File name: Pandora206s1_BuffaloNY_20231027_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T064231.5Z 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_20231027_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: 20231027 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 20231027T132142.4Z 8700.556741 226 1 1.82 2 74.66 124.76 121.03 314.52 0.00 1 0.00 1 0 17 9.080e-02 8.232e-03 7.783e-02 5.844e-03 4.058501e-01 2.890103e-03 4.814865e-03 -6.000000e+00 5.026565e-02 224.44 -2.00 3.55 -2.00 319.55 0.00e+00 2.391851e-04 7.975366e-04 5.737880e-04 -6.000000e+00 2.222020e-03 280.16 -2.00 20.00 -2.00 318.89 0.00e+00 3.710 0.001 302.00 328.00 3 2.1290e+00 8.1873e-03 4.1742e-02 -6.0000e+00 1.2412e-01 -1.8843e-02 9.6420e-03 2.1275e-02 -6.0000e+00 1.3528e-01 -1.6867e-02 7.6882e-03 1.0568e-02 -6.0000e+00 8.0663e-02 2.9264e-03 4.0586e-03 3.0327e-03 -6.0000e+00 3.4534e-02 1.1120e-03 -1.8943e-04 1.6489e-04 3.2478e-05 -6.0000e+00 2.3117e-03 -2.2274e-02 1.7070e-04 12 9 1 12 1 1 49.93 18.37 0.33 -0.02227 -0.02370 8 70 2 8 0 201.470 15.00 18.37 25.79 21.79 21.79 19.9 1002.56 -41835 28226 -44438 7294 -34548 -32279 -28687 -9914 -17728 1937 17077 -22497 78 -15930 13020 -14785 14670 -26768 231 -6856 -2467 -4789 -4651 -2229 -4141 9536 -4067 9881 -9064 3096 -7038 5786 -970 6896 -5057 2537 -552 917 658 -1023 1330 -1616 1368 2666 3445 -1428 1926 -2668 -442 -2513 2330 1923 967 2276 2206 1775 -150 1833 -6963 798 750 3028 -216 2230 -517 416 -721 -1308 1169 4394 1713 439 2187 -34 1630 -1113 -103 -3653 305 -1295 -812 -783 -2305 -1625 -1398 -212 -458 845 256 756 8 536 -1043 -578 -210 -58 -14 385 260 88 -121 -829 -28 -616 -228 -1316 -265 -350 -438 -210 882 227 -9 349 -38 14 154 683 -208 578 -628 872 133 608 296 271 -405 285 834 256 169 -13 -317 -414 -198 -113 -64 40 -27 -61 -146 62 -195 -1149 439 -1519 144 -913 -803 -743 -241 -533 52 398 -816 3 -768 560 -973 775 -2288 16 -536 -190 -375 -376 -192 -388 825 -413 829 -859 263 -740 599 -121 854 -660 297 -74 141 124 -236 336 -444 381 747 958 -422 550 -795 -130 -772 740 674 367 917 935 777 -69 828 -3348 350 339 1453 -109 1209 -296 221 -368 -668 624 2625 1165 317 1551 -23 1031 -648 -59 -2100 181 -829 -591 -643 -2082 -1527 -1302 -210 -478 902 277 784 8 515 -949 -516 -202 -59 -16 492 333 112 -155 -979 -31 -686 -278 -1710 -357 -466 -622 -325 1457 364 -13 553 -57 20 214 988 -325 953 -1060 1415 212 929 431 380 -586 417 1240 419 295 -23 -561 -766 -392 -236 -128 82 -55 -121 -297 121 -368 SS 20231027T134950.8Z 8700.576282 240 1 25.59 2 70.59 130.55 124.22 321.53 0.00 1 0.00 1 0 17 1.788e-02 5.053e-03 1.774e-02 2.439e-03 3.312470e-01 1.196325e-03 3.980265e-03 -6.000000e+00 9.895807e-03 224.44 -2.00 3.55 -2.00 318.92 0.00e+00 6.428904e-04 2.684579e-04 1.302760e-04 -6.000000e+00 4.374711e-04 280.16 -2.00 20.00 -2.00 318.23 0.00e+00 2.975 0.000 302.00 328.00 3 3.7502e+00 3.2736e-03 3.3581e-02 -6.0000e+00 2.4435e-02 -7.4243e-04 3.7737e-03 1.7185e-02 -6.0000e+00 2.6633e-02 9.0574e-04 2.6561e-03 8.5130e-03 -6.0000e+00 1.5880e-02 -6.3566e-03 1.3986e-03 2.5327e-03 -6.0000e+00 6.7985e-03 4.7207e-04 -2.4164e-04 6.9035e-05 2.5456e-05 -6.0000e+00 4.5513e-04 -2.2290e-02 1.5555e-04 12 1 1 12 1 1 99.99 18.37 0.35 -0.02229 -0.02411 62 44 2 8 0 405.800 15.00 18.37 26.72 21.79 21.79 19.9 1007.91 3005 -1131 4975 -7524 -91 -1740 -5148 -4124 -4962 -6512 -5524 7498 -5929 896 -2074 664 -3609 1217 1560 813 386 -1866 1014 -375 -565 -1220 -1135 -1920 -413 -1398 462 264 2344 -368 -1673 -1142 -2340 -2969 -1090 -724 -594 -978 189 -825 -158 297 -300 -1022 -862 -207 488 654 992 1078 920 718 1461 561 547 269 907 110 1571 2375 624 80 -473 -825 -257 489 749 463 236 736 193 43 -574 -542 -1523 -993 -1003 -807 -1646 -1521 -832 -758 -95 352 724 -18 981 505 79 41 938 198 639 644 173 -7 -174 -464 -903 78 -703 -736 -862 -645 -68 -130 483 49 32 -7 -156 128 -38 145 18 -80 -230 93 240 -57 703 68 345 858 642 178 247 23 -226 184 -174 68 -181 329 -129 -60 -195 -379 -211 116 -51 222 -365 -4 -67 -218 -194 -267 -384 -321 392 -410 68 -190 68 -407 138 186 102 50 -243 132 -53 -85 -194 -184 -296 -58 -198 70 44 426 -73 -313 -205 -468 -693 -303 -218 -198 -343 68 -306 -58 110 -110 -372 -312 -75 189 275 441 512 456 364 756 292 278 136 468 62 958 1565 425 51 -283 -486 -160 347 586 380 194 580 142 28 -345 -311 -932 -694 -796 -714 -1582 -1525 -816 -800 -105 400 827 -20 993 514 75 38 913 218 717 812 235 -9 -220 -537 -973 86 -855 -944 -1160 -915 -102 -193 763 79 50 -11 -229 177 -52 209 28 -122 -358 154 386 -88 1025 95 459 1146 936 281 417 37 -375 315 -320 132 -360 667 -264 -120 -372 -698 -377 SS 20231027T135556.3Z 8700.580513 242 1 20.01 2 69.75 131.85 124.84 323.11 0.00 1 0.00 1 0 17 7.158e-02 1.033e-02 5.587e-02 7.811e-03 3.140686e-01 3.828577e-03 3.791948e-03 -6.000000e+00 3.956074e-02 224.44 -2.00 3.55 -2.00 318.51 0.00e+00 7.631928e-04 7.700738e-04 1.321249e-04 -6.000000e+00 1.752090e-03 280.16 -2.00 20.00 -2.00 317.82 0.00e+00 2.860 0.000 302.00 328.00 3 5.8231e+00 1.0336e-02 3.2157e-02 -6.0000e+00 9.7679e-02 2.5152e-02 1.1815e-02 1.6264e-02 -6.0000e+00 1.0652e-01 1.8887e-02 8.0903e-03 8.0632e-03 -6.0000e+00 6.3508e-02 -1.4099e-02 4.2748e-03 2.3335e-03 -6.0000e+00 2.7156e-02 6.6347e-05 -1.9462e-03 2.1897e-04 2.4106e-05 -6.0000e+00 1.8236e-03 -2.0143e-02 -1.7258e-04 12 9 9 12 1 1 99.97 18.37 0.69 -0.02014 -0.03477 4 6 4 8 0 4000.000 15.00 18.37 26.93 21.79 21.79 19.9 1008.83 -4723 5194 21274 -1216 19051 13985 69122 -6247 5135 -4834 14006 12039 1500 11905 -3191 -1400 6706 4331 -5561 -3238 -754 -71 351 6376 -699 3075 1893 -2307 2436 215 3420 -2738 4464 -1787 449 -4993 -1730 -3375 -577 -2444 6348 -1924 -8872 -1838 994 650 -3541 -3715 43 2393 1242 3230 -1144 2799 181 901 -207 1524 67 -1545 252 2168 1822 1786 821 -1637 188 -2436 1163 -48 1169 59 838 1540 2207 -1223 -1904 -1394 -3387 -519 -1251 130 -3457 -1202 -458 1398 350 692 953 868 1376 483 -498 -848 322 -67 920 -369 668 -665 1501 -1262 -654 -1138 328 -766 -1803 324 -854 -34 1029 431 -561 177 -123 1215 -426 -187 111 970 -358 -376 590 552 468 -989 -920 1055 641 -546 416 -746 -677 -155 507 -200 185 371 -364 121 262 -460 213 -237 265 967 -66 763 564 1716 -358 297 -333 816 734 114 952 -346 -169 790 550 -819 -486 -113 -10 53 970 -120 535 339 -406 379 35 572 -532 894 -403 92 -1039 -384 -884 -178 -888 2334 -805 -4015 -811 425 281 -1579 -1631 18 987 554 1532 -601 1464 101 509 -121 876 38 -885 146 1331 1232 1274 598 -1160 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