File name: Pandora75s1_EssexMD_20260103_L2Fit_fout2c3d20230525p1-8.txt File generation date: 20260104T051757.6Z 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_20260103_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: 20260103 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 20260103T152650.2Z 9499.643637 361 1 51.10 2 66.65 153.97 109.46 332.04 0.00 1 0.00 1 0 17 3.797e-02 8.342e-03 7.865e-03 1.696e-03 3.337304e-01 8.710916e-04 3.915449e-03 -6.000000e+00 2.232915e-02 223.59 -2.00 3.48 -2.00 317.96 0.00e+00 1.381979e-03 1.528021e-04 4.068411e-04 -6.000000e+00 9.856286e-04 277.38 -2.00 20.00 -2.00 317.32 0.00e+00 2.504 0.000 302.00 328.00 3 4.4937e+00 2.3105e-03 2.9887e-02 -6.0000e+00 5.4972e-02 6.9160e-03 2.6197e-03 1.6560e-02 -6.0000e+00 5.9918e-02 1.0301e-03 1.6541e-03 8.2997e-03 -6.0000e+00 3.5726e-02 -6.8718e-03 8.3268e-04 2.5516e-03 -6.0000e+00 1.4879e-02 3.2607e-04 -1.7031e-05 5.3900e-05 3.0513e-05 -6.0000e+00 1.1738e-03 1.5072e-02 1.3169e-06 11 8 0 10 0 0 99.82 22.88 0.43 0.01507 0.01494 26 4 1 5 0 1965.310 25.79 20.00 22.88 7.06 7.5 881.23 -33034 -4453 -9761 1116 -9839 -11852 4051 -6702 -7214 -10578 -7380 -4764 -3271 3579 464 -3195 448 402 1592 496 1391 3402 1419 1964 490 476 -1693 -3541 -2202 1489 1107 -368 440 -3549 -1487 -2615 -2021 -4144 1286 -149 -325 936 570 963 -24 1416 405 -569 -287 926 617 201 1486 2022 1506 854 331 -276 -885 -339 1513 2283 2286 1601 1400 -1440 278 39 905 1450 420 1037 388 -441 -144 -880 -1619 -1765 -1992 -2261 -1668 -1747 -1727 -1406 -1086 -484 400 1004 645 927 215 32 -558 -697 -701 297 591 -108 710 -128 -987 -1590 -628 -709 -1112 -1083 -632 0 486 1111 1138 640 205 -54 -236 262 -248 212 578 317 350 319 731 330 356 -13 135 449 425 -34 -299 -755 -103 -290 22 94 297 559 132 143 -327 -648 -791 -2743 -310 -746 74 -670 -794 242 -492 -588 -948 -659 -439 -337 403 63 -502 73 70 286 94 266 641 280 406 108 99 -362 -818 -481 316 253 -85 110 -954 -381 -676 -564 -1370 479 -60 -145 436 276 472 -12 697 200 -281 -141 462 327 115 896 1183 921 539 214 -178 -568 -216 982 1583 1724 1200 1056 -1063 207 29 713 1174 374 956 359 -394 -119 -715 -1221 -1302 -1563 -1857 -1533 -1658 -1761 -1514 -1168 -551 474 1214 780 1074 234 34 -562 -699 -750 327 726 -138 946 -169 -1241 -1982 -743 -862 -1363 -1404 -859 0 691 1681 1715 982 306 -79 -327 365 -349 292 843 487 543 488 1081 470 511 -18 180 613 622 -51 -472 -1176 -164 -485 37 165 531 1016 239 252 -558 -1129 -1367 SS 20260103T153209.0Z 9499.647326 364 1 50.56 2 66.21 155.21 109.92 333.14 0.00 1 0.00 1 0 17 3.774e-02 8.344e-03 7.768e-03 1.746e-03 3.293402e-01 8.962686e-04 3.847125e-03 -6.000000e+00 2.219956e-02 223.59 -2.00 3.48 -2.00 317.88 0.00e+00 1.487967e-03 1.542757e-04 3.938791e-04 -6.000000e+00 9.797065e-04 277.38 -2.00 20.00 -2.00 317.24 0.00e+00 2.461 0.000 302.00 328.00 3 4.5839e+00 2.3736e-03 2.9386e-02 -6.0000e+00 5.4653e-02 1.3221e-02 2.6873e-03 1.6290e-02 -6.0000e+00 5.9567e-02 -2.3138e-03 1.6847e-03 8.1612e-03 -6.0000e+00 3.5518e-02 -6.1140e-03 8.4578e-04 2.5494e-03 -6.0000e+00 1.4795e-02 3.1168e-04 1.2564e-04 5.5462e-05 3.0142e-05 -6.0000e+00 1.1667e-03 1.4596e-02 3.3435e-05 11 8 0 10 0 0 98.91 22.88 0.42 0.01460 0.01554 23 4 1 5 0 2197.890 25.79 20.00 22.88 6.97 7.5 880.21 -34183 -6949 6386 -1291 -7712 -11844 1927 -3437 -9495 -7094 -8774 -2509 -3735 4502 -370 -3342 -1692 -521 682 65 2134 3367 2232 128 700 -509 -2747 -4522 -930 3290 279 684 -103 -2920 -823 -3158 -2960 -3288 1079 6 -897 919 992 677 57 1476 302 -355 427 1228 660 183 1435 2113 1288 1071 373 -297 -397 376 1491 2402 2421 1394 789 -1525 -174 70 847 1837 706 1030 75 -108 -694 -851 -1744 -1472 -1580 -2298 -1764 -2306 -1814 -1464 -911 -403 403 574 450 806 288 106 -737 -683 -680 375 635 374 386 -289 -811 -1392 -662 -718 -1015 -923 -808 119 497 844 1100 576 447 -247 -71 76 -23 243 333 455 707 521 538 550 293 -203 294 356 355 -180 -326 -552 -31 -114 -59 -121 252 385 -19 351 -130 -633 -907 -3056 -528 442 -93 -546 -841 124 -258 -836 -648 -837 -238 -406 527 -53 -551 -295 -95 129 13 422 662 455 28 146 -112 -616 -994 -208 709 66 162 -27 -803 -216 -845 -857 -1106 413 2 -411 439 490 341 29 743 153 -179 213 622 357 106 881 1257 802 685 244 -195 -257 242 982 1686 1848 1060 606 -1139 -131 53 673 1494 632 957 70 -97 -581 -697 -1328 -1090 -1242 -1898 -1631 -2210 -1859 -1583 -981 -460 479 700 547 938 313 113 -746 -686 -727 412 779 476 515 -382 -1017 -1730 -783 -873 -1242 -1193 -1097 169 705 1276 1654 880 662 -366 -98 105 -32 353 485 694 1088 791 794 778 419 -278 391 485 516 -267 -511 -851 -48 -188 -98 -210 448 695 -34 613 -219 -1094 -1558 SS 20260103T161711.7Z 9499.678608 387 1 51.26 2 63.32 166.24 113.10 342.87 0.00 1 0.00 1 0 17 3.431e-02 9.464e-03 8.237e-03 2.192e-03 2.986514e-01 1.124138e-03 3.517318e-03 -6.000000e+00 2.018326e-02 223.59 -2.00 3.48 -2.00 317.60 0.00e+00 1.358047e-03 1.776099e-04 3.682949e-04 -6.000000e+00 8.907196e-04 277.38 -2.00 20.00 -2.00 316.95 0.00e+00 2.215 0.000 302.00 328.00 3 5.2613e+00 2.9604e-03 2.6516e-02 -6.0000e+00 4.9689e-02 1.7415e-02 3.3444e-03 1.4765e-02 -6.0000e+00 5.4157e-02 3.0416e-03 2.0459e-03 7.3942e-03 -6.0000e+00 3.2292e-02 -8.2301e-03 1.0099e-03 2.2676e-03 -6.0000e+00 1.3451e-02 2.0908e-04 -5.3472e-05 6.9725e-05 2.7125e-05 -6.0000e+00 1.0607e-03 1.4819e-02 3.9296e-05 12 9 8 11 8 0 99.86 22.90 0.46 0.01482 0.01442 14 2 1 5 0 3660.900 25.79 20.00 22.90 7.48 7.5 884.32 -28457 665 8848 2218 -9586 -10020 4739 191 -7250 -8146 -7106 -1138 123 6308 1840 -4135 -1402 -1061 2506 1669 3410 3685 275 948 -1857 -254 -3100 -4299 -1303 5487 1385 -249 271 -3199 -1394 -2768 -2109 -4951 514 453 -1845 982 1737 1085 -123 1760 -674 -546 -1097 1391 611 45 1653 2026 1672 1020 441 -550 -494 -319 1814 2890 2288 1128 982 -1955 -569 -20 1323 1497 394 1792 326 -265 -363 -1416 -1001 -971 -1786 -2378 -1411 -2255 -1736 -1095 -1253 -388 139 959 319 1302 104 445 -795 -651 -610 503 352 -27 623 -317 -888 -1882 -602 -1080 -1310 -1023 -898 -221 740 906 1329 976 214 -134 -224 622 -22 184 477 316 812 222 573 458 354 -422 274 994 370 -63 -538 -482 -75 -378 -334 108 349 468 30 248 -268 -720 -728 -3054 59 751 193 -865 -870 369 17 -770 -925 -816 -129 15 862 303 -805 -284 -225 536 373 764 827 65 235 -451 -63 -789 -1169 -328 1288 360 -72 76 -956 -397 -795 -650 -1815 211 216 -910 497 902 576 -66 931 -362 -288 -578 727 339 27 1033 1329 1140 716 316 -396 -351 -227 1305 2036 1757 927 808 -1567 -426 -15 1023 1284 345 1613 297 -233 -320 -1142 -739 -752 -1357 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