File name: Pandora272s1_Lauder_20260522_L2Fit_fout2c6d20241202p1-8.txt File generation date: 20260704T073410.8Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 Local principal investigator: Richard Querel Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 272 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora272_OF_v3d20240829.txt Instrument calibration file used: Pandora272s1_CF_v6d20241202.txt Level 1 file used: Pandora272s1_Lauder_20260522_L1_smca1c6d20241202p1-8.txt Full location name: Lauder Atmospheric Research Station Short location name: Lauder Country of location: New Zealand Location latitude [deg]: -45.0380 Location longitude [deg]: 169.6840 Location altitude [m]: 370 Local noon date: 20260522 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: 196 338 Nominal wavelengths inside fitting window [nm]: 305.0455 305.1861 305.3267 305.4672 305.6077 305.7483 305.8888 306.0293 306.1697 306.3102 306.4507 306.5911 306.7315 306.8720 307.0124 307.1528 307.2931 307.4335 307.5739 307.7142 307.8545 307.9949 308.1352 308.2755 308.4158 308.5560 308.6963 308.8365 308.9768 309.1170 309.2572 309.3974 309.5376 309.6778 309.8179 309.9581 310.0982 310.2383 310.3784 310.5185 310.6586 310.7987 310.9388 311.0788 311.2189 311.3589 311.4989 311.6389 311.7789 311.9189 312.0589 312.1988 312.3388 312.4787 312.6186 312.7585 312.8984 313.0383 313.1782 313.3180 313.4579 313.5977 313.7375 313.8773 314.0171 314.1569 314.2967 314.4364 314.5762 314.7159 314.8556 314.9954 315.1351 315.2747 315.4144 315.5541 315.6937 315.8334 315.9730 316.1126 316.2522 316.3918 316.5314 316.6710 316.8105 316.9501 317.0896 317.2291 317.3686 317.5081 317.6476 317.7871 317.9265 318.0660 318.2054 318.3448 318.4842 318.6236 318.7630 318.9024 319.0417 319.1811 319.3204 319.4598 319.5991 319.7384 319.8777 320.0169 320.1562 320.2955 320.4347 320.5739 320.7131 320.8523 320.9915 321.1307 321.2699 321.4090 321.5482 321.6873 321.8264 321.9655 322.1046 322.2437 322.3828 322.5219 322.6609 322.7999 322.9390 323.0780 323.2170 323.3560 323.4949 323.6339 323.7729 323.9118 324.0507 324.1896 324.3285 324.4674 324.6063 324.7452 324.8840 --------------------------------------------------------------------------------------- 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 20260521T221408.8Z 9637.926490 474 1 3.32 2 73.11 35.12 119.54 90.86 0.00 1 0.00 1 0 17 5.901e-02 9.191e-03 2.167e-02 3.568e-03 4.268396e-01 1.772524e-03 5.312049e-03 -6.000000e+00 3.320071e-02 221.21 -2.00 3.69 -2.00 318.21 0.00e+00 9.251650e-04 3.317655e-04 1.752153e-04 -6.000000e+00 1.453880e-03 275.38 -2.00 20.00 -2.00 317.64 0.00e+00 3.390 0.000 302.00 328.00 3 2.6582e+00 4.7067e-03 3.9041e-02 -6.0000e+00 8.1494e-02 2.7645e-02 5.3529e-03 2.2299e-02 -6.0000e+00 8.8779e-02 -2.6652e-02 3.6464e-03 1.1297e-02 -6.0000e+00 5.2911e-02 1.1219e-02 1.9356e-03 3.5232e-03 -6.0000e+00 2.2836e-02 8.9371e-04 5.1525e-04 9.9615e-05 3.6874e-05 -6.0000e+00 1.6190e-03 9.1379e-03 0.0000e+00 12 9 1 12 1 1 32.66 25.13 0.29 0.00914 0.01301 6 12 4 8 0 473.390 20.01 25.13 16.47 35.00 33.75 1.1 948.49 1887 412 -17367 -13025 -3725 -18133 -24257 -20677 -12326 -34031 -27241 -13419 -8036 -15370 -3950 -2851 -7625 -2141 -5324 1389 1052 3120 -3809 2276 3030 620 -1446 -689 2730 -6207 -930 729 344 3094 -3154 -364 -3664 -1725 -105 -122 -357 803 1222 3414 4083 2324 401 1292 -968 2336 1065 1293 1913 743 1672 190 1101 -83 219 1133 1802 1502 1169 1608 239 627 -161 -1917 624 912 -50 389 640 328 731 -1173 -87 -2122 -1644 -1963 -1183 -1458 -2366 -2958 -1891 -768 -137 735 116 145 406 -56 -301 -822 -358 -498 1185 779 954 660 -246 -916 -1843 -348 395 -131 -890 -798 -427 -11 526 603 424 160 3 -258 -349 128 123 512 363 200 742 368 747 528 355 885 480 -287 594 16 37 -244 -89 -3 -235 573 257 -98 -572 -850 -794 76 19 -1003 -689 -162 -890 -1359 -1252 -772 -2854 -2180 -1004 -674 -1517 -415 -341 -1040 -296 -807 206 160 463 -629 381 535 118 -286 -129 469 -1196 -189 150 80 740 -766 -84 -960 -515 -34 -48 -146 343 543 1514 1804 1055 186 593 -459 1106 514 681 1075 425 998 119 698 -50 137 692 1121 951 822 1169 182 454 -112 -1352 454 712 -41 339 558 276 597 -928 -62 -1491 -1215 -1577 -1027 -1363 -2324 -3080 -1988 -857 -153 843 136 164 445 -60 -300 -842 -370 -553 1402 1004 1285 895 -319 -1148 -2224 -410 477 -169 -1168 -1068 -607 -16 810 938 655 245 4 -372 -495 180 184 780 565 307 1103 549 1093 743 497 1224 692 -441 939 26 60 -413 -154 -5 -433 1035 473 -181 -1016 -1494 -1342 SS 20260521T221852.0Z 9637.929769 477 1 15.84 2 72.64 34.07 118.73 90.07 0.00 1 0.00 1 0 25 1.145e-01 1.204e-02 3.055e-02 3.343e-03 4.155895e-01 1.664671e-03 5.184534e-03 -6.000000e+00 6.440627e-02 221.21 -2.00 3.69 -2.00 318.60 0.00e+00 5.153520e-04 3.511132e-04 2.367062e-04 -6.000000e+00 2.822038e-03 275.38 -2.00 20.00 -2.00 318.04 0.00e+00 3.303 0.000 302.00 328.00 3 4.0652e+00 4.4660e-03 3.8102e-02 -6.0000e+00 1.5808e-01 2.5578e-02 5.1171e-03 2.1842e-02 -6.0000e+00 1.7225e-01 -8.0911e-03 3.6487e-03 1.1089e-02 -6.0000e+00 1.0266e-01 1.8542e-03 1.9446e-03 3.3538e-03 -6.0000e+00 4.4278e-02 2.3941e-04 2.9975e-04 9.4817e-05 3.6550e-05 -6.0000e+00 3.1423e-03 1.3149e-02 0.0000e+00 12 9 9 12 33 1 97.44 25.13 0.45 0.01315 0.01540 8 3 1 8 0 1759.270 20.00 25.13 16.72 35.00 33.75 1.1 949.46 -4181 -27804 -29095 2207 75806 -35349 -15990 -51639 -4998 -46773 -37657 -29682 8616 -13871 -12702 -5009 -14785 177 -15879 887 -847 6530 965 7041 -3043 8161 -4129 7068 5487 -392 -8081 8219 1037 8195 -8833 6686 -3091 -2940 1212 1312 -977 5946 -1397 1270 2715 -1401 914 3438 -2480 1743 3695 1445 3067 2034 985 1038 1688 273 -2084 1546 1931 2497 1546 2711 -1031 392 3180 -2358 1132 252 1080 267 -705 1854 178 381 460 -1478 -1521 -932 -2023 -348 -2181 -4249 -4392 -258 -467 518 403 -322 288 -251 -109 213 -592 -288 -40 1498 512 115 29 -1141 -1673 -94 335 -548 -226 -142 -193 -20 297 -14 167 948 464 -20 -580 555 263 908 -13 -476 1027 48 1283 -77 -142 599 380 874 597 26 264 -468 -383 -46 -357 486 202 135 -531 -888 -722 -134 -1269 -1413 75 1112 -1544 -620 -3215 -220 -3370 -2529 -1974 461 -1112 -1197 -501 -1769 20 -2179 108 -107 764 124 920 -468 1181 -688 1005 750 -58 -1438 1391 191 1491 -1814 1271 -647 -714 342 441 -344 2071 -546 493 1041 -564 360 1317 -1017 705 1580 690 1547 1027 529 573 949 156 -1190 840 1072 1486 1026 1812 -737 263 2128 -1660 757 193 849 223 -595 1570 142 273 324 -1022 -1111 -718 -1683 -320 -2090 -4374 -4835 -275 -525 596 470 -366 321 -260 -105 214 -595 -323 -48 1872 701 158 38 -1391 -1993 -110 418 -694 -299 -198 -273 -29 463 -23 270 1449 698 -28 -811 794 401 1385 -20 -739 1532 73 1841 -107 -200 832 539 1349 944 43 435 -805 -666 -85 -677 933 377 256 -970 -1561 -1280 SS 20260521T222304.8Z 9637.932695 479 1 2.68 2 72.22 33.13 118.01 89.36 0.00 1 0.00 1 0 17 2.561e-02 7.058e-03 5.962e-03 1.337e-03 4.062005e-01 6.638598e-04 5.119931e-03 -6.000000e+00 1.440215e-02 221.21 -2.00 3.69 -2.00 317.80 0.00e+00 8.530192e-04 1.098505e-04 2.211111e-04 -6.000000e+00 6.310377e-04 275.38 -2.00 20.00 -2.00 317.23 0.00e+00 3.231 0.000 302.00 328.00 3 8.4217e-01 1.7469e-03 3.7213e-02 -6.0000e+00 3.5350e-02 5.8964e-03 1.9738e-03 2.1226e-02 -6.0000e+00 3.8517e-02 -1.5208e-02 1.2662e-03 1.0700e-02 -6.0000e+00 2.2956e-02 5.1437e-03 6.6099e-04 3.2131e-03 -6.0000e+00 9.9014e-03 6.5856e-03 -7.5942e-05 3.7267e-05 3.5346e-05 -6.0000e+00 7.0265e-04 1.3018e-02 0.0000e+00 12 9 1 12 1 1 77.65 25.13 0.30 0.01302 0.01245 40 87 2 8 0 65.220 20.00 25.13 16.99 35.00 33.75 1.0 950.13 -5222 -4111 -3508 -5096 -6991 -11586 -10557 -10454 -6359 -9792 -7126 -8956 -4151 -2239 -324 -967 -1474 404 -10 1990 952 760 117 -83 574 155 -1110 -1087 -1668 -1512 -318 1006 1420 190 -3241 -2905 -3186 -1676 -386 365 -61 297 -68 965 346 927 293 258 -528 590 1285 669 1143 1231 969 1009 779 488 304 647 786 1311 1838 2268 1196 51 -107 -779 0 719 542 757 426 612 64 -390 -715 -1709 -1714 -1453 -1454 -1507 -1694 -2495 -1562 -822 -244 210 481 621 370 166 -163 -405 -95 -42 624 899 626 153 -128 -961 -1445 -649 -365 -988 -658 -484 -209 449 680 713 300 274 -60 -77 -55 62 294 435 85 465 516 330 526 459 24 337 607 315 205 -3 -372 -304 -26 -31 -127 418 134 -100 -236 -336 -924 -341 -300 -267 -377 -475 -804 -778 -861 -514 -882 -637 -871 -452 -286 -48 -153 -253 73 -2 390 193 154 25 -18 127 36 -268 -251 -366 -338 -78 272 395 57 -954 -835 -1006 -565 -145 163 -29 148 -33 479 174 466 148 130 -270 307 714 386 670 773 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