File name: Pandora206s1_BuffaloNY_20231219_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T071210.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: Kang Sun Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 206 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora206_OF_v3d20211008.txt Instrument calibration file used: Pandora206s1_CF_v4d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20231219_L1_smca1c4d20220512p1-8.txt Full location name: University at Buffalo Short location name: BuffaloNY Country of location: Canada Location latitude [deg]: 43.0015 Location longitude [deg]: -78.7869 Location altitude [m]: 190 Local noon date: 20231219 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: 223 365 Nominal wavelengths inside fitting window [nm]: 305.0744 305.2154 305.3564 305.4973 305.6383 305.7792 305.9201 306.0611 306.2020 306.3428 306.4837 306.6246 306.7654 306.9063 307.0471 307.1879 307.3287 307.4695 307.6103 307.7511 307.8918 308.0326 308.1733 308.3140 308.4548 308.5955 308.7362 308.8768 309.0175 309.1582 309.2988 309.4394 309.5801 309.7207 309.8613 310.0019 310.1424 310.2830 310.4236 310.5641 310.7046 310.8451 310.9857 311.1261 311.2666 311.4071 311.5476 311.6880 311.8285 311.9689 312.1093 312.2497 312.3901 312.5305 312.6708 312.8112 312.9515 313.0919 313.2322 313.3725 313.5128 313.6531 313.7934 313.9336 314.0739 314.2141 314.3543 314.4946 314.6348 314.7750 314.9151 315.0553 315.1955 315.3356 315.4758 315.6159 315.7560 315.8961 316.0362 316.1763 316.3163 316.4564 316.5964 316.7364 316.8765 317.0165 317.1565 317.2964 317.4364 317.5764 317.7163 317.8563 317.9962 318.1361 318.2760 318.4159 318.5558 318.6956 318.8355 318.9753 319.1152 319.2550 319.3948 319.5346 319.6744 319.8141 319.9539 320.0937 320.2334 320.3731 320.5128 320.6525 320.7922 320.9319 321.0716 321.2112 321.3509 321.4905 321.6301 321.7697 321.9093 322.0489 322.1885 322.3280 322.4676 322.6071 322.7467 322.8862 323.0257 323.1652 323.3046 323.4441 323.5836 323.7230 323.8624 324.0018 324.1413 324.2806 324.4200 324.5594 324.6988 324.8381 324.9774 --------------------------------------------------------------------------------------- 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: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Temperature at electronics board 1 [°C], 999=no temperature signal Column 98: Temperature at electronics board 2 [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: 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 20231219T172106.6Z 8753.722993 182 1 24.01 2 66.45 182.22 92.09 93.47 0.00 1 0.00 1 0 17 2.708e-01 2.913e-02 2.588e-01 2.119e-02 3.832167e-01 1.052688e-02 4.514492e-03 -6.000000e+00 1.495769e-01 222.46 -2.00 3.55 -2.00 319.10 0.00e+00 3.047913e-03 2.508287e-03 5.724065e-04 -6.000000e+00 6.980797e-03 274.10 -2.00 20.00 -2.00 318.55 0.00e+00 2.484 0.000 302.00 328.00 3 7.4867e+00 2.8742e-02 3.1236e-02 -6.0000e+00 3.6841e-01 1.3514e-01 3.3481e-02 2.0464e-02 -6.0000e+00 4.0350e-01 3.2663e-02 2.6585e-02 9.9048e-03 -6.0000e+00 2.3902e-01 -2.1991e-02 1.4304e-02 4.2623e-03 -6.0000e+00 1.0255e-01 1.4642e-05 -6.3470e-04 5.9636e-04 3.5433e-05 -6.0000e+00 6.9794e-03 -1.0974e-02 4.4647e-05 12 8 8 10 0 0 -8.00 17.85 1.58 -0.01097 -0.01574 6 6 2 8 0 4000.000 14.99 17.85 4.75 21.38 21.27 18.7 911.32 -18057 900000 152366 78305 100022 900000 17285 119715 17155 125970 900000 13864 15965 42524 35385 36808 81652 18895 37292 10292 43044 -15154 48599 20748 4608 -12118 -3930 -15143 -6360 40998 -10593 900000 8411 24561 2260 -53274 -2542 20319 10170 1105 -6236 -2936 8644 -3805 6913 -6897 -2257 -25489 8677 1605 7472 -1044 2610 3819 -1930 5933 -2197 1863 -1125 -1729 -678 12020 -495 4130 2659 3237 -6836 2402 285 -1542 4481 -647 2953 2285 4129 -4065 3373 -3051 -5285 -5679 3002 662 -3430 -174 -1087 5492 -3004 2421 -422 4931 -544 3400 -3869 -2328 -2051 -2222 1990 -341 2115 200 1706 -2086 1081 -3288 2991 -4924 1190 1 -337 -1109 1829 360 -1593 -1123 -2156 1237 -3018 -1080 -1592 1946 -1408 805 1384 2341 976 2407 -1543 -975 2545 -2458 2272 -1377 359 -991 2473 87 293 1493 2371 -371 -1156 -3468 -480 -603 900000 3147 1617 2066 900000 433 2472 537 2602 900000 503 679 1677 1741 2057 3219 1446 2514 950 2928 -1762 3159 1903 521 -1645 -513 -2097 -761 3233 -1525 900000 1252 3282 349 -13549 -443 3271 2193 300 -2009 -960 2627 -1332 2178 -2527 -786 -11130 2778 562 2669 -429 1100 1697 -942 2724 -1117 901 -561 -858 -344 5848 -293 2551 1685 1944 -4183 1363 177 -1089 3263 -514 2242 1661 2789 -2652 1862 -1739 -3310 -4122 2266 571 -3207 -164 -1108 5600 -3490 2739 -491 5199 -556 3151 -3570 -2082 -1981 -2346 2263 -446 2875 271 2114 -2439 1163 -3807 3548 -6424 1527 1 -491 -1764 3025 600 -2615 -1766 -3148 1690 -4188 -1534 -2431 3027 -2271 1235 2053 3375 1351 3140 -1985 -1272 3511 -3857 3619 -2289 599 -1746 4489 169 579 2973 4681 -722 -2161 -6336 -852 SS 20231219T182911.7Z 8753.770274 220 1 0.31 2 68.74 198.93 79.97 104.69 0.00 1 0.00 1 0 17 7.842e-02 1.368e-02 1.125e-01 1.134e-02 4.090725e-01 5.526469e-03 4.865128e-03 -6.000000e+00 4.300656e-02 222.46 -2.00 3.55 -2.00 318.92 0.00e+00 2.789151e-04 1.261489e-03 3.567955e-04 -6.000000e+00 1.871976e-03 274.09 -2.00 20.00 -2.00 318.35 0.00e+00 2.733 0.000 302.00 328.00 3 2.1971e+00 1.5029e-02 3.3758e-02 -6.0000e+00 1.0594e-01 1.8168e-02 1.7363e-02 2.0886e-02 -6.0000e+00 1.1582e-01 -1.3439e-02 1.3008e-02 1.0486e-02 -6.0000e+00 6.8909e-02 -3.3452e-03 6.9453e-03 3.1303e-03 -6.0000e+00 2.9418e-02 2.4739e-03 4.4672e-04 3.1021e-04 3.0867e-05 -6.0000e+00 1.9963e-03 -1.1658e-02 1.1700e-04 12 9 9 12 1 1 999.00 17.86 0.38 -0.01166 -0.00830 1 92 2 8 0 154.070 15.00 17.86 5.33 21.38 21.27 18.5 913.89 -38315 -1367 -28831 6841 16299 -17421 14837 -29703 7625 -10128 43750 -24889 6463 -16586 2886 -13251 1390 -8038 -5044 104 1676 10633 8295 6461 -7967 3953 -5301 -2054 -13273 -2180 118 -1842 -5169 -3502 751 -3540 1296 493 5779 -2939 1374 -3702 2452 -2054 923 -1861 2453 846 457 2936 1501 5742 354 6366 -571 214 721 3268 1453 2623 2768 4038 1391 1321 707 845 302 -884 -14757 -116 1615 -479 651 608 1079 -1389 -54 -2083 664 -382 -693 -1677 -1890 -214 -1215 -56 11 885 -449 4 58 -595 1003 241 1107 1130 1549 1127 1701 -75 -607 -1081 -953 -306 -532 -660 -1067 -521 218 360 89 1180 -572 71 -1349 507 143 226 12 -816 106 -294 -495 990 1140 -171 648 -599 625 -99 1396 -97 -926 -101 175 -37 90 166 274 495 184 -923 -771 -1496 -43 -1215 198 378 -553 370 -1314 264 -452 1177 -1367 309 -1158 204 -1223 119 -806 -519 11 173 1020 849 710 -1077 500 -746 -272 -1842 -278 17 -284 -927 -651 124 -598 232 104 1420 -912 451 -1305 847 -751 327 -685 886 310 169 1089 597 2390 162 3025 -295 112 388 1699 747 1316 1432 2248 857 868 473 540 186 -547 -11061 -86 1266 -399 531 471 786 -950 -35 -1319 431 -282 -571 -1525 -1803 -210 -1264 -60 12 1016 -522 5 60 -590 937 226 1094 1229 1848 1454 2271 -99 -773 -1316 -1100 -355 -660 -841 -1431 -720 312 549 143 1926 -922 109 -1985 707 201 326 18 -1291 169 -460 -758 1458 1628 -243 889 -836 930 -155 2293 -164 -1596 -178 322 -71 173 325 538 948 337 -1671 -1387 SS 20231219T184227.3Z 8753.779482 228 1 45.92 2 69.59 202.05 77.66 106.97 0.00 1 0.00 1 0 25 6.175e-02 4.889e-03 4.334e-02 2.871e-03 4.169582e-01 1.423887e-03 4.913300e-03 -6.000000e+00 3.387011e-02 222.46 -2.00 3.55 -2.00 319.90 0.00e+00 1.735473e-03 4.221165e-04 2.404974e-04 -6.000000e+00 1.474014e-03 274.09 -2.00 20.00 -2.00 319.35 0.00e+00 2.839 0.000 302.00 328.00 3 3.6652e+00 4.0421e-03 3.4922e-02 -6.0000e+00 8.3434e-02 -5.2271e-03 4.8099e-03 2.1589e-02 -6.0000e+00 9.1208e-02 2.6289e-02 4.0702e-03 1.0964e-02 -6.0000e+00 5.4268e-02 -1.7285e-02 2.1432e-03 3.8968e-03 -6.0000e+00 2.3169e-02 5.0752e-04 2.8924e-04 8.2250e-05 3.8866e-05 -6.0000e+00 1.5719e-03 -1.0808e-02 1.8467e-04 10 0 0 10 0 0 99.99 17.86 0.36 -0.01081 -0.00863 638 197 2 8 0 71.850 15.00 17.86 5.81 21.38 21.27 18.7 918.07 14014 -22915 -9787 -32763 -30988 -21309 -35582 -1382 -6636 -6254 -5840 -14260 160 -1412 3909 377 6607 703 -1211 2100 -4874 -1368 -3250 -4503 1753 -2593 2478 2771 1962 2975 -563 3217 -3584 -1194 -4901 -4967 -277 -899 962 1023 -458 -349 -722 -890 -1548 -889 433 -2523 -192 -796 554 1482 1083 1777 979 1550 653 626 129 35 1247 959 1665 1396 -85 299 -840 551 715 682 1133 105 432 -92 4 -1155 -810 -900 -216 -74 -641 -391 -1372 -1692 -1236 -1010 -245 -248 131 550 695 922 632 554 895 328 667 716 438 70 27 -416 -612 -85 -978 -968 -859 -644 -166 98 525 303 115 97 -430 -67 16 -96 -124 -50 -308 -75 295 208 730 394 356 856 375 85 54 -132 -345 -151 -25 -137 -13 304 -114 23 95 -215 -219 193 -519 -207 -834 -686 -418 -870 -27 -155 -158 -147 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