File name: Pandora64s1_NewHavenCT_20240630_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240701T050235.9Z 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_20240630_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: 20240630 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 20240630T123929.7Z 8947.527427 266 1 48.43 2 55.80 88.01 29.61 196.93 0.00 1 0.00 1 0 17 1.706e-02 7.808e-03 2.462e-03 1.050e-03 2.476366e-01 5.725087e-04 2.971805e-03 -6.000000e+00 1.051992e-02 232.95 -2.00 3.52 -2.00 316.59 0.00e+00 4.505812e-04 6.960230e-05 9.883747e-05 -6.000000e+00 4.652206e-04 287.98 -2.00 20.00 -2.00 315.80 0.00e+00 1.773 0.000 302.00 328.00 3 4.2682e+00 1.5067e-03 2.2166e-02 -6.0000e+00 2.6413e-02 7.7690e-03 1.6738e-03 1.3057e-02 -6.0000e+00 2.8414e-02 -3.2293e-03 9.7106e-04 6.3085e-03 -6.0000e+00 1.6906e-02 -2.6528e-03 4.5390e-04 1.7362e-03 -6.0000e+00 7.1540e-03 9.3111e-04 3.2996e-05 3.2518e-05 2.1633e-05 -6.0000e+00 5.0794e-04 -6.9995e-03 5.9009e-05 11 8 0 10 0 0 99.83 21.58 0.19 -0.00700 -0.00675 60 14 1 5 0 807.050 26.00 20.01 21.58 31.71 39.8 1065.05 -518 171 41 -2873 -15530 -593 -2022 1624 985 1285 -4006 -786 19 -483 1133 1332 -1076 1517 -77 2692 922 639 1137 1356 413 621 264 -683 -1063 -1040 1362 285 2074 541 -4284 -2058 -1650 -578 6 -7 -777 -944 -258 -1415 -397 56 -495 -322 -591 -610 1330 1171 921 1006 385 585 985 453 444 373 676 1333 1183 2070 791 -1181 -72 -1155 925 1463 565 94 -31 258 58 -681 -301 -2059 -710 -406 -1405 -1096 -1828 -1912 -582 -529 251 174 857 515 298 314 -735 105 997 440 -195 1050 540 -556 -610 -1355 -1720 295 333 -1323 -389 -526 -231 283 636 334 178 186 4 -58 566 42 469 364 -156 -273 578 165 801 1088 -872 667 951 367 458 -417 -651 -287 402 -128 -465 206 86 -471 -44 -655 -81 28 7 -441 -2482 -90 -334 264 175 234 -761 -155 4 -121 315 396 -312 449 -24 842 295 204 377 472 151 231 97 -235 -351 -348 475 106 818 214 -1672 -822 -735 -277 4 -4 -496 -626 -175 -967 -269 37 -325 -207 -375 -396 903 844 655 750 294 456 773 354 342 291 552 1094 1038 1874 697 -977 -60 -974 790 1383 540 93 -30 252 53 -593 -243 -1659 -612 -367 -1417 -1138 -2012 -2109 -683 -624 307 216 1047 628 336 344 -758 108 1098 507 -236 1366 687 -723 -747 -1643 -2053 367 422 -1775 -519 -733 -323 416 965 501 254 259 5 -76 753 55 669 518 -225 -385 827 225 1092 1413 -1113 870 1319 514 669 -598 -961 -442 625 -207 -771 346 144 -766 -70 -1008 SS 20240630T124436.2Z 8947.530975 270 1 11.64 2 54.84 88.84 29.88 199.32 0.00 1 0.00 1 0 17 1.668e-02 8.073e-03 4.498e-03 2.032e-03 2.420225e-01 1.106971e-03 2.889656e-03 -6.000000e+00 1.028530e-02 232.95 -2.00 3.52 -2.00 316.42 0.00e+00 4.727544e-04 1.289861e-04 7.826866e-05 -6.000000e+00 4.547965e-04 287.98 -2.00 20.00 -2.00 315.64 0.00e+00 1.731 0.000 302.00 328.00 3 4.1595e+00 2.9101e-03 2.1628e-02 -6.0000e+00 2.5824e-02 9.6535e-03 3.2296e-03 1.2723e-02 -6.0000e+00 2.7778e-02 -3.0851e-03 1.8673e-03 6.1406e-03 -6.0000e+00 1.6528e-02 -4.1128e-03 8.6467e-04 1.6967e-03 -6.0000e+00 6.9959e-03 1.0919e-03 3.9956e-04 6.3026e-05 2.1279e-05 -6.0000e+00 4.9636e-04 -7.6208e-03 1.0519e-04 12 9 1 12 1 1 99.98 21.58 0.30 -0.00762 -0.00462 15 16 1 5 0 726.920 26.00 20.01 21.58 32.20 39.9 1067.93 2825 -3324 216 -7120 -11507 -2258 3619 -1340 2682 -2119 -722 -2512 1046 -1683 1900 -644 146 1284 2577 2010 2455 -131 1506 1045 825 793 895 -1478 -301 -1381 2270 -147 1963 -133 -3698 -1945 -1589 -1058 -301 390 -944 -1118 -1038 -1177 -656 248 -778 79 -991 -509 1368 871 645 1515 194 916 961 761 -211 742 70 1327 809 2511 333 -1139 -468 -1027 380 1712 968 489 -562 639 63 -395 -1203 -1906 -1032 -472 -967 -1045 -1615 -1990 -285 -406 290 32 986 596 415 519 -664 -155 991 311 -28 830 517 -722 -528 -1505 -1680 204 438 -1329 -251 -642 -255 252 698 280 158 21 58 -38 919 -438 575 434 193 -360 568 -174 916 963 -734 624 979 351 413 -639 -407 -431 402 -100 -436 171 237 -305 -93 -737 463 -606 38 -1230 -1903 -374 607 -241 503 -429 -142 -540 245 -457 559 -192 44 405 826 672 822 -45 528 387 317 312 343 -541 -104 -488 826 -58 815 -56 -1506 -814 -742 -534 -167 242 -631 -777 -694 -786 -436 173 -534 53 -658 -344 967 613 478 1166 154 738 782 614 -170 599 56 1129 737 2340 304 -973 -381 -840 337 1571 949 494 -563 605 59 -333 -1009 -1578 -863 -439 -941 -1113 -1723 -2251 -325 -491 364 38 1233 707 479 551 -701 -164 1057 366 -34 1052 671 -913 -659 -1770 -1944 247 567 -1734 -341 -872 -365 361 1031 409 230 30 76 -48 1179 -596 794 627 282 -517 790 -242 1208 1274 -951 828 1313 499 584 -931 -608 -646 633 -157 -703 280 385 -482 -149 -1153 SS 20240630T130039.5Z 8947.542124 280 1 1.69 2 51.83 91.49 30.97 206.59 0.00 1 0.00 1 0 17 1.092e-02 7.539e-03 3.161e-03 1.748e-03 2.240499e-01 9.587655e-04 2.703341e-03 -6.000000e+00 6.734425e-03 232.95 -2.00 3.52 -2.00 315.84 0.00e+00 3.338822e-04 9.761225e-05 6.365271e-05 -6.000000e+00 2.978484e-04 287.98 -2.00 20.00 -2.00 315.09 0.00e+00 1.614 0.000 302.00 328.00 3 2.1696e+00 2.4995e-03 2.0116e-02 -6.0000e+00 1.6909e-02 -5.3407e-03 2.7658e-03 1.1784e-02 -6.0000e+00 1.8192e-02 5.4254e-05 1.5837e-03 5.6947e-03 -6.0000e+00 1.0824e-02 -3.7058e-03 7.1225e-04 1.5581e-03 -6.0000e+00 4.5787e-03 9.3051e-03 -2.9723e-04 5.3935e-05 2.0918e-05 -6.0000e+00 3.2537e-04 -6.7747e-03 -2.7672e-05 12 9 1 12 1 1 78.65 21.58 0.22 -0.00677 -0.00901 13 97 1 5 0 120.230 26.00 20.01 21.58 33.72 40.1 1074.81 382 -1993 623 -2973 -4789 -1392 -721 -170 1487 785 -1895 -3107 579 -407 1213 267 -625 840 993 1543 1465 -580 1074 565 576 1028 660 -1133 80 510 2131 311 2010 -165 -4299 -2090 -1127 -951 310 -75 -1088 -870 -34 -1204 -745 56 -1196 -285 -1021 -233 1162 1167 804 1152 385 375 1085 250 94 530 640 1392 1176 1905 440 -1252 101 -939 696 1654 94 302 95 516 59 -614 -952 -1669 -627 82 -1211 -554 -1727 -2121 -405 -608 -178 20 683 490 347 611 -404 151 606 546 -219 882 484 -449 -537 -1191 -1536 238 453 -1237 -451 -562 -323 374 668 191 56 276 -49 22 818 -219 461 477 -123 -282 610 46 682 1097 -619 463 797 532 545 -381 -486 -434 396 -121 -621 211 172 -665 130 -622 89 -494 150 -674 -1012 -286 -158 -41 385 210 -511 -836 168 -134 440 97 -234 324 393 630 601 -242 458 254 268 455 306 -498 33 211 923 144 918 -76 -2071 -961 -575 -530 190 -52 -765 -632 -25 -898 -553 41 -858 -199 -744 -162 847 899 617 923 316 314 913 210 78 444 561 1235 1113 1768 416 -1107 89 -831 632 1575 96 303 98 508 57 -533 -811 -1399 -562 78 -1215 -575 -1906 -2376 -461 -735 -215 25 856 581 396 669 -416 155 666 629 -267 1110 625 -563 -661 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