File name: Pandora206s1_BuffaloNY_20231114_L2Fit_fout2c1d20220512p1-8.txt File generation date: 20231115T075629.4Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Kang Sun Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 206 Spectrometer number: 1 Processing software version used: BlickP v1.8.49 Instrument operation file used: Pandora206_OF_v3d20211008.txt Instrument calibration file used: Pandora206s1_CF_v1d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20231114_L1_smca1c1d20220512p1-8.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: 20231114 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]: 305.0398 305.1808 305.3218 305.4628 305.6038 305.7447 305.8857 306.0266 306.1675 306.3084 306.4493 306.5902 306.7311 306.8720 307.0128 307.1537 307.2945 307.4353 307.5761 307.7169 307.8577 307.9985 308.1393 308.2800 308.4207 308.5615 308.7022 308.8429 308.9836 309.1243 309.2649 309.4056 309.5462 309.6869 309.8275 309.9681 310.1087 310.2493 310.3899 310.5305 310.6710 310.8116 310.9521 311.0926 311.2331 311.3736 311.5141 311.6546 311.7950 311.9355 312.0759 312.2164 312.3568 312.4972 312.6376 312.7779 312.9183 313.0587 313.1990 313.3394 313.4797 313.6200 313.7603 313.9006 314.0408 314.1811 314.3214 314.4616 314.6018 314.7421 314.8823 315.0225 315.1626 315.3028 315.4430 315.5831 315.7232 315.8634 316.0035 316.1436 316.2837 316.4238 316.5638 316.7039 316.8439 316.9839 317.1240 317.2640 317.4040 317.5439 317.6839 317.8239 317.9638 318.1038 318.2437 318.3836 318.5235 318.6634 318.8033 318.9431 319.0830 319.2228 319.3627 319.5025 319.6423 319.7821 319.9219 320.0616 320.2014 320.3412 320.4809 320.6206 320.7603 320.9000 321.0397 321.1794 321.3191 321.4587 321.5984 321.7380 321.8776 322.0172 322.1568 322.2964 322.4360 322.5755 322.7151 322.8546 322.9941 323.1336 323.2731 323.4126 323.5521 323.6916 323.8310 323.9705 324.1099 324.2493 324.3887 324.5281 324.6675 324.8069 324.9462 --------------------------------------------------------------------------------------- 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 20231114T163930.1Z 8718.694098 151 1 24.00 2 61.46 174.57 71.75 159.99 0.00 1 0.00 1 0 17 1.204e-01 2.529e-02 1.365e-01 2.043e-02 2.758349e-01 9.891715e-03 3.416570e-03 -6.000000e+00 6.614063e-02 222.79 -2.00 3.55 -2.00 318.26 0.00e+00 6.380652e-03 1.870135e-03 6.384840e-04 -6.000000e+00 2.920171e-03 277.86 -2.00 20.00 -2.00 317.63 0.00e+00 2.083 0.000 302.00 328.00 3 7.6495e+00 2.6461e-02 2.5354e-02 -6.0000e+00 1.6284e-01 7.3880e-02 3.0171e-02 1.7576e-02 -6.0000e+00 1.7787e-01 6.4770e-02 2.0386e-02 7.5024e-03 -6.0000e+00 1.0604e-01 -3.4045e-02 1.0792e-02 5.8710e-03 -6.0000e+00 4.5383e-02 2.1838e-05 -1.3296e-03 5.7152e-04 4.4947e-05 -6.0000e+00 3.0674e-03 1.3530e-02 -1.6363e-04 12 8 8 10 0 0 -61.15 17.98 2.43 0.01353 0.00354 6 6 2 8 0 4000.000 14.99 17.98 14.43 21.48 21.38 19.2 948.18 -16664 75502 63060 22153 15597 49170 22247 6008 -3442 17143 13569 30263 24316 18940 5073 -8995 31018 11223 7828 -7534 12994 -11779 -4546 555 5332 -2637 3859 -5581 -421 14312 10790 2030 4397 13572 -983 -9046 699 1920 6652 -7656 -1615 -7289 1700 -1556 4884 -721 -6051 -15973 -644 1501 339 -53 -4611 2737 6045 538 -1157 -2176 -813 -1280 -1743 1242 -1269 4745 -3130 1921 -407 -1045 2751 -2568 736 -1423 1781 23144 3151 -605 11 -51 -3711 -4727 -3276 2774 -1957 -673 476 5001 -980 -7 765 2067 266 -1526 -2816 -1500 -1610 -2140 1444 2127 1562 616 1826 -717 -1098 -1769 335 -2154 -1224 -21 -349 815 954 109 -1851 324 -3343 2172 -1530 -2446 -539 1625 -653 -1264 1756 -2545 2144 2075 -929 3722 2625 -2166 2202 -1748 -552 -779 934 -411 -553 1093 1636 1124 160 -1841 -1247 -1167 2444 2434 1227 806 1769 1053 363 -251 1067 853 1658 1665 1639 597 -1347 3398 1579 1162 -1360 2014 -2218 -801 99 933 -515 716 -1084 -73 2183 1874 421 983 2906 -224 -2151 165 514 2025 -3059 -684 -3300 758 -733 2174 -345 -3028 -8681 -296 677 164 -28 -2658 1549 3398 321 -714 -1345 -485 -766 -1089 818 -940 3577 -2562 1369 -276 -692 1851 -2085 634 -1302 1572 15819 2440 -435 8 -32 -2568 -3655 -2810 2481 -1957 -689 517 5563 -1179 -9 940 2481 299 -1589 -2708 -1416 -1569 -2333 1694 2773 2179 847 2317 -855 -1220 -2042 414 -2870 -1687 -30 -526 1257 1558 183 -3020 495 -4843 2784 -2034 -3425 -795 2505 -1048 -2001 2633 -3799 2976 2752 -1200 4616 3555 -3190 3275 -2783 -881 -1290 1619 -759 -1042 2076 3109 2075 286 -3241 -2122 SS 20231114T172216.4Z 8718.723801 174 1 26.85 2 61.51 186.13 69.86 169.70 0.00 1 0.00 1 0 17 1.063e-02 5.323e-03 9.269e-03 2.294e-03 2.742600e-01 1.114247e-03 3.359794e-03 -6.000000e+00 5.841238e-03 222.79 -2.00 3.55 -2.00 317.83 0.00e+00 4.485847e-04 1.837525e-04 7.351492e-05 -6.000000e+00 2.577488e-04 277.85 -2.00 20.00 -2.00 317.18 0.00e+00 2.086 0.000 302.00 328.00 3 4.4633e+00 2.9474e-03 2.4656e-02 -6.0000e+00 1.4381e-02 -1.9666e-03 3.3450e-03 1.4015e-02 -6.0000e+00 1.5706e-02 8.0149e-03 2.1095e-03 7.0033e-03 -6.0000e+00 9.3631e-03 -5.6839e-03 1.0829e-03 2.0453e-03 -6.0000e+00 4.0093e-03 5.7589e-04 -1.4202e-04 6.3805e-05 2.1557e-05 -6.0000e+00 2.7068e-04 1.1913e-02 -7.1061e-05 10 0 0 10 0 0 99.59 17.99 0.08 0.01191 0.01085 41 41 2 8 0 654.740 15.00 17.99 16.37 21.48 21.38 19.4 961.12 -3727 -1569 -2137 -2540 235 866 -4605 2371 467 338 350 -2523 -1493 -785 914 -156 704 105 -957 -532 431 -201 790 897 557 -1216 12 40 -733 1118 547 1753 737 1186 -4378 -2855 -2143 -1389 -917 -680 224 -1633 -570 -663 -45 -570 -867 -930 -138 -454 999 433 1093 742 761 1159 924 592 363 629 1054 1499 1228 1885 629 -46 -411 -290 133 189 644 237 460 324 426 -263 -32 -1110 -317 -909 -529 -654 -1873 -1484 -937 -559 -187 -63 568 228 448 329 12 199 385 -294 388 473 360 -10 -263 -778 -670 -357 -774 -803 -619 -426 -138 202 264 504 119 77 -211 68 -144 243 -215 192 -243 3 40 282 554 313 192 1085 851 480 365 44 -78 7 187 -157 -105 184 -151 -219 -184 -323 -530 -312 -142 -201 -226 18 62 -371 199 45 35 35 -266 -178 -107 141 -27 127 20 -191 -110 90 -41 165 200 131 -304 3 9 -158 235 124 425 198 331 -1187 -739 -608 -453 -347 -304 109 -840 -290 -353 -24 -302 -453 -475 -69 -227 525 247 631 456 483 745 609 389 233 400 689 1052 912 1497 505 -35 -294 -202 98 154 575 215 428 290 354 -203 -23 -768 -229 -727 -458 -630 -1886 -1550 -1015 -648 -227 -77 689 275 511 344 12 191 393 -324 459 606 489 -13 -339 -926 -768 -424 -983 -1038 -837 -604 -199 310 418 805 183 113 -294 91 -194 332 -318 293 -379 5 60 414 766 428 249 1406 1196 702 564 68 -123 12 316 -280 -187 333 -276 -388 -323 -547 -904 SS 20231114T172744.8Z 8718.727602 176 1 2.80 2 61.63 187.60 69.71 170.96 0.00 1 0.00 1 0 17 1.299e-02 5.804e-03 7.742e-03 2.335e-03 2.724285e-01 1.136175e-03 3.346506e-03 -6.000000e+00 7.138541e-03 222.79 -2.00 3.55 -2.00 317.39 0.00e+00 3.539304e-04 1.678099e-04 6.367066e-05 -6.000000e+00 3.149746e-04 277.85 -2.00 20.00 -2.00 316.74 0.00e+00 2.094 0.000 302.00 328.00 3 2.4692e+00 2.9787e-03 2.4652e-02 -6.0000e+00 1.7575e-02 -1.6754e-02 3.3680e-03 1.3897e-02 -6.0000e+00 1.9194e-02 4.4648e-03 2.0612e-03 6.9358e-03 -6.0000e+00 1.1442e-02 -3.3361e-03 1.0378e-03 2.0155e-03 -6.0000e+00 4.9001e-03 4.2522e-03 -5.4834e-05 6.4267e-05 2.1659e-05 -6.0000e+00 3.3077e-04 1.1055e-02 -8.5287e-05 12 1 1 12 1 1 -152.60 17.99 0.31 0.01106 0.01064 14 145 4 8 0 186.490 15.00 17.99 16.83 21.48 21.38 19.5 964.13 -4212 -2239 -2495 -5553 -2628 -4552 -1864 -3198 1248 -2938 -2499 -4629 -1218 -2981 297 -527 -725 -57 893 1165 600 772 -453 2372 -771 832 108 304 -1239 1151 1169 1259 2375 -135 -1347 -2824 -1671 -1950 603 -1280 8 -659 -313 -946 25 -339 -296 -296 -274 434 517 1422 459 1403 84 1256 905 805 462 35 892 1371 1202 1297 106 -359 123 -415 798 186 231 -4 51 386 401 -300 -192 87 224 -408 -731 -1003 -2359 -1400 -1416 -666 -403 -195 187 331 628 121 504 395 469 -50 614 375 299 -345 -346 -679 -722 240 -973 -585 -713 -325 -322 241 73 13 202 315 -127 373 15 409 50 -116 -307 -203 338 281 807 358 705 1014 736 418 505 147 -193 159 233 -174 -59 38 -304 -218 -326 -407 -577 -424 -244 -282 -627 -251 -424 -180 -351 147 -386 -320 -616 -178 -496 55 -110 -158 -13 208 281 149 188 -114 621 -212 235 31 84 -320 288 314 364 745 -44 -421 -868 -544 -737 261 -648 4 -368 -180 -553 14 -197 -168 -164 -150 236 300 878 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