File name: Pandora75s1_EssexMD_20240714_L2Fit_fout2c1d20221230p1-8.txt File generation date: 20240715T052315.0Z 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_20240714_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: 20240714 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 20240714T105734.0Z 8961.456643 70 1 50.53 2 79.17 70.92 153.00 349.83 0.00 1 0.00 1 0 17 4.763e-01 2.185e-02 3.394e-01 1.336e-02 6.248347e-01 7.932095e-03 8.263176e-03 -6.000000e+00 2.956368e-01 232.77 -2.00 3.48 -2.00 321.43 0.00e+00 5.078673e-03 3.969483e-03 7.524823e-03 -6.000000e+00 1.357448e-02 290.42 -2.00 20.00 -2.00 320.82 0.00e+00 5.122 0.002 302.00 328.00 3 3.2683e+00 2.8351e-02 7.1560e-02 -6.0000e+00 7.3994e-01 3.5750e-01 3.7001e-02 5.8800e-02 -6.0000e+00 7.9447e-01 -5.6594e-01 3.0309e-02 2.4532e-02 -6.0000e+00 4.7417e-01 2.3073e-01 1.4340e-02 4.9743e-03 -6.0000e+00 2.0285e-01 6.0904e-05 -1.4145e-03 4.3452e-04 1.4863e-04 -6.0000e+00 1.4719e-02 -3.4949e-02 1.0940e-04 12 9 8 11 16 0 64.47 23.57 1.26 -0.03495 -0.04558 21 3 1 5 0 2405.670 26.21 20.00 23.57 35.29 4.4 1060.74 -6303 900000 452 -147312 968 -144788 188879 -82444 -97766 -130093 -130486 9524 -111633 -136759 68531 52825 -65342 -32026 -564 31309 251621 15000 49382 19551 -55008 900000 100135 -22639 30124 46114 5938 24449 -6487 -699 59462 -19962 6372 86943 -10543 65704 5884 30272 3515 9271 95685 112709 13681 7117 9288 42480 8526 13206 2550 -739 813 10152 22412 12349 17469 18674 8801 16451 9462 11255 -1895 6902 3661 14164 6693 14536 6268 7544 6915 7412 6729 -9246 -3198 -5583 1958 -6900 -1347 -2882 -5690 470 -307 -1841 2182 1458 222 -2406 -2610 365 -4141 -2478 -3796 -2909 -286 -1453 -1872 -2767 338 -1935 662 -293 304 -4961 -1705 -2400 489 319 1283 1198 -469 41 -303 768 -597 -1004 700 882 2008 1879 2546 307 1794 -136 -1666 38 2466 752 -385 338 -1869 1114 -267 966 243 -144 -327 -711 -387 -797 -82 900000 6 -5437 13 -4401 2460 -1432 -2123 -4095 -4249 124 -3878 -7571 893 688 -2837 -1078 -16 667 3278 373 877 486 -2996 900000 1304 -885 678 928 204 811 -330 -36 1620 -1182 309 2162 -824 2801 509 2187 345 878 3853 3871 1280 725 957 3320 1020 1658 387 -124 141 1659 3291 1989 2607 2720 1459 2747 1894 2439 -489 1610 871 3432 1901 4298 2204 2732 2495 2520 2113 -3083 -941 -1702 612 -2750 -590 -1453 -3232 268 -189 -1223 1461 1011 156 -1671 -1704 217 -2498 -1517 -2611 -2281 -252 -1468 -2044 -3049 341 -1838 573 -258 282 -5157 -1825 -2788 605 438 1912 1875 -747 62 -444 1081 -862 -1523 1103 1436 3225 2942 3833 456 2519 -189 -2313 54 3833 1322 -748 694 -4143 2546 -658 2464 641 -386 -872 -1829 -941 -1852 SS 20240714T110804.9Z 8961.463945 73 1 51.72 2 77.24 72.45 153.29 355.25 0.00 1 0.00 1 0 17 3.231e-01 1.181e-02 5.096e-02 2.386e-03 5.608038e-01 1.327480e-03 6.806007e-03 -6.000000e+00 2.001117e-01 232.77 -2.00 3.48 -2.00 320.35 0.00e+00 2.609618e-03 4.983955e-04 3.104833e-03 -6.000000e+00 8.878156e-03 290.42 -2.00 20.00 -2.00 319.62 0.00e+00 4.404 0.001 302.00 328.00 3 2.5499e+00 4.0680e-03 5.4821e-02 -6.0000e+00 5.0157e-01 3.2832e-02 5.1083e-03 3.4815e-02 -6.0000e+00 5.3828e-01 -1.2926e-01 4.3802e-03 1.6529e-02 -6.0000e+00 3.2102e-01 4.5236e-02 2.2044e-03 4.2359e-03 -6.0000e+00 1.3695e-01 2.8049e-04 -1.1709e-03 7.2880e-05 6.9712e-05 -6.0000e+00 9.9640e-03 -3.6284e-02 1.6681e-04 12 8 8 10 0 0 30.01 23.57 0.74 -0.03628 -0.04508 69 11 1 5 0 749.510 26.32 20.00 23.57 36.31 4.3 1068.17 -129449 -103414 -76943 -84383 -133625 -84653 -60132 -113854 -112442 -113641 -99546 -103197 -71968 -39131 -49294 4591 -33555 -8219 9555 -2040 -769 11824 -1858 -166 -12079 -1397 950 -5066 6137 -25367 1803 -19676 -1019 -5437 -1943 6220 -15429 1934 -4676 -3401 59 4157 -1076 6596 5400 6797 5938 4161 6059 3740 3314 2705 7981 6520 2805 1450 498 3048 1884 232 1402 1801 1386 3749 115 -2435 -436 -393 2388 3649 2026 2109 1894 -682 28 -1666 -2336 -5021 -2330 -2841 -1567 -4748 -1525 -646 -20 440 1093 1784 1235 761 220 -1123 -259 -2490 -1945 -76 540 512 485 -417 -1000 -2663 -1487 -1206 -1634 -1154 -753 -100 464 998 1122 795 173 70 -119 -292 321 33 515 577 356 1043 1142 387 609 -307 -122 120 35 -48 -336 -688 -271 -395 -222 281 512 483 -39 212 -681 -628 -2218 -1619 -1009 -1196 -2911 -1092 -636 -2288 -2497 -2788 -2478 -2929 -1792 -874 -1502 97 -1179 -247 260 -66 -25 349 -65 -6 -540 -59 40 -224 238 -1417 87 -1373 -67 -402 -138 407 -1361 167 -522 -446 8 619 -178 1040 877 1109 993 724 1071 717 698 634 1939 1738 824 449 160 957 590 74 454 633 496 1443 48 -1024 -177 -163 1050 1790 1112 1214 1090 -385 15 -797 -1053 -2329 -1152 -1635 -1029 -3341 -1138 -511 -17 394 1022 1706 1188 710 194 -939 -206 -2072 -1766 -77 577 617 627 -542 -1240 -3092 -1605 -1310 -1894 -1413 -975 -138 643 1512 1718 1274 278 109 -187 -443 488 52 806 938 581 1654 1878 618 930 -456 -178 182 59 -82 -631 -1288 -531 -820 -460 609 1138 1092 -88 462 -1424 -1335 SS 20240714T111809.0Z 8961.470937 76 1 51.78 2 75.38 73.91 153.39 0.50 0.00 1 0.00 1 0 17 1.869e-01 7.780e-03 5.637e-02 2.084e-03 5.063582e-01 1.179824e-03 6.195863e-03 -6.000000e+00 1.157763e-01 232.77 -2.00 3.48 -2.00 320.51 0.00e+00 3.255415e-03 4.589042e-04 2.819649e-03 -6.000000e+00 5.136532e-03 290.43 -2.00 20.00 -2.00 319.78 0.00e+00 3.879 0.001 302.00 328.00 3 2.0849e+00 3.7252e-03 4.8892e-02 -6.0000e+00 2.9018e-01 6.8394e-03 4.6601e-03 3.1402e-02 -6.0000e+00 3.1142e-01 -5.9822e-02 3.9662e-03 1.5381e-02 -6.0000e+00 1.8573e-01 1.2048e-02 1.9848e-03 4.1232e-03 -6.0000e+00 7.9233e-02 7.7185e-04 -1.0461e-03 6.7433e-05 7.5817e-05 -6.0000e+00 5.7645e-03 -3.5936e-02 1.8739e-04 11 9 0 11 16 0 12.57 23.58 0.44 -0.03594 -0.04380 134 22 1 5 0 386.380 26.32 20.00 23.58 37.23 4.3 1074.40 -64746 -91062 -49966 -59204 -68459 -49009 -69233 -54671 -34006 -38105 -50136 -39004 -46377 -37291 -22169 -17113 -15723 -9877 -12528 -14750 -17515 -7670 -16735 -6975 -6861 -9088 -3716 -16988 -13525 -14007 -9620 -7181 -2167 -7951 -7484 -8492 -9379 -2417 -3136 -584 -987 1933 -824 -1291 1352 1237 3487 2876 2023 1164 2322 2513 2054 1088 1011 1498 1836 -385 1141 431 766 3040 2710 3509 2140 1466 -523 416 1692 1859 1782 1444 1278 725 -53 -1493 -2398 -3889 -2654 -2782 -1427 -1227 -1936 -1060 -352 192 927 1455 852 1208 857 66 -604 -1212 -816 -605 246 338 495 -640 -1167 -1856 -1423 -1122 -1337 -1225 -1090 -114 461 1057 750 523 217 -37 -587 82 62 182 677 143 408 721 777 559 142 -175 -336 283 32 -201 -493 -553 -542 151 14 201 444 399 269 -11 -269 -716 -646 -1396 -554 -722 -860 -489 -883 -667 -377 -479 -750 -569 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