File name: Pandora64s1_NewHavenCT_20240524_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240525T052206.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 64 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora64_OF_v3d20190516.txt Instrument calibration file used: Pandora64s1_CF_v4d20190911.txt Level 1 file used: Pandora64s1_NewHavenCT_20240524_L1_smca1c4d20190911p1-8.txt Full location name: New Haven - Criscuolo Park CTDEEP (USEPA AQS ID 34-017-0006) Short location name: NewHavenCT Country of location: USA Location latitude [deg]: 41.3014 Location longitude [deg]: -72.9029 Location altitude [m]: 4 Local noon date: 20240524 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: Mod WL cal slit func 9 First and last pixel inside fitting window: 249 390 Nominal wavelengths inside fitting window [nm]: 305.1279 305.2688 305.4097 305.5506 305.6915 305.8324 305.9732 306.1141 306.2549 306.3958 306.5366 306.6774 306.8182 306.9590 307.0997 307.2405 307.3812 307.5220 307.6627 307.8034 307.9441 308.0848 308.2255 308.3662 308.5068 308.6475 308.7881 308.9287 309.0693 309.2099 309.3505 309.4911 309.6316 309.7722 309.9127 310.0533 310.1938 310.3343 310.4748 310.6153 310.7557 310.8962 311.0366 311.1771 311.3175 311.4579 311.5983 311.7387 311.8791 312.0195 312.1598 312.3002 312.4405 312.5808 312.7211 312.8614 313.0017 313.1420 313.2822 313.4225 313.5627 313.7030 313.8432 313.9834 314.1236 314.2638 314.4039 314.5441 314.6842 314.8244 314.9645 315.1046 315.2447 315.3848 315.5249 315.6649 315.8050 315.9450 316.0851 316.2251 316.3651 316.5051 316.6451 316.7850 316.9250 317.0649 317.2049 317.3448 317.4847 317.6246 317.7645 317.9044 318.0442 318.1841 318.3239 318.4638 318.6036 318.7434 318.8832 319.0230 319.1628 319.3025 319.4423 319.5820 319.7217 319.8614 320.0011 320.1408 320.2805 320.4202 320.5598 320.6995 320.8391 320.9787 321.1183 321.2579 321.3975 321.5371 321.6766 321.8162 321.9557 322.0953 322.2348 322.3743 322.5138 322.6532 322.7927 322.9322 323.0716 323.2110 323.3504 323.4899 323.6292 323.7686 323.9080 324.0474 324.1867 324.3260 324.4654 324.6047 324.7440 324.8833 --------------------------------------------------------------------------------------- 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 20240524T103325.1Z 8910.439873 210 1 48.51 2 79.10 71.68 98.67 240.80 0.00 1 0.00 1 0 17 4.936e-01 1.791e-02 1.435e-01 4.963e-03 7.320613e-01 2.856785e-03 8.640348e-03 -6.000000e+00 3.022678e-01 231.69 -2.00 3.52 -2.00 321.24 0.00e+00 8.040448e-03 1.372936e-03 3.038680e-03 -6.000000e+00 1.325474e-02 284.39 -2.00 20.00 -2.00 320.68 0.00e+00 5.092 0.002 302.00 328.00 3 2.8573e+00 9.6862e-03 6.5463e-02 -6.0000e+00 7.5743e-01 2.9578e-01 1.2807e-02 4.1550e-02 -6.0000e+00 8.1685e-01 -3.8964e-01 1.1803e-02 2.3759e-02 -6.0000e+00 4.8544e-01 1.5671e-01 5.6106e-03 9.4056e-03 -6.0000e+00 2.0462e-01 8.0897e-05 -2.7176e-03 1.4363e-04 1.5160e-04 -6.0000e+00 1.4696e-02 1.2734e-03 -3.1759e-04 12 8 8 10 0 0 99.97 21.53 0.24 0.00127 -0.01915 45 11 1 5 0 1077.770 26.00 20.01 21.53 23.69 39.2 1030.28 -154317 -143297 -178190 -191593 -140256 -163634 -133385 -185130 -28665 -127044 -145478 -135040 -92319 -113366 -34058 -115292 -3835 -54280 -11775 11161 -25300 24151 -3165 -39289 -25391 -40712 -41910 -42913 -13107 -82292 -24606 -21891 2159 990 -9951 -4756 15982 -3993 16746 2788 15768 14951 21043 -2691 14953 15911 28626 11488 3098 -8185 18359 11977 21490 11115 11227 8007 6767 3147 13612 6015 3690 9160 9809 9528 12869 3202 6828 6412 4944 5833 2922 3799 1239 1511 -1116 -2905 3128 -2443 -3957 2480 -1115 -8987 -3007 -1501 -704 -336 328 467 749 1045 -1912 -743 -3905 -1565 -1810 1289 -1636 749 58 -1036 -967 -2213 -4346 427 -1130 -1870 -1958 -323 -740 372 1789 131 -199 197 -50 -1073 828 -37 1110 902 542 69 1767 812 2511 753 -1464 1041 1117 243 156 -1180 -50 -244 673 -175 -556 308 1020 -518 -313 -1421 -2240 -2080 -3521 -4017 -1789 -2663 -1702 -3957 -151 -1900 -2816 -2911 -1706 -3063 -569 -4695 -62 -1488 -243 191 -623 361 -65 -1227 -715 -1379 -1438 -1472 -352 -4712 -972 -980 87 41 -441 -211 710 -235 959 211 1145 1164 1621 -268 1284 1399 2297 1158 361 -1168 2265 1739 3085 1762 1843 1401 1211 573 2184 1054 707 1868 2253 2437 3253 879 1868 1859 1649 2171 1189 1557 500 566 -389 -946 948 -837 -1610 1120 -559 -5519 -1870 -976 -487 -243 246 353 556 735 -1298 -480 -2597 -1104 -1474 1182 -1656 836 68 -1197 -1038 -2171 -4122 403 -1156 -2011 -2267 -399 -1023 533 2767 212 -322 308 -75 -1597 1247 -59 1831 1506 882 108 2646 1176 3704 1099 -2176 1553 1892 461 304 -2480 -111 -575 1581 -428 -1381 767 2468 -1201 -724 -3157 SS 20240524T103832.6Z 8910.443433 213 1 48.35 2 78.18 72.47 99.49 241.54 0.00 1 0.00 1 0 25 4.559e-01 1.064e-02 5.231e-02 1.552e-03 6.855486e-01 8.792744e-04 7.842771e-03 -6.000000e+00 2.795658e-01 231.69 -2.00 3.52 -2.00 320.86 0.00e+00 3.222589e-03 3.909499e-04 1.905269e-03 -6.000000e+00 1.224004e-02 284.39 -2.00 20.00 -2.00 320.28 0.00e+00 4.728 0.002 302.00 328.00 3 1.3700e+00 2.8563e-03 6.0540e-02 -6.0000e+00 7.0059e-01 3.2748e-02 3.7929e-03 3.8184e-02 -6.0000e+00 7.5514e-01 -8.9124e-02 3.6746e-03 2.0533e-02 -6.0000e+00 4.4879e-01 3.2954e-02 1.7743e-03 6.9307e-03 -6.0000e+00 1.8949e-01 5.7392e-04 -6.6105e-04 4.5120e-05 9.6348e-05 -6.0000e+00 1.3573e-02 -2.5895e-03 -5.5600e-05 12 9 8 11 8 0 98.03 21.52 0.14 -0.00259 -0.00756 200 48 1 5 0 241.700 26.00 20.01 21.52 23.85 39.2 1031.39 -143873 -155657 -130454 -166523 -257831 -142972 -130714 -117536 -116343 -114576 -125350 -98802 -72689 -44316 -56550 -44784 -44698 -7587 -33853 -12321 -32115 -4007 -23407 -18891 -28743 -4042 -22473 -10188 -17265 -21905 -13910 6307 -7215 6459 -12048 -82 -3572 3506 377 7856 960 6785 3253 4057 3114 6586 3545 5893 1374 2830 4044 4462 4747 4071 2839 2316 2029 1120 2073 1189 952 2253 4110 4136 3413 -56 1421 262 2451 2368 1626 972 347 202 -578 -1935 38 -2528 -415 -822 -1112 -1994 -1552 -2429 -356 -818 554 347 1462 684 499 -388 -896 -970 313 -240 -487 874 866 -385 -447 -2079 -2419 -109 214 -1496 -481 -593 -303 267 875 204 211 54 -328 -558 410 -85 934 722 -124 70 656 496 1037 539 -1477 424 923 374 359 -473 -912 -353 429 -33 -472 513 447 -198 -12 -823 -1198 -1649 -1145 -1991 -6705 -1363 -1227 -1103 -1215 -1283 -1708 -1271 -935 -550 -993 -827 -843 -122 -689 -237 -698 -74 -519 -437 -783 -91 -612 -243 -461 -705 -503 217 -328 263 -574 -4 -193 213 29 651 86 614 322 406 324 684 393 674 175 390 624 761 884 831 615 527 473 260 469 275 236 570 1153 1284 1087 -18 470 93 965 1055 778 479 166 91 -238 -742 14 -1021 -191 -447 -648 -1327 -1106 -1860 -268 -652 454 289 1185 530 390 -293 -677 -793 270 -239 -523 1040 1075 -470 -508 -2175 -2583 -120 233 -1735 -593 -790 -421 411 1371 330 338 83 -515 -863 647 -133 1524 1195 -201 109 1047 759 1534 777 -2162 666 1540 695 686 -964 -1878 -769 992 -76 -1098 1196 1020 -453 -26 -1714 SS 20240524T104347.0Z 8910.447072 216 1 48.25 2 77.24 73.27 100.33 242.30 0.00 1 0.00 1 0 25 3.631e-01 9.065e-03 3.869e-02 1.226e-03 6.478557e-01 6.886838e-04 7.428068e-03 -6.000000e+00 2.226726e-01 231.69 -2.00 3.52 -2.00 320.62 0.00e+00 2.569165e-03 2.838759e-04 1.497518e-03 -6.000000e+00 9.748753e-03 284.39 -2.00 20.00 -2.00 320.01 0.00e+00 4.404 0.002 302.00 328.00 3 1.2993e+00 2.1659e-03 5.6511e-02 -6.0000e+00 5.5802e-01 1.2187e-02 2.8051e-03 3.5558e-02 -6.0000e+00 6.0144e-01 -5.0552e-02 2.6367e-03 1.8777e-02 -6.0000e+00 3.5745e-01 1.4760e-02 1.2940e-03 6.1442e-03 -6.0000e+00 1.5094e-01 8.6891e-04 -6.1631e-04 3.5919e-05 7.9205e-05 -6.0000e+00 1.0810e-02 -2.8721e-03 -3.9780e-05 11 8 0 10 0 0 89.48 21.52 0.19 -0.00287 -0.00750 261 63 1 5 0 184.810 26.00 20.00 21.52 24.30 39.2 1033.81 -116710 -115440 -101347 -130795 -211003 -116074 -107651 -110831 -89197 -90237 -89005 -63402 -64117 -50721 -40998 -31490 -27698 -7513 -27046 -10727 -20440 -8766 -14670 -11643 -17115 -5231 -16583 -13078 -20304 -17083 -10212 950 -3399 713 -8042 -1769 -3190 1959 -933 2886 1830 2767 2644 2370 1042 3553 1219 3184 1717 157 3622 2799 2973 2378 1844 1552 1193 763 -250 863 591 2030 2784 4294 2623 -463 1079 -464 1571 1976 565 755 330 304 -357 -1655 -491 -2312 -921 -584 -1222 -1477 -1592 -2077 -487 -307 674 506 1558 802 475 232 -799 -604 432 -80 -339 971 652 -497 -604 -1872 -2209 86 351 -1657 -561 -798 -299 307 1022 384 325 112 -336 -471 422 -55 827 450 -121 -113 739 258 904 580 -1430 394 871 238 343 -587 -680 -273 445 -153 -568 509 427 -193 139 -738 -991 -1090 -885 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