File name: Pandora55s1_QueensNY_20240804_L2Fit_fout2c18d20230426p1-8.txt File generation date: 20240824T143149.3Z Data description: Level 2 spectral fitting results file Data file version: fout2c18p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora55_OF_v5d20190723.txt Instrument calibration file used: Pandora55s1_CF_v18d20230426.txt Level 1 file used: Pandora55s1_QueensNY_20240804_L1_smca1c18d20230426p1-8.txt Full location name: Queens College NYSDEC (USEPA AQS ID 36-081-0124) Short location name: QueensNY Country of location: USA Location latitude [deg]: 40.7361 Location longitude [deg]: -73.8215 Location altitude [m]: 25 Local noon date: 20240804 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: Based on session 17 for new VP from 20230426 First and last pixel inside fitting window: 261 404 Nominal wavelengths inside fitting window [nm]: 305.0111 305.1511 305.2911 305.4311 305.5710 305.7110 305.8510 305.9909 306.1308 306.2708 306.4107 306.5506 306.6905 306.8303 306.9702 307.1101 307.2499 307.3897 307.5296 307.6694 307.8092 307.9490 308.0888 308.2286 308.3683 308.5081 308.6478 308.7876 308.9273 309.0670 309.2067 309.3464 309.4861 309.6257 309.7654 309.9050 310.0447 310.1843 310.3239 310.4635 310.6031 310.7427 310.8823 311.0219 311.1614 311.3010 311.4405 311.5800 311.7195 311.8590 311.9985 312.1380 312.2775 312.4169 312.5564 312.6958 312.8352 312.9747 313.1141 313.2535 313.3929 313.5322 313.6716 313.8110 313.9503 314.0896 314.2290 314.3683 314.5076 314.6469 314.7861 314.9254 315.0647 315.2039 315.3432 315.4824 315.6216 315.7608 315.9000 316.0392 316.1784 316.3175 316.4567 316.5958 316.7350 316.8741 317.0132 317.1523 317.2914 317.4305 317.5695 317.7086 317.8476 317.9867 318.1257 318.2647 318.4037 318.5427 318.6817 318.8207 318.9596 319.0986 319.2375 319.3765 319.5154 319.6543 319.7932 319.9321 320.0710 320.2098 320.3487 320.4875 320.6264 320.7652 320.9040 321.0428 321.1816 321.3204 321.4592 321.5979 321.7367 321.8754 322.0141 322.1529 322.2916 322.4303 322.5689 322.7076 322.8463 322.9849 323.1236 323.2622 323.4008 323.5394 323.6780 323.8166 323.9552 324.0938 324.2323 324.3709 324.5094 324.6479 324.7864 324.9249 --------------------------------------------------------------------------------------- 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 100-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-387: 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 20240804T133154.4Z 8982.563824 159 1 50.06 2 50.71 101.89 50.98 96.37 0.00 1 0.00 1 0 17 1.918e-02 7.844e-03 3.814e-03 1.735e-03 2.221090e-01 9.190471e-04 2.667825e-03 -6.000000e+00 1.156629e-02 232.15 -2.00 3.51 -2.00 316.41 0.00e+00 -8.249058e-05 1.082091e-04 5.558715e-05 -6.000000e+00 5.192068e-04 290.06 -2.00 20.00 -2.00 315.58 0.00e+00 1.576 0.000 302.00 328.00 3 5.0043e+00 2.4122e-03 1.9673e-02 -6.0000e+00 2.8945e-02 1.3765e-02 2.6887e-03 1.1636e-02 -6.0000e+00 3.1215e-02 8.0936e-03 1.5470e-03 5.6326e-03 -6.0000e+00 1.8631e-02 -5.4831e-03 7.1098e-04 1.5329e-03 -6.0000e+00 7.8212e-03 5.6391e-04 -2.4662e-04 5.3783e-05 2.0466e-05 -6.0000e+00 5.7308e-04 2.1177e-03 0.0000e+00 11 8 0 10 0 0 99.99 22.78 0.12 0.00212 0.00026 51 10 1 5 0 981.340 26.21 20.02 22.78 32.38 38.2 1098.76 -2931 -5950 9268 -9528 -245 398 -529 8808 654 -1008 -2874 -1069 -2896 -90 4029 389 -2902 -608 3996 2759 -2285 1077 1424 -2061 965 195 4436 -1392 6 -2355 1412 1805 1409 -2126 -887 3764 -1147 -1172 592 522 -2106 -353 -2475 -1010 -1320 471 -1802 -182 -165 900 220 253 -416 1993 1588 556 1591 517 961 341 1205 1593 1072 -283 -311 -1131 607 -186 1068 1463 -180 175 -115 -747 244 -443 251 1231 1131 -247 -969 -157 -1501 -1152 -1241 -736 -960 -296 -947 -308 -206 -5 393 1314 925 1271 485 557 -297 -411 -402 -476 -142 1031 338 -537 -238 -718 37 539 178 -480 37 -407 -557 377 603 1086 407 -237 -895 -431 199 363 20 306 -80 1034 782 59 547 251 226 419 306 -421 113 180 -53 -545 -409 -311 -170 -146 -505 -1155 1621 -1914 -42 64 -86 1437 127 -210 -617 -227 -661 -22 1066 115 -932 -197 1280 921 -812 376 499 -763 364 77 1706 -546 2 -852 497 662 551 -886 -362 1436 -465 -521 297 297 -1337 -233 -1709 -701 -919 324 -1245 -122 -109 581 145 172 -299 1463 1205 434 1253 413 762 270 951 1292 916 -256 -288 -1038 523 -153 869 1258 -168 172 -116 -752 237 -412 217 991 889 -203 -865 -150 -1534 -1225 -1372 -847 -1155 -367 -1197 -387 -252 -6 430 1355 941 1335 544 667 -378 -541 -524 -597 -170 1196 403 -672 -309 -963 51 759 260 -723 56 -603 -790 506 776 1390 536 -327 -1289 -630 289 519 29 414 -106 1311 991 77 745 353 323 606 453 -645 178 289 -86 -897 -667 -499 -266 -226 SS 20240804T134005.7Z 8982.569510 165 1 19.53 2 49.20 103.51 49.49 97.85 0.00 1 0.00 1 0 25 9.312e-03 6.392e-03 1.961e-03 1.152e-03 2.168325e-01 6.149296e-04 2.622354e-03 -6.000000e+00 5.615513e-03 232.15 -2.00 3.51 -2.00 315.59 0.00e+00 -2.801082e-05 6.048896e-05 3.107139e-05 -6.000000e+00 2.520721e-04 290.06 -2.00 20.00 -2.00 314.82 0.00e+00 1.527 0.000 302.00 328.00 3 3.5265e+00 1.5973e-03 1.9114e-02 -6.0000e+00 1.4053e-02 6.8132e-03 1.7715e-03 1.1340e-02 -6.0000e+00 1.5155e-02 -1.8803e-03 1.0114e-03 5.5001e-03 -6.0000e+00 9.0453e-03 -1.6982e-03 4.4847e-04 1.5008e-03 -6.0000e+00 3.7974e-03 2.6349e-03 -2.5278e-04 3.5359e-05 2.1205e-05 -6.0000e+00 2.7822e-04 1.8520e-03 0.0000e+00 12 1 1 12 1 1 99.61 22.78 0.20 0.00185 -0.00005 27 14 1 5 0 697.280 26.21 20.01 22.78 32.76 38.2 1100.00 -1409 -2292 -1020 -4976 -1323 213 400 3202 503 285 -1512 1158 493 865 1335 -184 -972 126 865 954 -184 712 1667 40 570 -499 363 -1319 53 997 1372 1500 1547 -1117 -1303 1002 -195 263 113 -366 -1430 -667 -1295 -1005 -888 -552 -1213 -518 -420 348 477 401 573 866 679 451 899 407 445 1156 1327 1366 1063 291 -390 -504 286 354 1369 954 62 -217 -451 -428 -306 -402 108 612 1290 27 -320 -508 -1612 -1193 -1149 -841 -880 -413 -414 -498 -367 191 196 1005 1490 1010 740 690 -174 -548 -542 -496 -73 774 185 -595 -460 -657 -144 42 -84 -359 -237 -22 -70 388 789 806 716 -95 -598 -323 -155 -241 341 256 490 1216 880 234 695 190 174 218 296 -233 -186 113 -493 -504 -357 -177 -295 -3 -347 -614 -277 -1357 -330 49 93 785 137 82 -445 335 150 285 480 -72 -397 52 364 412 -81 315 735 18 269 -244 178 -637 24 441 606 685 742 -562 -651 481 -96 138 67 -239 -1011 -490 -976 -766 -676 -420 -917 -385 -307 250 346 300 445 692 556 376 758 346 377 970 1118 1176 955 273 -374 -479 259 308 1177 860 60 -219 -463 -440 -307 -387 98 525 1079 23 -296 -499 -1676 -1280 -1271 -964 -1047 -505 -513 -617 -445 222 215 1054 1539 1075 830 818 -217 -703 -693 -612 -87 894 219 -733 -586 -858 -192 57 -118 -519 -344 -31 -95 506 996 1014 919 -127 -830 -455 -218 -335 461 338 629 1519 1099 301 920 259 240 304 421 -342 -281 173 -766 -787 -554 -269 -443 -4 SS 20240804T141827.4Z 8982.596151 187 1 50.25 2 42.28 111.95 42.59 105.45 0.00 1 0.00 1 0 17 2.108e-02 9.202e-03 4.593e-03 2.293e-03 1.948046e-01 1.215395e-03 2.324356e-03 -6.000000e+00 1.271306e-02 232.15 -2.00 3.51 -2.00 316.16 0.00e+00 9.622106e-05 1.349723e-04 3.478463e-05 -6.000000e+00 5.706974e-04 290.06 -2.00 20.00 -2.00 315.34 0.00e+00 1.350 0.000 302.00 328.00 3 5.6709e+00 3.1804e-03 1.6976e-02 -6.0000e+00 3.1814e-02 1.7631e-02 3.5400e-03 1.0146e-02 -6.0000e+00 3.4310e-02 9.9648e-03 2.0271e-03 4.9116e-03 -6.0000e+00 2.0478e-02 -5.1295e-03 9.1833e-04 1.3387e-03 -6.0000e+00 8.5965e-03 3.7872e-04 -2.6442e-04 7.1157e-05 1.7913e-05 -6.0000e+00 6.2991e-04 2.2402e-03 0.0000e+00 11 8 0 10 0 0 99.99 22.77 0.40 0.00224 0.00025 53 10 1 5 0 947.990 26.21 19.99 22.77 34.00 38.2 1100.00 -2490 -5425 9491 -10236 895 2672 12 8886 1903 -157 -4294 -199 -2880 -1219 5423 -217 -3664 48 4964 2007 -1238 64 1621 -3440 603 -765 5230 -1781 -863 -2059 1076 2630 1 -2403 -779 4918 -1642 -2055 1392 1018 -2405 -164 -1771 -1586 -1505 1381 -2231 -74 -203 1312 -105 -398 -1143 2904 1643 637 1732 805 1252 972 1011 2427 1278 -670 556 -1691 1303 -853 1006 1103 -250 96 584 -381 528 -819 285 1321 71 -549 -1731 181 -1600 -831 -1561 -509 -1257 -414 -430 -363 -366 -147 401 581 755 572 28 539 -162 -286 -136 -542 -493 1058 127 -450 -248 -813 -4 1112 287 -539 31 -92 -447 -400 447 945 375 74 -1034 -76 563 1139 40 362 -178 786 283 -173 263 504 496 594 551 -341 65 247 123 -820 -530 -411 -204 -323 -502 -1222 1924 -2396 175 480 2 1644 413 -37 -1052 -47 -735 -337 1568 -71 -1298 17 1719 731 -474 24 612 -1393 246 -327 2139 -750 -343 -787 400 1007 0 -1048 -330 1926 -690 -955 719 601 -1600 -113 -1272 -1155 -1097 983 -1613 -52 -138 867 -71 -280 -846 2160 1273 507 1392 654 1010 780 817 1998 1117 -623 524 -1589 1131 -712 821 954 -235 95 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