File name: Pandora89s1_PaloDuroTX_20250803_L2Fit_fout2c2d20241101p1-8.txt File generation date: 20250804T070052.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Kevin Mishoe Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 89 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora89_OF_v3d20240314.txt Instrument calibration file used: Pandora89s1_CF_v2d20241101.txt Level 1 file used: Pandora89s1_PaloDuroTX_20250803_L1_smca1c2d20241101p1-8.txt Full location name: Palo Duro, TX Short location name: PaloDuroTX Country of location: United States Location latitude [deg]: 34.8806 Location longitude [deg]: -101.6647 Location altitude [m]: 1056 Local noon date: 20250803 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: OOB session based clearance session 1 First and last pixel inside fitting window: 194 335 Nominal wavelengths inside fitting window [nm]: 305.1224 305.2633 305.4042 305.5451 305.6860 305.8269 305.9677 306.1085 306.2494 306.3902 306.5310 306.6718 306.8126 306.9533 307.0941 307.2349 307.3756 307.5163 307.6570 307.7977 307.9384 308.0791 308.2198 308.3604 308.5011 308.6417 308.7823 308.9230 309.0636 309.2041 309.3447 309.4853 309.6258 309.7664 309.9069 310.0474 310.1879 310.3284 310.4689 310.6094 310.7499 310.8903 311.0307 311.1712 311.3116 311.4520 311.5924 311.7328 311.8731 312.0135 312.1538 312.2942 312.4345 312.5748 312.7151 312.8554 312.9957 313.1359 313.2762 313.4164 313.5566 313.6969 313.8371 313.9773 314.1174 314.2576 314.3978 314.5379 314.6781 314.8182 314.9583 315.0984 315.2385 315.3786 315.5186 315.6587 315.7987 315.9388 316.0788 316.2188 316.3588 316.4988 316.6387 316.7787 316.9186 317.0586 317.1985 317.3384 317.4783 317.6182 317.7581 317.8979 318.0378 318.1776 318.3175 318.4573 318.5971 318.7369 318.8767 319.0164 319.1562 319.2959 319.4357 319.5754 319.7151 319.8548 319.9945 320.1342 320.2738 320.4135 320.5531 320.6928 320.8324 320.9720 321.1116 321.2512 321.3907 321.5303 321.6698 321.8094 321.9489 322.0884 322.2279 322.3674 322.5068 322.6463 322.7857 322.9252 323.0646 323.2040 323.3434 323.4828 323.6222 323.7616 323.9009 324.0403 324.1796 324.3189 324.4582 324.5975 324.7368 324.8761 --------------------------------------------------------------------------------------- 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 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: 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 20250803T131938.3Z 9346.555304 76 1 16.01 2 74.83 79.20 167.68 314.02 0.00 1 0.00 1 0 25 3.711e-01 2.534e-02 2.376e-01 1.784e-02 4.614557e-01 9.728406e-03 5.565704e-03 -6.000000e+00 2.181063e-01 230.91 -2.00 3.36 -2.00 320.25 0.00e+00 4.598304e-03 3.247449e-03 1.054694e-03 -6.000000e+00 1.090796e-02 287.49 -2.00 20.00 -2.00 319.50 0.00e+00 3.750 0.001 302.00 328.00 3 5.4348e+00 2.8845e-02 4.0598e-02 -6.0000e+00 5.4791e-01 9.6628e-02 3.4802e-02 2.3459e-02 -6.0000e+00 5.9618e-01 -1.2975e-01 2.8776e-02 1.2725e-02 -6.0000e+00 3.5099e-01 4.7462e-02 1.4976e-02 5.1802e-03 -6.0000e+00 1.5001e-01 4.5358e-05 -1.8112e-02 5.2850e-04 6.1875e-05 -6.0000e+00 1.0223e-02 1.9957e-01 0.0000e+00 12 9 9 12 9 1 99.98 26.43 0.83 0.19957 0.06347 3 2 2 5 0 4000.000 34.00 20.00 26.43 27.01 5.9 961.43 84473 -100449 -107674 900000 900000 -115624 -98000 900000 900000 -108567 137852 900000 217465 900000 64956 -22015 900000 900000 -48248 -33986 -8496 -12075 1697 9693 95506 14830 -12557 4032 -829 97932 -2415 29508 26204 16619 -10785 93295 -30088 1404 31445 35263 3283 -4154 -10897 7544 1608 26718 -7241 -3687 -4753 12832 -2222 3291 1403 3633 15272 -2474 5282 4394 1699 2812 -1344 2509 8087 10496 5493 4782 1639 -2342 -5038 1575 -2522 6958 -1296 5917 -412 -5668 3266 -3550 -5293 -2225 -1186 -1225 4992 -3591 253 9005 3401 -7877 -1134 -1463 883 -2472 -4888 -1130 -425 93 -1190 -957 824 -245 -398 144 1834 -3095 -3551 890 -1995 -48 43 -351 1010 -755 -1652 -725 29 690 1394 -259 1074 876 302 3131 1415 -50 1762 -20 -486 2252 2167 872 77 -452 1049 -524 -1457 -323 -249 214 1375 -1524 -1786 900000 1467 -4280 -4758 900000 900000 -4927 -3867 900000 900000 -5654 2393 900000 3775 900000 1333 -1181 900000 900000 -4036 -2521 -483 -724 94 520 2261 796 -852 223 -50 2473 -191 1909 1861 1233 -1021 3725 -4369 197 3876 4653 633 -902 -2592 1506 346 4499 -1722 -858 -1155 2829 -625 943 438 1160 4454 -881 1733 1419 558 942 -511 1024 3440 4501 2355 1968 694 -1110 -2808 908 -1585 3962 -765 2999 -199 -2647 1361 -1707 -3005 -1410 -838 -940 3787 -3173 230 7926 3271 -8533 -1109 -1331 724 -1957 -3929 -949 -402 99 -1463 -1156 973 -302 -447 149 1882 -3622 -4420 1112 -2722 -63 61 -545 1609 -1204 -2524 -1021 42 995 2089 -383 1658 1368 462 4974 2201 -76 2496 -28 -683 3390 3597 1435 134 -817 1958 -1061 -3138 -706 -553 476 2926 -3177 -3555 900000 SS 20250803T135411.4Z 9346.579298 95 1 54.16 2 67.83 83.80 170.99 350.83 0.00 1 0.00 1 0 17 1.382e-02 7.413e-03 6.495e-04 2.302e-04 3.282701e-01 1.171620e-04 3.684263e-03 -6.000000e+00 7.951995e-03 230.91 -2.00 3.36 -2.00 317.13 0.00e+00 5.699681e-04 1.627385e-05 1.177569e-04 -6.000000e+00 3.561310e-04 287.49 -2.00 20.00 -2.00 316.30 0.00e+00 2.627 0.000 302.00 328.00 3 7.0681e-01 3.0985e-04 2.8439e-02 -6.0000e+00 1.9876e-02 -2.2110e-02 3.4758e-04 1.6205e-02 -6.0000e+00 2.1517e-02 -1.2372e-02 2.0662e-04 7.8507e-03 -6.0000e+00 1.2818e-02 6.9919e-03 1.0126e-04 2.2053e-03 -6.0000e+00 5.4789e-03 1.7313e-02 7.8613e-04 6.3960e-06 2.3358e-05 -6.0000e+00 3.7174e-04 6.1476e-02 0.0000e+00 11 8 0 10 0 0 99.94 26.45 0.39 0.06148 0.06738 1233 132 1 5 0 43.920 34.00 20.00 26.45 28.09 6.0 970.00 255 -483 -3025 -4308 -5080 -3831 -2660 -1441 -2604 -3893 -3302 -2030 -334 1125 1041 1605 2005 1915 2480 1749 1845 2248 1637 1344 1339 435 -354 -1178 -200 21 751 1095 -1496 -3310 -3624 -3503 -2267 -841 -319 -516 -187 -269 -274 463 -81 -214 -502 -1246 -477 316 227 834 804 567 909 439 77 -161 -206 626 1160 1783 1950 458 -81 -770 -1026 345 307 606 990 905 1022 273 -362 -1212 -2039 -1515 -1465 -1136 -1069 -1835 -1083 -509 20 665 1055 1482 1116 799 103 -463 -509 -592 -407 431 965 415 -135 -480 -1183 -1094 -535 -1136 -996 -761 -569 187 769 1011 636 506 34 -575 -556 -572 -142 110 215 101 517 607 273 463 -303 -281 376 72 78 -61 -202 -201 55 24 197 473 707 359 0 -226 -762 -906 31 -62 -380 -489 -556 -439 -339 -204 -398 -603 -527 -335 -64 245 236 384 503 505 678 494 517 644 467 408 425 140 -109 -343 -62 6 254 379 -556 -1182 -1263 -1330 -931 -388 -163 -293 -105 -157 -163 273 -48 -126 -292 -725 -279 196 145 564 550 404 662 314 55 -119 -151 446 886 1420 1605 387 -67 -600 -822 278 270 563 924 846 955 239 -311 -954 -1615 -1203 -1268 -1068 -1076 -1928 -1143 -552 23 783 1238 1740 1312 903 111 -480 -514 -636 -454 516 1205 541 -175 -605 -1420 -1267 -633 -1425 -1279 -990 -778 260 1112 1514 951 756 49 -793 -743 -761 -197 158 320 149 768 878 392 649 -408 -371 497 99 113 -91 -307 -312 86 39 329 806 1201 617 1 -373 -1246 -1444 SS 20250803T140349.8Z 9346.585993 98 1 24.98 2 65.86 85.10 171.09 4.10 0.00 1 0.00 1 0 17 1.203e-02 7.411e-03 9.692e-04 3.799e-04 3.036020e-01 1.930914e-04 3.415977e-03 -6.000000e+00 6.924052e-03 230.91 -2.00 3.36 -2.00 316.87 0.00e+00 6.242896e-04 2.535792e-05 9.024078e-05 -6.000000e+00 3.100784e-04 287.49 -2.00 20.00 -2.00 316.06 0.00e+00 2.428 0.000 302.00 328.00 3 1.1155e+00 5.0906e-04 2.6293e-02 -6.0000e+00 1.7307e-02 -1.7507e-02 5.7075e-04 1.4995e-02 -6.0000e+00 1.8735e-02 -9.5505e-03 3.3532e-04 7.2578e-03 -6.0000e+00 1.1161e-02 4.8448e-03 1.6194e-04 2.0521e-03 -6.0000e+00 4.7708e-03 1.4113e-02 8.1789e-04 1.0577e-05 2.2261e-05 -6.0000e+00 3.2368e-04 6.1186e-02 0.0000e+00 12 9 1 12 1 1 99.99 26.46 0.37 0.06119 0.06733 583 136 1 5 0 42.770 34.00 20.01 26.46 28.82 5.9 974.74 398 -193 -1953 -3547 -4369 -2786 -1425 -936 -1660 -3039 -2214 -1041 66 1362 1331 1416 1552 1380 2461 1387 1721 2123 1510 1217 1282 364 -330 -816 -94 306 765 1256 -1575 -3052 -3296 -3472 -2001 -876 -427 -505 -297 -435 -549 287 -200 -273 -619 -1229 -560 328 187 681 719 633 994 476 25 -153 -196 598 1074 1797 1926 510 28 -660 -1050 401 245 628 993 856 1050 273 -241 -1109 -1978 -1364 -1465 -1141 -1053 -1835 -1113 -531 71 603 1115 1455 1068 773 79 -396 -529 -597 -345 464 1004 418 -42 -459 -1162 -1111 -497 -1153 -935 -729 -566 176 798 1016 660 525 31 -572 -615 -686 -234 111 212 102 452 624 248 423 -367 -286 338 57 68 -24 -177 -183 74 35 234 489 719 378 -3 -196 -748 -873 57 -29 -279 -459 -543 -361 -204 -150 -284 -527 -392 -189 14 325 328 369 422 394 723 422 518 650 494 393 431 124 -107 -268 -30 106 267 478 -643 -1189 -1251 -1438 -889 -435 -234 -289 -178 -270 -346 179 -126 -170 -379 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