File name: Pandora75s1_EssexMD_20240805_L2Fit_fout2c1d20221230p1-8.txt File generation date: 20240821T141436.8Z 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_20240805_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: 20240805 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 20240805T111525.1Z 8983.469041 69 1 51.89 2 78.81 77.41 89.12 70.05 0.00 1 0.00 1 0 17 4.102e-01 1.319e-02 2.471e-01 7.354e-03 6.294750e-01 4.328904e-03 8.012287e-03 -6.000000e+00 2.542036e-01 232.02 -2.00 3.48 -2.00 321.39 0.00e+00 6.154787e-03 2.194820e-03 6.226767e-03 -6.000000e+00 1.145177e-02 290.96 -2.00 20.00 -2.00 320.77 0.00e+00 4.971 0.002 302.00 328.00 3 2.7653e+00 1.5588e-02 6.6715e-02 -6.0000e+00 6.3518e-01 2.0924e-01 2.1130e-02 5.1145e-02 -6.0000e+00 6.8223e-01 -2.9659e-01 1.9160e-02 2.5084e-02 -6.0000e+00 4.0664e-01 1.0826e-01 9.0455e-03 6.2874e-03 -6.0000e+00 1.7337e-01 1.1609e-04 -1.6081e-03 2.3650e-04 1.4948e-04 -6.0000e+00 1.2648e-02 -3.1256e-02 1.1298e-04 12 9 8 11 24 0 9.78 23.61 0.80 -0.03126 -0.04334 35 6 1 5 0 1482.570 26.32 19.99 23.61 34.42 4.6 1052.14 -138754 -88783 -128150 -141869 -102007 900000 -97092 -161983 -125398 -149546 -162525 -130413 -56653 -53471 -104729 -16849 1016 11033 74899 19291 -18891 13144 -38105 -27919 -55317 -5132 -27057 7309 25105 -19769 -19937 -26714 -3064 2247 -681 -6212 3142 -16941 4662 2385 4585 14835 5120 5925 2519 7050 -898 10791 2990 7489 9325 3294 462 -5577 13715 7138 11680 1551 -2335 3801 -5705 8102 5610 6319 6217 6167 -6301 6912 4662 4228 5671 3706 3199 2142 -2534 -1319 2580 -4697 326 -3261 737 -1745 -2890 -1202 -352 -2039 661 701 -855 2498 627 1930 -695 -569 -2384 -1148 4 397 -197 -1741 -1760 -2763 -1127 -502 -885 -3090 -873 -248 -153 899 1111 1105 -61 -142 -798 -593 83 -318 1783 795 346 1724 1493 165 441 -269 -9 310 -38 -1013 -704 -364 -623 487 -464 487 223 1116 -161 551 -987 -966 -1492 -690 -1608 -2034 -914 900000 -812 -2806 -1798 -2924 -3813 -2465 -628 -732 -3003 -242 14 151 586 277 -406 206 -1018 -710 -1947 -114 -758 143 409 -541 -637 -1079 -112 83 -26 -247 123 -938 249 154 326 1025 410 487 218 597 -84 928 290 816 1096 456 72 -996 2134 1228 1959 287 -440 670 -1149 1557 1243 1540 1591 1565 -1798 1784 1343 1382 2004 1395 1199 769 -875 -409 723 -1438 105 -1279 323 -890 -1632 -713 -221 -1389 459 501 -619 1687 404 1156 -414 -350 -1658 -907 3 404 -217 -1943 -1855 -2696 -1011 -450 -845 -3199 -940 -286 -193 1246 1679 1750 -98 -220 -1186 -852 120 -481 2791 1299 565 2701 2268 245 625 -371 -13 443 -60 -1811 -1368 -752 -1362 1119 -1145 1247 588 2954 -429 1399 -2411 -2249 SS 20240805T112111.8Z 8983.473053 72 1 51.31 2 77.72 78.28 88.12 70.94 0.00 1 0.00 1 0 17 3.240e-01 9.375e-03 1.772e-01 4.591e-03 5.862452e-01 2.623521e-03 7.163085e-03 -6.000000e+00 1.999429e-01 232.02 -2.00 3.48 -2.00 321.04 0.00e+00 2.772469e-03 1.230391e-03 4.184901e-03 -6.000000e+00 8.920019e-03 290.96 -2.00 20.00 -2.00 320.40 0.00e+00 4.563 0.002 302.00 328.00 3 2.5567e+00 8.9721e-03 5.8799e-02 -6.0000e+00 5.0010e-01 7.8644e-02 1.1932e-02 4.1110e-02 -6.0000e+00 5.3710e-01 -1.3626e-01 1.0876e-02 1.8647e-02 -6.0000e+00 3.2064e-01 4.1988e-02 5.2511e-03 4.5834e-03 -6.0000e+00 1.3694e-01 2.2815e-04 -1.3863e-03 1.4486e-04 9.6926e-05 -6.0000e+00 9.9905e-03 -3.0724e-02 1.3277e-04 12 9 8 11 16 0 20.77 23.61 0.75 -0.03072 -0.04114 53 9 1 5 0 967.940 26.32 20.01 23.61 34.84 4.6 1055.14 -101782 -112074 -107170 -58396 -105075 -123440 -41647 -107688 -57439 -139209 -73638 -101170 -54992 -64397 -69131 21927 -44111 -9583 -41187 -40109 -38253 6723 -32916 -16597 -14292 -16347 -18262 -14299 29482 -22100 -28042 -8000 6197 -3945 -18636 2329 -9742 -3295 -20547 9444 -1088 23310 -3271 -1437 1502 4649 -2372 -7333 72 -895 6151 5112 7962 125 8417 1672 1934 2665 -1089 3459 -1197 4593 6292 6343 613 1880 1029 2633 2695 1430 2091 1846 2317 1366 536 -1893 -3514 -5208 -585 -2188 -2444 -886 -663 -924 -167 62 -75 1309 547 1000 -138 -195 -791 -2399 -707 -1109 808 812 -656 -284 -1491 -1188 -1586 -1051 -1808 -1728 -501 169 309 1078 727 471 770 -699 -191 -302 463 135 262 467 344 774 551 547 608 75 -341 -7 -290 207 -812 -274 -827 42 -139 33 683 550 192 -245 -158 -729 -721 -1045 -1134 -380 -1026 -1407 -220 -1227 -444 -2663 -779 -1564 -649 -1048 -1463 223 -987 -168 -1073 -1094 -1059 120 -911 -419 -378 -466 -543 -401 528 -701 -1084 -296 227 -172 -933 95 -488 -181 -1622 723 -105 1899 -366 -163 168 514 -287 -955 9 -121 851 792 1312 24 1586 351 416 569 -238 717 -270 1065 1605 1783 191 569 310 805 899 546 871 807 1003 568 207 -681 -1205 -1832 -217 -957 -1241 -501 -409 -611 -118 46 -59 1043 439 770 -101 -133 -526 -1666 -533 -960 787 892 -782 -336 -1687 -1231 -1551 -1033 -1901 -1923 -585 210 419 1600 1177 797 1293 -1147 -297 -452 695 212 434 802 590 1288 890 850 906 109 -488 -11 -480 378 -1623 -527 -1681 89 -317 78 1660 1358 471 -582 -357 -1587 SS 20240805T112627.4Z 8983.476706 75 1 51.33 2 76.72 79.07 87.19 71.75 0.00 1 0.00 1 0 17 3.086e-01 8.575e-03 8.920e-02 3.125e-03 5.531204e-01 1.781200e-03 6.612704e-03 -6.000000e+00 1.904510e-01 232.02 -2.00 3.48 -2.00 320.81 0.00e+00 3.404181e-03 7.654554e-04 2.786427e-03 -6.000000e+00 8.495609e-03 290.96 -2.00 20.00 -2.00 320.12 0.00e+00 4.244 0.001 302.00 328.00 3 2.3243e+00 5.7702e-03 5.2877e-02 -6.0000e+00 4.7636e-01 4.9956e-02 7.4796e-03 3.3160e-02 -6.0000e+00 5.1158e-01 -9.5644e-02 6.6762e-03 1.6901e-02 -6.0000e+00 3.0540e-01 2.8082e-02 3.2887e-03 4.8354e-03 -6.0000e+00 1.3045e-01 4.0245e-04 -1.4489e-03 1.0008e-04 7.7593e-05 -6.0000e+00 9.5147e-03 -3.1253e-02 1.5473e-04 11 9 0 11 24 0 7.37 23.61 0.73 -0.03125 -0.04214 78 13 1 5 0 658.020 26.32 20.00 23.61 35.18 4.6 1057.51 -143447 -58813 -111837 -97050 -98655 -99564 -104054 -84688 -88927 -88235 -63671 -109872 -41962 -66342 -17701 -14790 -30994 -16658 -7397 -4106 -32655 -2774 -36681 -11209 -18623 -10980 -7007 -21436 -10817 -25529 -614 -8953 3203 -10693 3488 -8922 -7439 -8195 2378 -3655 4229 3989 2094 6461 6106 4262 -3316 -898 2565 5373 779 4603 3508 2962 3975 2426 3876 -1886 840 3027 1374 2741 3078 4084 1151 1615 -1200 1107 1121 1857 1529 1086 1424 874 650 -1873 -1861 -3388 -954 -2464 -415 -2828 -1303 -1512 -1148 -101 783 1998 217 1551 -322 397 -1066 -1936 -1149 -425 1057 430 89 -450 -833 -1520 -757 -1129 -741 -1463 -682 -303 -122 1018 370 885 96 -187 -593 -49 315 265 956 6 523 713 864 654 344 -135 -482 397 113 -234 -543 -360 -460 113 -136 97 260 493 -35 -61 -160 -574 -2185 -456 -1611 -1210 -1175 -1158 -1326 -985 -1207 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