File name: Pandora55s1_QueensNY_20240713_L2Fit_fout2c17d20220526p1-8.txt File generation date: 20240714T051052.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c17p1-8 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_v17d20220526.txt Level 1 file used: Pandora55s1_QueensNY_20240713_L1_smca1c17d20220526p1-8.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: 20240713 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: None First and last pixel inside fitting window: 262 404 Nominal wavelengths inside fitting window [nm]: 305.1320 305.2720 305.4120 305.5520 305.6920 305.8320 305.9719 306.1119 306.2518 306.3917 306.5317 306.6716 306.8115 306.9514 307.0912 307.2311 307.3709 307.5108 307.6506 307.7905 307.9303 308.0701 308.2099 308.3496 308.4894 308.6292 308.7689 308.9087 309.0484 309.1881 309.3278 309.4675 309.6072 309.7469 309.8866 310.0262 310.1659 310.3055 310.4451 310.5847 310.7243 310.8639 311.0035 311.1431 311.2827 311.4222 311.5618 311.7013 311.8408 311.9803 312.1198 312.2593 312.3988 312.5383 312.6777 312.8172 312.9566 313.0960 313.2355 313.3749 313.5143 313.6536 313.7930 313.9324 314.0717 314.2111 314.3504 314.4897 314.6291 314.7684 314.9077 315.0469 315.1862 315.3255 315.4647 315.6040 315.7432 315.8824 316.0216 316.1608 316.3000 316.4392 316.5783 316.7175 316.8566 316.9958 317.1349 317.2740 317.4131 317.5522 317.6913 317.8303 317.9694 318.1085 318.2475 318.3865 318.5255 318.6645 318.8035 318.9425 319.0815 319.2205 319.3594 319.4984 319.6373 319.7762 319.9151 320.0540 320.1929 320.3318 320.4707 320.6095 320.7484 320.8872 321.0260 321.1649 321.3037 321.4425 321.5812 321.7200 321.8588 321.9975 322.1363 322.2750 322.4137 322.5524 322.6911 322.8298 322.9685 323.1072 323.2458 323.3845 323.5231 323.6617 323.8003 323.9389 324.0775 324.2161 324.3547 324.4932 324.6318 324.7703 324.9089 --------------------------------------------------------------------------------------- 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 20240713T145617.4Z 8960.622423 213 1 50.77 2 32.52 116.35 114.16 79.78 0.00 1 0.00 1 0 17 1.223e-02 7.752e-03 2.550e-03 1.723e-03 1.655778e-01 9.298560e-04 1.960124e-03 -6.000000e+00 7.403239e-03 232.88 -2.00 3.51 -2.00 315.03 0.00e+00 -7.060975e-05 8.124914e-05 1.920326e-05 -6.000000e+00 3.313838e-04 289.47 -2.00 20.00 -2.00 314.33 0.00e+00 1.185 0.000 302.00 328.00 3 5.4584e+00 2.4067e-03 1.4712e-02 -6.0000e+00 1.8564e-02 3.9294e-02 2.6601e-03 8.5709e-03 -6.0000e+00 2.0019e-02 4.2057e-03 1.5180e-03 4.1358e-03 -6.0000e+00 1.1926e-02 -3.4102e-03 6.6112e-04 1.1235e-03 -6.0000e+00 5.0225e-03 5.8527e-04 3.4567e-04 5.2951e-05 1.6194e-05 -6.0000e+00 3.6810e-04 1.5436e-02 0.0000e+00 11 9 0 11 36 0 99.98 22.79 0.35 0.01544 0.01803 22 4 1 5 0 2307.230 26.11 20.01 22.79 31.69 38.0 1100.00 -3177 3272 -1806 -1492 1858 -1288 5873 1238 -1032 -1833 -675 -1348 -2639 3866 -473 -2347 -130 3083 1609 -1160 867 1265 -1514 -236 -164 2984 -1286 -1090 -299 170 1628 105 -729 -1454 1806 -1462 -1803 533 63 -1156 -360 -1505 -1557 -574 408 -1731 427 -768 504 285 -86 -547 1614 1438 953 2117 894 1498 1009 1156 1926 1141 -346 38 -925 246 -716 741 533 35 287 347 -477 673 -208 -15 791 31 -611 -1296 -376 -1728 -1166 -1431 -292 -1247 -424 -436 -224 -10 -35 -65 371 558 879 -97 338 -61 -235 -36 -315 -29 915 298 -537 -212 -740 248 763 325 -530 25 -371 -481 -184 253 941 390 37 -1024 46 432 618 208 527 -247 626 296 -13 844 732 74 -83 471 -86 470 433 -322 -620 -476 -478 -313 -326 -1085 1082 -602 -459 520 -372 1710 409 -364 -655 -238 -496 -1056 1600 -216 -1125 -62 1467 792 -592 438 638 -794 -127 -91 1623 -701 -564 -147 82 807 55 -393 -777 913 -768 -1030 337 44 -889 -289 -1241 -1298 -475 334 -1422 339 -599 384 218 -68 -449 1347 1232 831 1857 793 1315 884 1016 1728 1074 -342 38 -915 229 -638 648 489 35 295 364 -502 686 -203 -14 678 26 -527 -1200 -368 -1797 -1254 -1594 -337 -1507 -526 -550 -281 -12 -42 -71 386 568 917 -107 395 -75 -297 -45 -381 -34 1035 347 -652 -266 -959 328 1028 453 -756 35 -517 -641 -233 307 1133 482 47 -1382 63 590 831 274 672 -307 752 354 -15 1067 948 97 -111 637 -120 672 633 -479 -930 -708 -700 -450 -463 SS 20240713T161356.9Z 8960.676353 259 1 50.37 2 21.52 148.77 100.16 92.68 0.00 1 0.00 1 0 17 9.111e-03 6.257e-03 1.922e-03 1.298e-03 1.512295e-01 6.996790e-04 1.805465e-03 -6.000000e+00 5.513812e-03 232.88 -2.00 3.51 -2.00 315.05 0.00e+00 1.160765e-04 6.125478e-05 2.338430e-05 -6.000000e+00 2.468033e-04 289.47 -2.00 20.00 -2.00 314.34 0.00e+00 1.075 0.000 302.00 328.00 3 4.8934e+00 1.8123e-03 1.3396e-02 -6.0000e+00 1.3826e-02 3.1775e-02 2.0028e-03 7.8671e-03 -6.0000e+00 1.4910e-02 4.0156e-03 1.1425e-03 3.7993e-03 -6.0000e+00 8.8818e-03 -4.3384e-03 4.9730e-04 1.0400e-03 -6.0000e+00 3.7409e-03 1.1867e-03 3.9508e-04 4.0046e-05 1.5056e-05 -6.0000e+00 2.7414e-04 1.5010e-02 0.0000e+00 11 1 0 11 4 0 99.99 22.78 0.25 0.01501 0.01798 120 23 1 5 0 419.660 26.11 20.01 22.78 32.97 37.9 1100.00 -2284 767 -4469 -774 78 893 3345 1252 -129 -886 738 -164 -524 1228 -351 -1335 -410 1808 1527 -785 1130 1045 187 514 -257 1108 -960 209 77 1209 1517 1458 -1730 -908 1627 -372 -557 359 -124 -1497 -839 -1567 -1238 -1092 -16 -1593 -697 -652 623 314 218 430 1090 1235 945 1106 535 728 836 1223 1694 1072 408 -314 -745 188 -39 838 618 3 39 -77 -397 -24 -339 223 422 718 -423 -671 -562 -1544 -1068 -1163 -735 -758 -61 -358 -355 -103 199 281 793 707 874 292 610 -113 -323 -77 -520 -221 851 72 -813 -131 -630 40 344 174 -396 -27 45 -344 76 287 810 663 124 -605 -286 162 187 188 -24 244 1048 491 74 350 118 159 203 362 -190 19 275 -406 -318 -178 -230 -463 -71 -788 263 -1544 -240 22 255 1001 416 -45 -315 257 -59 -207 519 -160 -637 -197 869 750 -400 571 527 97 275 -142 607 -519 106 37 573 740 744 -924 -476 807 -190 -309 224 -87 -1155 -676 -1299 -1036 -912 -13 -1308 -556 -507 470 239 170 349 908 1055 819 971 473 640 731 1072 1521 1011 403 -317 -738 174 -34 720 560 3 40 -81 -417 -24 -331 202 357 586 -357 -610 -546 -1597 -1144 -1292 -848 -918 -76 -455 -450 -127 233 308 818 711 902 320 709 -139 -410 -97 -630 -255 956 83 -992 -166 -822 53 469 244 -571 -39 64 -459 96 346 968 814 160 -816 -394 223 253 248 -30 301 1250 584 90 442 153 209 269 490 -266 27 404 -607 -480 -267 -339 -669 -101 SS 20240713T162355.3Z 8960.683279 262 1 52.29 2 20.63 154.72 98.35 94.28 0.00 1 0.00 1 0 17 8.064e-03 6.485e-03 2.263e-04 1.689e-04 1.465924e-01 9.151329e-05 1.775850e-03 -6.000000e+00 4.880374e-03 232.88 -2.00 3.51 -2.00 314.54 0.00e+00 1.035821e-04 7.268116e-06 3.195984e-05 -6.000000e+00 2.184438e-04 289.47 -2.00 20.00 -2.00 313.88 0.00e+00 1.068 0.000 302.00 328.00 3 1.0839e+00 2.3594e-04 1.3217e-02 -6.0000e+00 1.2238e-02 1.0834e-02 2.5989e-04 7.6712e-03 -6.0000e+00 1.3197e-02 1.1982e-03 1.4878e-04 3.7130e-03 -6.0000e+00 7.8613e-03 -2.7025e-03 6.3919e-05 1.0225e-03 -6.0000e+00 3.3113e-03 5.4943e-02 3.9557e-04 5.1820e-06 1.5496e-05 -6.0000e+00 2.4263e-04 1.4707e-02 0.0000e+00 11 9 0 11 4 0 99.97 22.78 0.24 0.01471 0.01768 2747 519 1 5 0 18.350 26.11 20.00 22.78 34.77 37.8 1100.00 -1417 -2432 -2786 -1170 492 1364 1477 1071 -508 -40 988 998 768 281 -318 -348 -255 521 601 37 1033 1272 901 524 59 -770 -845 275 1375 1286 1584 1463 -879 -677 176 269 438 372 -735 -1317 -1053 -1208 -1145 -909 -830 -1113 -857 -652 388 742 571 811 697 554 536 789 335 680 894 1360 1203 1066 414 -760 -221 -75 363 1219 858 80 -268 -600 -430 -704 -222 99 396 1169 224 -7 -777 -1450 -1192 -966 -960 -631 -425 -390 -615 -174 165 238 1150 1333 1160 776 720 -282 -475 -329 -435 107 828 116 -681 -257 -694 -118 -38 -79 -294 -283 -138 -108 510 748 786 729 46 -467 -386 -219 -275 230 219 480 1318 979 451 443 -83 158 69 199 -304 -213 123 -414 -412 -217 -240 -269 14 -586 -1036 -1138 -427 175 478 520 419 -214 -17 405 425 359 136 -168 -191 -133 276 326 21 570 699 508 309 36 -478 -504 151 751 688 875 852 -506 -380 100 155 263 246 -543 -1033 -879 -1041 -999 -791 -717 -947 -702 -540 309 590 473 669 601 493 486 724 311 623 809 1235 1080 1021 403 -767 -224 -70 326 1066 806 80 -274 -636 -453 -716 -220 92 354 987 198 -7 -758 -1470 -1276 -1086 -1099 -736 -522 -491 -773 -209 191 262 1202 1341 1213 841 817 -335 -589 -402 -523 124 931 137 -824 -314 -891 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