File name: Pandora55s1_QueensNY_20210114_L2Fit_fout2c11d20210101p1-8.txt File generation date: 20260625T174407.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c11p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora55_OF_v4d20190723.txt Instrument calibration file used: Pandora55s1_CF_v11d20210101.txt Level 1 file used: Pandora55s1_QueensNY_20210114_L1_smca1c11d20210101p1-8.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: 20210114 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: 261 404 Nominal wavelengths inside fitting window [nm]: 305.0145 305.1546 305.2946 305.4346 305.5746 305.7145 305.8545 305.9945 306.1344 306.2744 306.4143 306.5542 306.6941 306.8340 306.9739 307.1138 307.2536 307.3935 307.5333 307.6732 307.8130 307.9528 308.0926 308.2324 308.3722 308.5120 308.6517 308.7915 308.9312 309.0710 309.2107 309.3504 309.4901 309.6298 309.7695 309.9091 310.0488 310.1884 310.3281 310.4677 310.6073 310.7469 310.8865 311.0261 311.1657 311.3053 311.4448 311.5844 311.7239 311.8634 312.0029 312.1424 312.2819 312.4214 312.5609 312.7003 312.8398 312.9792 313.1187 313.2581 313.3975 313.5369 313.6763 313.8156 313.9550 314.0944 314.2337 314.3730 314.5124 314.6517 314.7910 314.9303 315.0695 315.2088 315.3481 315.4873 315.6265 315.7658 315.9050 316.0442 316.1834 316.3226 316.4617 316.6009 316.7401 316.8792 317.0183 317.1574 317.2966 317.4357 317.5747 317.7138 317.8529 317.9919 318.1310 318.2700 318.4090 318.5481 318.6871 318.8260 318.9650 319.1040 319.2429 319.3819 319.5208 319.6598 319.7987 319.9376 320.0765 320.2153 320.3542 320.4931 320.6319 320.7708 320.9096 321.0484 321.1872 321.3260 321.4648 321.6036 321.7423 321.8811 322.0198 322.1586 322.2973 322.4360 322.5747 322.7134 322.8520 322.9907 323.1294 323.2680 323.4066 323.5453 323.6839 323.8225 323.9611 324.0996 324.2382 324.3768 324.5153 324.6538 324.7924 324.9309 --------------------------------------------------------------------------------------- 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 100-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-387: 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 20210114T134135.4Z 7684.570548 86 1 50.77 2 77.80 132.41 90.50 118.89 0.00 1 0.00 1 0 25 4.207e-01 8.559e-03 1.397e-01 1.491e-03 7.371286e-01 7.995149e-04 8.395765e-03 -6.000000e+00 2.457928e-01 223.73 -2.00 3.51 -2.00 320.67 0.00e+00 3.273123e-03 3.260752e-04 1.655739e-03 -6.000000e+00 1.084245e-02 275.41 -2.00 20.00 -2.00 320.18 0.00e+00 4.596 0.002 302.00 328.00 3 1.1539e+00 2.4287e-03 6.0284e-02 -6.0000e+00 6.0602e-01 1.2616e-01 3.2389e-03 4.0910e-02 -6.0000e+00 6.5926e-01 -9.1458e-02 3.3946e-03 2.0317e-02 -6.0000e+00 3.9288e-01 2.3720e-02 1.6782e-03 7.5219e-03 -6.0000e+00 1.6598e-01 7.3910e-04 -1.2871e-03 4.0938e-05 8.0925e-05 -6.0000e+00 1.2542e-02 -3.3554e-03 -2.1209e-06 11 8 0 10 0 0 92.17 22.82 0.27 -0.00336 -0.01303 154 29 1 5 0 327.450 25.68 19.99 22.82 13.21 27.8 1070.63 -200734 -19422 900000 -184177 -103120 -3041 -155144 74760 -135367 -123910 -146558 -102381 -131858 -75656 131039 -55024 -59024 -36865 49312 15785 20028 -26595 -24259 -31635 -26559 -24297 8122 -26932 -31706 -33585 -21877 1986 -11667 -20484 -3957 23565 -6483 -12423 12106 -4058 -127 -3959 -4441 -7614 746 7218 -620 7590 3565 5971 474 4275 3 6444 5189 1738 3440 1038 2262 953 1112 2819 2260 -1270 2657 -664 4066 13 3210 2157 215 584 622 -994 83 184 1049 1910 -50 842 -263 409 -1905 -1583 -1636 -1083 -1435 -798 -998 -717 466 293 1285 1006 447 1230 105 571 -570 -716 -303 -134 30 1019 43 -1200 -567 -742 37 214 -99 -765 -171 -349 67 662 1249 959 451 -147 -727 -340 -140 125 -262 217 205 1258 858 56 231 87 421 132 344 -443 -37 214 -302 -1028 -34 -83 79 345 -2120 -44 900000 -2396 -608 -6 -1472 109 -1357 -1233 -1997 -1019 -2190 -944 286 -918 -1220 -697 462 211 270 -584 -537 -809 -709 -686 173 -818 -1014 -1154 -770 67 -520 -1129 -192 907 -332 -770 713 -326 -11 -416 -504 -936 87 805 -77 906 468 822 72 707 1 1295 1144 403 855 258 573 239 277 728 627 -416 932 -243 1480 5 1209 921 102 299 328 -520 40 84 433 747 -21 398 -143 249 -1298 -1179 -1300 -877 -1234 -713 -880 -646 397 236 1001 770 362 1075 104 632 -679 -923 -391 -161 34 1075 46 -1353 -651 -902 47 287 -145 -1217 -280 -580 108 1042 1882 1449 711 -238 -1216 -560 -228 194 -405 322 301 1790 1239 88 403 160 802 260 704 -949 -81 480 -688 -2343 -77 -178 163 700 SS 20210114T134750.4Z 7684.574889 89 1 50.80 2 76.94 133.61 89.50 119.87 0.00 1 0.00 1 0 25 3.454e-01 7.123e-03 9.823e-02 1.150e-03 6.990602e-01 6.097635e-04 8.004568e-03 -6.000000e+00 2.018311e-01 223.73 -2.00 3.51 -2.00 320.42 0.00e+00 2.621983e-03 2.308815e-04 1.332227e-03 -6.000000e+00 8.798599e-03 275.41 -2.00 20.00 -2.00 319.92 0.00e+00 4.312 0.001 302.00 328.00 3 9.6804e-01 1.8052e-03 5.6469e-02 -6.0000e+00 4.9762e-01 1.0539e-01 2.3281e-03 3.7843e-02 -6.0000e+00 5.4133e-01 -6.5683e-02 2.3616e-03 1.8901e-02 -6.0000e+00 3.2239e-01 1.2815e-02 1.1892e-03 6.6898e-03 -6.0000e+00 1.3568e-01 1.2134e-03 -1.0722e-03 3.1906e-05 7.3006e-05 -6.0000e+00 1.0291e-02 -3.8712e-03 1.0875e-05 11 8 0 10 0 0 11.95 22.82 0.23 -0.00387 -0.01193 229 43 1 5 0 219.860 25.68 20.00 22.82 13.90 27.6 1073.99 -147930 -68108 214412 -152706 -46540 -95156 -94455 -45860 -63009 -91657 -99654 -77542 -80635 -53108 1442 -33009 -49924 -4717 2276 17500 -8171 -12050 -15780 -21568 -22511 -12672 -514 -20845 -16669 -29667 -8998 -932 -1022 -11835 2338 10255 -4258 -7643 3888 -795 -4399 -2755 -5134 -3101 -1187 6192 -2457 3263 1868 3248 943 976 803 3392 3928 722 2628 416 1193 157 1931 2305 2071 -46 1084 -18 2693 850 2101 2062 61 472 -46 -618 -713 -331 786 1227 990 297 82 -122 -1418 -1432 -1621 -1271 -990 -765 -939 -507 193 734 796 1465 850 1320 437 618 -282 -755 -339 -289 225 932 94 -1112 -372 -801 -143 -74 -103 -501 -325 -59 33 684 940 1001 398 -130 -777 -334 -213 -76 -78 -30 308 1355 883 31 253 -107 292 283 339 -477 -153 205 -402 -613 -129 -59 66 299 -1379 -353 241 -2135 -217 -698 -717 -262 -451 -973 -1247 -877 -1155 -752 15 -615 -1301 -89 44 314 -199 -312 -437 -631 -731 -403 -16 -752 -576 -1220 -343 -40 -52 -756 134 539 -269 -568 313 -76 -510 -350 -718 -445 -171 848 -377 490 299 547 178 193 178 808 1006 202 754 124 350 46 547 685 687 -16 429 -8 1092 352 909 943 32 269 -27 -359 -388 -163 369 547 460 149 49 -80 -1070 -1122 -1358 -1074 -883 -711 -893 -474 172 642 655 1168 714 1179 435 709 -353 -981 -440 -367 256 1017 103 -1301 -437 -999 -181 -104 -155 -802 -530 -97 53 1070 1410 1500 623 -214 -1282 -543 -347 -118 -121 -45 444 1963 1280 48 430 -194 544 557 684 -998 -336 445 -889 -1352 -284 -125 132 594 SS 20210114T140314.2Z 7684.585581 100 1 50.39 2 74.88 136.64 87.07 122.33 0.00 1 0.00 1 0 33 1.556e-01 6.615e-03 2.362e-02 8.609e-04 6.168873e-01 4.490507e-04 7.196931e-03 -6.000000e+00 9.090574e-02 223.73 -2.00 3.51 -2.00 319.86 0.00e+00 2.129864e-03 1.421428e-04 9.591349e-04 -6.000000e+00 3.963316e-03 275.41 -2.00 20.00 -2.00 319.33 0.00e+00 3.761 0.001 302.00 328.00 3 1.0706e+00 1.2748e-03 4.9203e-02 -6.0000e+00 2.2413e-01 8.8782e-02 1.5489e-03 3.2550e-02 -6.0000e+00 2.4383e-01 -5.1235e-02 1.4183e-03 1.6158e-02 -6.0000e+00 1.4521e-01 8.7608e-03 7.3768e-04 5.3454e-03 -6.0000e+00 6.1103e-02 2.0171e-03 -1.1697e-03 2.4487e-05 6.0882e-05 -6.0000e+00 4.6360e-03 -3.5671e-03 -1.4912e-05 11 8 0 10 0 0 95.27 22.82 0.19 -0.00357 -0.01236 280 53 1 5 0 179.940 25.68 20.00 22.82 15.10 27.2 1078.88 -86125 -27486 1804 -69634 -37071 -37376 -58413 -20923 -47529 -50072 -57568 -36052 -44470 -29475 3012 -15685 -17784 -11452 4245 2539 739 -4190 -2269 -7173 -8919 -5993 -2103 -7105 -7615 -8412 -5392 364 -1192 -5084 -3 4511 -1040 -3042 2757 -1209 -2244 -1926 -3061 -2260 -662 1320 -249 1381 352 2078 552 1450 916 2829 1648 910 1560 374 445 132 1494 1395 1591 191 463 70 1411 728 2146 1299 136 -242 -407 -705 -581 -280 536 1001 854 268 -147 -279 -1622 -1543 -1394 -1340 -889 -549 -511 -362 166 780 962 1554 1299 1355 769 806 -484 -721 -463 -380 125 1016 -133 -990 -604 -846 -135 -59 -69 -453 -351 -71 76 731 914 1008 470 -348 -822 -444 -203 -150 -58 28 259 1335 951 150 282 -17 425 129 297 -307 -160 116 -255 -663 -173 -54 -16 227 -1131 -243 13 -975 -391 -379 -758 -209 -708 -774 -1031 -628 -924 -668 62 -477 -641 -433 150 98 30 -184 -100 -354 -489 -317 -120 -392 -452 -477 -330 25 -97 -479 0 391 -99 -334 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