File name: Pandora55s1_QueensNY_20240630_L2Fit_fout2c17d20220526p1-8.txt File generation date: 20240701T050720.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c17p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora55_OF_v5d20190723.txt Instrument calibration file used: Pandora55s1_CF_v17d20220526.txt Level 1 file used: Pandora55s1_QueensNY_20240630_L1_smca1c17d20220526p1-8.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: 20240630 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: 262 404 Nominal wavelengths inside fitting window [nm]: 305.1320 305.2720 305.4120 305.5520 305.6920 305.8320 305.9719 306.1119 306.2518 306.3917 306.5317 306.6716 306.8115 306.9514 307.0912 307.2311 307.3709 307.5108 307.6506 307.7905 307.9303 308.0701 308.2099 308.3496 308.4894 308.6292 308.7689 308.9087 309.0484 309.1881 309.3278 309.4675 309.6072 309.7469 309.8866 310.0262 310.1659 310.3055 310.4451 310.5847 310.7243 310.8639 311.0035 311.1431 311.2827 311.4222 311.5618 311.7013 311.8408 311.9803 312.1198 312.2593 312.3988 312.5383 312.6777 312.8172 312.9566 313.0960 313.2355 313.3749 313.5143 313.6536 313.7930 313.9324 314.0717 314.2111 314.3504 314.4897 314.6291 314.7684 314.9077 315.0469 315.1862 315.3255 315.4647 315.6040 315.7432 315.8824 316.0216 316.1608 316.3000 316.4392 316.5783 316.7175 316.8566 316.9958 317.1349 317.2740 317.4131 317.5522 317.6913 317.8303 317.9694 318.1085 318.2475 318.3865 318.5255 318.6645 318.8035 318.9425 319.0815 319.2205 319.3594 319.4984 319.6373 319.7762 319.9151 320.0540 320.1929 320.3318 320.4707 320.6095 320.7484 320.8872 321.0260 321.1649 321.3037 321.4425 321.5812 321.7200 321.8588 321.9975 322.1363 322.2750 322.4137 322.5524 322.6911 322.8298 322.9685 323.1072 323.2458 323.3845 323.5231 323.6617 323.8003 323.9389 324.0775 324.2161 324.3547 324.4932 324.6318 324.7703 324.9089 --------------------------------------------------------------------------------------- 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 20240630T115028.9Z 8947.493390 235 1 8.03 2 65.73 79.63 28.57 170.87 0.00 1 0.00 1 0 25 3.796e-02 7.959e-03 1.507e-02 3.763e-03 3.269914e-01 1.993997e-03 3.861427e-03 -6.000000e+00 2.297590e-02 232.90 -2.00 3.51 -2.00 317.68 0.00e+00 2.437841e-04 3.232998e-04 1.215800e-04 -6.000000e+00 1.022881e-03 288.23 -2.00 20.00 -2.00 316.84 0.00e+00 2.415 0.000 302.00 328.00 3 3.6029e+00 5.3537e-03 2.9771e-02 -6.0000e+00 5.7641e-02 -3.3164e-03 6.0187e-03 1.7255e-02 -6.0000e+00 6.2168e-02 1.8280e-04 3.6782e-03 8.3020e-03 -6.0000e+00 3.7004e-02 -2.9193e-03 1.8251e-03 2.2836e-03 -6.0000e+00 1.5569e-02 8.6803e-04 1.6348e-04 1.1637e-04 2.7710e-05 -6.0000e+00 1.1421e-03 1.3705e-02 0.0000e+00 12 9 1 12 5 1 95.89 22.85 0.26 0.01371 0.01493 5 7 1 5 0 1337.400 26.11 19.99 22.85 32.02 37.6 1100.00 -12317 22924 -23206 3148 -6636 -2210 13699 -159 -4621 -6937 -2145 -7722 -1199 4814 -525 5245 -946 5594 3040 -836 868 2791 -3728 -1897 -803 8802 -4759 864 -652 -1295 3053 1948 -562 -643 5648 -3793 -2248 820 78 -1710 -955 -2085 -2095 -1662 -88 -256 338 -282 956 -116 568 -991 2897 1015 270 2074 1664 1452 1009 1049 1040 51 86 -888 -609 601 31 67 973 886 58 242 -1046 253 -884 272 1539 609 120 -520 609 -1789 -876 -1674 -852 -547 -637 -412 -88 -301 -354 441 1052 688 1415 250 587 -113 -773 -565 -665 68 1253 488 -346 -872 -450 -331 387 416 -443 -410 -158 -56 402 580 1108 513 38 -935 -412 -1 134 122 -155 437 1349 525 122 296 351 574 -202 398 -353 -36 40 -436 -641 -191 -152 -423 493 -1097 1558 -2368 237 -516 -169 990 -15 -474 -748 -228 -943 -157 687 -88 897 -179 1046 607 -177 184 589 -864 -458 -201 2067 -1231 205 -153 -313 764 535 -166 -190 1547 -1149 -740 303 33 -813 -480 -1092 -1121 -891 -47 -136 178 -148 499 -63 320 -595 1773 652 179 1388 1127 981 678 708 724 38 67 -722 -493 464 24 50 771 756 52 223 -969 226 -759 217 1153 455 94 -443 554 -1763 -895 -1783 -941 -629 -756 -497 -105 -354 -399 468 1069 698 1488 282 707 -145 -1026 -746 -848 83 1472 586 -433 -1136 -602 -457 549 613 -677 -635 -240 -82 566 792 1503 714 54 -1405 -627 -2 200 178 -220 602 1805 708 170 432 531 885 -318 640 -587 -61 70 -771 -1138 -335 -262 -713 817 SS 20240630T120754.4Z 8947.505491 246 1 6.42 2 62.47 82.22 28.23 179.61 0.00 1 0.00 1 0 25 9.549e-03 6.336e-03 2.833e-03 1.050e-03 2.975468e-01 5.591511e-04 3.529580e-03 -6.000000e+00 5.781336e-03 232.90 -2.00 3.51 -2.00 316.94 0.00e+00 -3.434324e-05 7.410778e-05 9.993530e-05 -6.000000e+00 2.573050e-04 288.23 -2.00 20.00 -2.00 316.11 0.00e+00 2.152 0.000 302.00 328.00 3 1.3898e+00 1.4815e-03 2.6688e-02 -6.0000e+00 1.4504e-02 -6.2036e-03 1.6543e-03 1.5600e-02 -6.0000e+00 1.5641e-02 -5.3597e-03 9.6752e-04 7.5220e-03 -6.0000e+00 9.3103e-03 -1.1439e-03 4.5956e-04 2.0503e-03 -6.0000e+00 3.9191e-03 1.0751e-02 6.0652e-04 3.2425e-05 2.6124e-05 -6.0000e+00 2.8729e-04 1.1115e-02 0.0000e+00 12 1 1 12 5 1 56.88 22.85 0.21 0.01112 0.01567 50 76 1 5 0 125.700 26.11 20.01 22.85 32.67 37.7 1100.00 -1694 -2568 -4582 -2704 -837 -79 36 1572 -3279 -249 -289 1125 -517 934 -814 -485 -129 296 1109 -373 1532 1335 803 144 -287 -357 -338 -201 1504 1415 1657 977 -1308 -653 -66 354 -163 445 -623 -1324 -827 -1079 -1118 -666 -434 -1058 -916 -538 497 652 612 588 559 573 453 874 315 709 853 1540 1239 1253 611 -512 -105 311 423 1316 994 120 -355 -698 -448 -778 -165 268 401 998 215 163 -560 -1480 -1448 -980 -1132 -636 -491 -383 -612 37 387 674 1469 1552 1497 788 780 -407 -587 -411 -662 -97 731 -33 -827 -272 -848 -168 -159 -169 -497 -253 -255 -75 546 786 922 637 -13 -594 -274 -278 -356 29 171 373 1294 1032 369 615 32 321 214 317 -263 -56 99 -379 -503 -293 -208 -283 60 -217 -348 -620 -332 -102 -10 5 218 -514 -39 -46 193 -103 196 -195 -125 -35 83 322 -106 431 381 239 46 -97 -123 -113 -63 451 432 546 354 -480 -237 -25 135 -65 199 -316 -725 -487 -665 -705 -421 -274 -669 -569 -327 299 402 382 393 378 406 331 654 240 534 633 1141 961 1000 507 -450 -90 262 336 1040 819 106 -342 -671 -426 -740 -151 231 317 801 177 143 -535 -1503 -1512 -1038 -1283 -738 -579 -463 -736 44 443 733 1532 1597 1571 886 940 -508 -774 -535 -841 -117 843 -39 -1027 -345 -1133 -226 -219 -249 -749 -386 -378 -107 743 1043 1214 874 -18 -872 -399 -413 -515 42 234 501 1708 1367 504 871 47 483 320 494 -422 -92 162 -638 -852 -488 -343 -464 95 SS 20240630T121313.4Z 8947.509183 249 1 50.40 2 61.47 83.02 28.22 182.30 0.00 1 0.00 1 0 25 8.832e-03 5.936e-03 1.508e-03 5.270e-04 2.878407e-01 2.800027e-04 3.424856e-03 -6.000000e+00 5.346600e-03 232.90 -2.00 3.51 -2.00 317.10 0.00e+00 -3.110122e-05 3.852295e-05 9.337472e-05 -6.000000e+00 2.379896e-04 288.23 -2.00 20.00 -2.00 316.26 0.00e+00 2.083 0.000 302.00 328.00 3 2.0907e+00 7.4389e-04 2.5859e-02 -6.0000e+00 1.3414e-02 -6.0960e-03 8.3142e-04 1.5140e-02 -6.0000e+00 1.4466e-02 -1.3172e-03 4.8952e-04 7.3032e-03 -6.0000e+00 8.6106e-03 -3.2295e-03 2.3430e-04 1.9880e-03 -6.0000e+00 3.6238e-03 5.7800e-03 4.2264e-04 1.6313e-05 2.5113e-05 -6.0000e+00 2.6572e-04 1.2222e-02 0.0000e+00 11 1 0 11 4 0 99.98 22.85 0.19 0.01222 0.01540 356 67 1 5 0 141.540 26.11 20.01 22.85 33.00 37.7 1100.00 -2490 -1292 -4559 -2481 -130 -204 2018 583 -1005 -740 -91 267 -21 1199 -491 -713 -52 766 399 -342 869 1340 272 434 -130 -10 -676 -75 1249 1328 1749 1306 -1123 -945 211 -37 -215 444 -645 -1490 -1031 -1240 -1045 -874 -494 -1064 -603 -586 355 538 562 607 887 473 694 815 341 728 708 1288 1283 1255 545 -555 -213 171 366 1408 910 135 -78 -545 -444 -655 -175 199 583 1212 323 -71 -750 -1444 -1196 -1066 -943 -609 -389 -318 -464 -90 319 498 1242 1361 1199 861 741 -430 -503 -472 -570 -68 730 -13 -816 -352 -760 -61 -64 -91 -380 -296 -141 -119 497 781 740 708 -112 -559 -379 -297 -330 94 104 369 1337 914 420 514 13 328 92 305 -216 -87 201 -377 -443 -283 -298 -225 110 -312 -167 -596 -294 -14 -22 239 79 -148 -112 -14 44 -4 240 -112 -176 -12 191 104 -92 235 364 78 131 -42 -3 -215 -22 356 383 542 442 -388 -344 73 -13 -81 198 -326 -814 -605 -724 -622 -523 -295 -634 -351 -353 211 328 346 400 588 329 498 599 255 538 516 939 976 982 463 -477 -180 141 283 1081 762 121 -72 -528 -427 -605 -155 167 467 941 256 -63 -692 -1473 -1249 -1130 -1066 -706 -474 -384 -557 -107 366 543 1301 1402 1258 961 885 -550 -654 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