File name: Pandora75s1_EssexMD_20260111_L2Fit_fout2c3d20230525p1-8.txt File generation date: 20260112T051847.1Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 75 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora75_OF_v3d20220127.txt Instrument calibration file used: Pandora75s1_CF_v3d20230525.txt Level 1 file used: Pandora75s1_EssexMD_20260111_L1_smca1c3d20230525p1-8.txt Full location name: MDE Essex Monitoring Site Short location name: EssexMD Country of location: United States Location latitude [deg]: 39.3109 Location longitude [deg]: -76.4745 Location altitude [m]: 12 Local noon date: 20260111 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 on session 2 First and last pixel inside fitting window: 196 338 Nominal wavelengths inside fitting window [nm]: 305.0305 305.1717 305.3128 305.4540 305.5951 305.7363 305.8774 306.0185 306.1596 306.3007 306.4418 306.5828 306.7239 306.8649 307.0060 307.1470 307.2880 307.4290 307.5700 307.7110 307.8519 307.9929 308.1338 308.2747 308.4157 308.5566 308.6975 308.8384 308.9792 309.1201 309.2610 309.4018 309.5426 309.6834 309.8243 309.9651 310.1058 310.2466 310.3874 310.5281 310.6689 310.8096 310.9503 311.0910 311.2317 311.3724 311.5131 311.6537 311.7944 311.9350 312.0757 312.2163 312.3569 312.4975 312.6381 312.7786 312.9192 313.0598 313.2003 313.3408 313.4813 313.6218 313.7623 313.9028 314.0433 314.1838 314.3242 314.4646 314.6051 314.7455 314.8859 315.0263 315.1667 315.3070 315.4474 315.5877 315.7281 315.8684 316.0087 316.1490 316.2893 316.4296 316.5699 316.7101 316.8504 316.9906 317.1308 317.2710 317.4112 317.5514 317.6916 317.8318 317.9719 318.1121 318.2522 318.3923 318.5324 318.6725 318.8126 318.9527 319.0927 319.2328 319.3728 319.5129 319.6529 319.7929 319.9329 320.0729 320.2128 320.3528 320.4927 320.6327 320.7726 320.9125 321.0524 321.1923 321.3322 321.4721 321.6119 321.7518 321.8916 322.0314 322.1712 322.3110 322.4508 322.5906 322.7304 322.8701 323.0099 323.1496 323.2893 323.4290 323.5687 323.7084 323.8481 323.9877 324.1274 324.2670 324.4067 324.5463 324.6859 324.8255 324.9650 --------------------------------------------------------------------------------------- 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 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: 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 20260111T141649.9Z 9507.595022 304 1 51.78 2 73.74 137.52 67.83 223.07 0.00 1 0.00 1 0 17 1.356e-01 1.163e-02 4.742e-02 3.193e-03 4.239929e-01 1.645568e-03 4.976810e-03 -6.000000e+00 7.970480e-02 223.80 -2.00 3.48 -2.00 319.52 0.00e+00 2.844445e-03 4.553342e-04 1.065664e-03 -6.000000e+00 3.513381e-03 276.91 -2.00 20.00 -2.00 318.91 0.00e+00 3.513 0.001 302.00 328.00 3 4.2465e+00 4.6074e-03 4.0934e-02 -6.0000e+00 1.9634e-01 4.8018e-02 5.4055e-03 2.1655e-02 -6.0000e+00 2.1411e-01 -2.2611e-02 4.2515e-03 1.1359e-02 -6.0000e+00 1.2759e-01 2.7525e-03 2.2202e-03 3.8565e-03 -6.0000e+00 5.3021e-02 1.3928e-04 -1.8299e-03 1.0223e-04 5.1445e-05 -6.0000e+00 4.1949e-03 1.6375e-02 -3.4708e-04 12 9 8 11 8 0 99.99 23.15 0.73 0.01637 0.00262 62 10 1 5 0 835.050 26.00 20.00 23.15 13.44 7.7 926.44 -124557 -33240 42528 44605 -12156 -40539 -13091 -26779 -12220 -12381 -5934 8228 427 -9335 379 -9503 -2988 -845 7136 -3421 12111 14467 643 3131 -4260 2550 -15071 -5886 -4493 11574 940 -1869 1125 -8700 -1132 431 -1549 -9545 5316 1430 -1943 4731 -49 1728 -1244 4595 2227 -568 -716 4737 905 2327 2681 2832 1951 3450 321 -2196 -345 -625 1975 1956 1097 2731 1561 -3340 1636 339 1508 2545 939 2593 216 -1586 -1679 -1788 -1670 -261 -2335 -3437 -2253 -2360 -1795 -1211 -1452 -107 360 1235 270 1324 360 215 -393 -1126 -1443 642 970 942 920 -291 -987 -1479 -1207 -1052 -1350 -1304 -647 76 420 721 1895 786 -96 -37 -506 129 -487 194 498 349 801 53 1459 138 317 -791 464 480 487 84 -1151 -545 -544 -654 241 -114 468 663 -190 714 -202 -274 -914 -6875 -837 530 583 -261 -1123 -289 -750 -327 -355 -166 218 14 -419 18 -586 -190 -57 469 -261 811 955 50 252 -391 228 -1619 -561 -413 937 94 -216 139 -1243 -147 55 -221 -1718 985 321 -502 1220 -14 490 -368 1296 646 -170 -219 1426 304 838 1036 1164 846 1517 148 -1036 -158 -286 916 985 557 1469 865 -1873 844 179 848 1585 647 1831 155 -1107 -1084 -1049 -1001 -153 -1371 -2325 -1713 -2001 -1634 -1164 -1371 -106 372 1300 286 1333 372 206 -361 -1049 -1457 654 1111 1196 1233 -390 -1254 -1744 -1350 -1199 -1643 -1679 -872 108 590 1093 3021 1295 -155 -56 -734 193 -736 281 762 558 1279 83 2203 203 481 -1164 658 705 715 134 -1989 -978 -1014 -1192 460 -228 956 1372 -393 1420 -388 -507 -1685 SS 20260111T144207.7Z 9507.612589 313 1 51.60 2 70.60 142.73 71.32 228.21 0.00 1 0.00 1 0 17 3.267e-02 8.089e-03 1.975e-03 3.894e-04 3.680606e-01 2.001954e-04 4.295882e-03 -6.000000e+00 1.923203e-02 223.80 -2.00 3.48 -2.00 318.07 0.00e+00 1.619894e-03 3.621188e-05 5.335683e-04 -6.000000e+00 8.465276e-04 276.91 -2.00 20.00 -2.00 317.45 0.00e+00 2.976 0.000 302.00 328.00 3 1.2044e+00 5.3310e-04 3.4716e-02 -6.0000e+00 4.7378e-02 -4.4941e-04 6.0422e-04 1.8261e-02 -6.0000e+00 5.1635e-02 -1.2827e-02 3.8807e-04 9.1896e-03 -6.0000e+00 3.0774e-02 -5.0925e-04 1.9766e-04 2.8918e-03 -6.0000e+00 1.2807e-02 5.3842e-03 -6.9221e-05 1.2246e-05 3.4211e-05 -6.0000e+00 1.0101e-03 1.4092e-02 -2.2779e-06 11 8 0 10 0 0 70.47 23.14 0.45 0.01409 0.01357 576 94 1 5 0 89.570 26.00 20.00 23.14 13.49 7.8 929.32 -11764 -6937 -6650 -9235 -12117 -11741 -11749 -10336 -9098 -9503 -10111 -10109 -6525 -4675 -1496 -1040 -40 873 1605 1174 1385 934 1309 781 312 -120 -1708 -2218 -2471 -1171 -773 68 208 -2114 -3677 -3999 -2933 -1701 78 -176 -204 169 218 611 665 924 499 325 82 687 970 1419 1549 1729 1201 1132 879 195 37 400 1268 2051 2592 2049 1046 75 -499 -188 742 1374 904 906 691 225 -219 -1217 -1908 -2261 -2156 -1927 -1836 -1909 -1974 -1682 -897 -419 436 800 624 584 283 -272 -865 -730 -525 -56 496 544 190 -349 -979 -1485 -925 -646 -936 -945 -539 -250 599 934 849 551 227 -116 -243 -198 73 408 573 563 624 743 795 738 531 61 -5 188 121 -32 -308 -493 -330 -108 54 178 475 380 177 91 -370 -800 -949 -683 -432 -432 -597 -747 -697 -730 -701 -675 -755 -836 -893 -639 -531 -193 -152 -6 131 253 194 233 159 229 145 62 -25 -360 -455 -490 -233 -166 16 54 -580 -1002 -1093 -862 -526 28 -69 -88 78 104 296 324 452 244 159 41 347 484 761 889 1052 715 694 549 122 23 247 805 1396 1917 1526 796 55 -353 -133 558 1145 776 811 617 194 -186 -949 -1386 -1726 -1646 -1562 -1682 -1834 -1937 -1747 -988 -465 504 946 737 663 316 -282 -900 -758 -553 -62 585 708 250 -454 -1266 -1789 -1112 -794 -1173 -1196 -716 -350 851 1362 1310 866 349 -168 -344 -281 104 578 860 846 949 1109 1204 1072 738 86 -7 263 175 -48 -490 -784 -542 -178 94 312 854 694 323 161 -657 -1378 -1623 SS 20260111T144821.5Z 9507.616915 317 1 51.59 2 69.88 144.07 72.22 229.42 0.00 1 0.00 1 0 17 2.847e-02 8.083e-03 1.679e-03 3.639e-04 3.581677e-01 1.866965e-04 4.185549e-03 -6.000000e+00 1.675701e-02 223.80 -2.00 3.48 -2.00 317.93 0.00e+00 1.530225e-03 3.225337e-05 4.655662e-04 -6.000000e+00 7.375732e-04 276.91 -2.00 20.00 -2.00 317.29 0.00e+00 2.877 0.000 302.00 328.00 3 1.1866e+00 4.9465e-04 3.3614e-02 -6.0000e+00 4.1280e-02 -8.9441e-04 5.6015e-04 1.7761e-02 -6.0000e+00 4.4989e-02 -1.1176e-02 3.5461e-04 8.8969e-03 -6.0000e+00 2.6814e-02 -1.2662e-03 1.7905e-04 2.7676e-03 -6.0000e+00 1.1159e-02 6.1064e-03 -2.4431e-05 1.1407e-05 3.2619e-05 -6.0000e+00 8.8008e-04 1.4051e-02 -1.9386e-07 11 8 0 10 0 0 65.09 23.15 0.46 0.01405 0.01387 611 99 1 5 0 84.430 26.00 20.00 23.15 14.66 7.9 937.13 -9244 -6286 -5761 -7875 -10868 -10932 -9334 -8212 -7269 -8461 -9083 -8784 -5674 -3577 -1192 -630 233 1227 1500 1820 1811 1381 1064 770 442 174 -1631 -2203 -1998 -1117 -264 556 242 -1941 -3533 -3891 -3200 -1734 -218 -189 -245 17 181 535 639 863 475 171 20 532 884 1384 1561 1652 1204 1201 863 124 139 588 1197 2063 2414 2004 947 -42 -504 -175 629 1382 863 969 714 388 -218 -1198 -1877 -2227 -2154 -1837 -1866 -1896 -1963 -1706 -810 -329 377 787 613 614 283 -253 -890 -764 -551 12 507 588 227 -354 -1042 -1459 -947 -585 -873 -941 -551 -171 586 929 864 581 326 -102 -333 -201 51 419 535 463 595 771 796 732 550 29 -5 154 142 -52 -305 -518 -259 -58 51 168 436 407 182 119 -381 -821 -932 -593 -439 -419 -566 -745 -724 -637 -613 -594 -746 -833 -855 -613 -446 -170 -92 36 202 260 327 333 257 204 157 95 39 -375 -492 -429 -241 -61 141 67 -572 -1032 -1140 -927 -575 -85 -79 -114 8 86 257 309 418 230 83 10 265 466 784 945 989 754 773 567 82 91 381 800 1474 1759 1565 754 -32 -372 -129 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