2422 957 -10428 951 -1059 -9834 -4749 -3942 -160 -1854 4247 -381 -2574 889 2342 -867 -1318 -675 -23 305 -366 -1249 1529 -3788 -1248 1261 857 3924 943 -1622 1349 1476 -28 -44 762 -8 -742 -883 -614 -939 -239 -227 -1854 97 -543 1425 869 185 1041 961 1427 527 1193 -131 1507 542 1879 872 1648 -534 -617 -851 303 607 1432 611 -265 -353 -336 -980 -45 -239 322 472 1238 311 282 -840 -1341 -1352 -1681 -1086 -974 -770 -622 -611 -60 433 635 1172 1749 1456 613 1019 -261 -516 -470 -534 400 1216 -254 -941 -455 -697 -38 251 3 -385 -2 -162 -104 648 594 484 557 -392 -834 -497 -316 -57 216 314 433 1427 855 80 577 -147 492 254 276 -208 160 271 -579 -931 -123 -180 -355 271 -598 -47 -373 -583 -168 61 -762 69 -88 -945 -451 -387 -17 -227 567 -60 -441 157 427 -170 -266 -137 -5 65 -83 -301 366 -929 -290 281 199 962 258 -477 389 416 -8 -14 281 -3 -345 -438 -313 -490 -125 -119 -982 50 -283 739 465 105 619 598 918 349 806 -90 1018 365 1261 607 1204 -417 -499 -688 235 457 1084 493 -230 -323 -313 -908 -41 -204 257 359 936 247 244 -786 -1336 -1402 -1810 -1210 -1127 -915 -750 -733 -70 485 674 1199 1785 1556 700 1241 -338 -691 -625 -685 487 1439 -307 -1189 -593 -934 -52 356 5 -591 -3 -248 -154 920 820 668 785 -575 -1260 -756 -477 -84 313 443 596 1912 1156 113 848 -224 766 401 449 -349 276 474 -1026 -1656 -215 -310 -595 448 SS 20210531T120121.2Z 7821.500940 255 1 9.37 2 63.22 83.18 69.09 213.82 0.00 1 0.00 1 0 25 1.343e-02 6.460e-03 2.466e-03 6.175e-04 3.659864e-01 3.245014e-04 4.349543e-03 -6.000000e+00 8.084048e-03 232.04 -2.00 3.51 -2.00 317.56 0.00e+00 6.456443e-06 5.064052e-05 1.144994e-04 -6.000000e+00 3.560849e-04 285.23 -2.00 20.00 -2.00 316.77 0.00e+00 2.207 0.000 302.00 328.00 3 5.9813e-01 8.6714e-04 2.9468e-02 -6.0000e+00 2.0258e-02 1.6264e-02 9.7442e-04 1.9170e-02 -6.0000e+00 2.1876e-02 -8.8086e-03 5.9301e-04 9.3026e-03 -6.0000e+00 1.3018e-02 7.7769e-05 2.9315e-04 2.5334e-03 -6.0000e+00 5.4312e-03 1.9695e-02 -5.2196e-04 1.8713e-05 3.1609e-05 -6.0000e+00 4.0119e-04 3.8071e-03 7.7385e-06 12 9 1 12 1 1 98.31 22.67 0.20 0.00381 -0.00012 159 159 1 5 0 57.370 25.58 20.00 22.67 17.31 28.2 1052.42 -3048 -3962 -5208 -5759 -5719 -3324 -4238 -1862 -3195 -1841 -3037 -831 -1554 138 -51 -456 -444 237 807 -226 -379 235 1645 490 482 -117 -351 -1075 222 1438 898 1765 863 -952 -1032 503 -273 468 82 -688 -1389 -821 -1115 -915 -400 -495 -683 -485 -178 320 651 699 983 980 641 820 659 377 705 917 1520 1379 1230 513 -541 -51 333 778 1555 869 122 -526 -817 -672 -792 -183 409 823 1202 405 29 -738 -1621 -1226 -1195 -1136 -880 -578 -500 -643 -138 164 517 1357 1539 1233 891 802 -448 -705 -391 -611 132 806 -86 -824 -483 -710 -152 -71 -159 -335 -237 -111 38 623 944 861 599 -151 -673 -456 -321 -248 238 186 547 1497 1046 461 436 -49 273 224 241 -313 -195 132 -411 -441 -250 -302 -220 54 -219 -328 -461 -504 -465 -250 -329 -157 -309 -190 -328 -92 -191 20 -8 -80 -85 48 171 -47 -81 51 357 113 119 -31 -94 -283 55 344 225 482 263 -294 -319 149 -84 162 32 -302 -696 -419 -598 -502 -220 -273 -377 -265 -97 174 367 401 607 614 424 561 464 269 498 637 1054 1002 924 402 -451 -42 258 601 1212 713 108 -483 -776 -629 -706 -156 328 638 918 321 25 -692 -1622 -1259 -1299 -1269 -1006 -693 -613 -781 -160 183 550 1395 1579 1309 1017 988 -573 -954 -521 -792 162 939 -103 -1030 -638 -954 -206 -99 -232 -502 -362 -170 57 886 1312 1193 838 -218 -1000 -687 -477 -368 348 261 752 2027 1389 636 632 -74 423 348 391 -524 -333 231 -718 -771 -440 -510 -365 87 SS 20210531T120543.5Z 7821.503976 258 1 47.43 2 62.39 83.85 69.53 214.77 0.00 1 0.00 1 0 25 1.281e-02 6.559e-03 8.279e-04 2.172e-04 3.586960e-01 1.147001e-04 4.277649e-03 -6.000000e+00 7.714359e-03 232.04 -2.00 3.51 -2.00 317.47 0.00e+00 -3.577871e-05 1.742114e-05 1.253134e-04 -6.000000e+00 3.397807e-04 285.23 -2.00 20.00 -2.00 316.69 0.00e+00 2.147 0.000 302.00 328.00 3 2.0994e-01 3.0580e-04 2.8776e-02 -6.0000e+00 1.9332e-02 1.5533e-02 3.4251e-04 1.8796e-02 -6.0000e+00 2.0875e-02 -9.0932e-03 2.0696e-04 9.1140e-03 -6.0000e+00 1.2423e-02 3.8997e-04 1.0191e-04 2.4791e-03 -6.0000e+00 5.1830e-03 3.1105e-02 -4.1638e-04 6.5911e-06 3.1085e-05 -6.0000e+00 3.8281e-04 4.1656e-03 3.7044e-05 11 8 0 10 0 0 99.87 22.67 0.23 0.00417 0.00104 1320 250 1 5 0 35.520 25.58 20.00 22.67 17.56 28.3 1054.39 -3356 -3870 -4595 -6125 -4699 -3940 -2985 -2263 -1601 -2799 -2210 -700 -678 -164 -93 -621 -789 -104 206 321 -143 807 1010 559 548 -114 -603 -918 474 1499 1335 1501 1289 -1107 -861 88 82 359 287 -692 -1279 -880 -1119 -849 -556 -381 -763 -537 -469 494 839 716 921 793 712 645 893 307 652 939 1552 1385 1232 586 -598 54 236 722 1428 911 32 -436 -830 -670 -814 -170 364 810 1411 344 72 -774 -1564 -1281 -1112 -1160 -843 -659 -595 -691 -170 318 502 1437 1585 1318 891 723 -415 -613 -485 -540 99 838 -51 -859 -433 -774 -147 -85 -158 -367 -317 -85 49 694 907 888 607 -196 -705 -482 -305 -326 224 238 611 1509 1061 469 508 23 322 220 260 -281 -196 110 -452 -470 -289 -268 -229 47 -257 -338 -427 -568 -399 -314 -241 -202 -160 -306 -248 -81 -86 -24 -15 -113 -157 -22 45 74 -34 193 245 132 139 -31 -167 -248 120 368 340 419 399 -348 -289 29 27 126 113 -326 -649 -455 -607 -470 -309 -212 -426 -296 -256 270 474 435 571 525 471 442 628 220 461 652 1075 1006 924 458 -498 45 191 555 1107 741 28 -414 -781 -622 -751 -150 303 622 1065 282 64 -748 -1544 -1350 -1191 -1277 -986 -779 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