File name: Pandora206s1_BuffaloNY_20220822_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T041355.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: ---- Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 206 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora206_OF_v2d20211008.txt Instrument calibration file used: Pandora206s1_CF_v4d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20220822_L1_smca1c4d20220512p1-8.txt Full location name: University at Buffalo Short location name: BuffaloNY Country of location: Canada Location latitude [deg]: 43.0015 Location longitude [deg]: -78.7869 Location altitude [m]: 190 Local noon date: 20220822 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: 223 365 Nominal wavelengths inside fitting window [nm]: 305.0744 305.2154 305.3564 305.4973 305.6383 305.7792 305.9201 306.0611 306.2020 306.3428 306.4837 306.6246 306.7654 306.9063 307.0471 307.1879 307.3287 307.4695 307.6103 307.7511 307.8918 308.0326 308.1733 308.3140 308.4548 308.5955 308.7362 308.8768 309.0175 309.1582 309.2988 309.4394 309.5801 309.7207 309.8613 310.0019 310.1424 310.2830 310.4236 310.5641 310.7046 310.8451 310.9857 311.1261 311.2666 311.4071 311.5476 311.6880 311.8285 311.9689 312.1093 312.2497 312.3901 312.5305 312.6708 312.8112 312.9515 313.0919 313.2322 313.3725 313.5128 313.6531 313.7934 313.9336 314.0739 314.2141 314.3543 314.4946 314.6348 314.7750 314.9151 315.0553 315.1955 315.3356 315.4758 315.6159 315.7560 315.8961 316.0362 316.1763 316.3163 316.4564 316.5964 316.7364 316.8765 317.0165 317.1565 317.2964 317.4364 317.5764 317.7163 317.8563 317.9962 318.1361 318.2760 318.4159 318.5558 318.6956 318.8355 318.9753 319.1152 319.2550 319.3948 319.5346 319.6744 319.8141 319.9539 320.0937 320.2334 320.3731 320.5128 320.6525 320.7922 320.9319 321.0716 321.2112 321.3509 321.4905 321.6301 321.7697 321.9093 322.0489 322.1885 322.3280 322.4676 322.6071 322.7467 322.8862 323.0257 323.1652 323.3046 323.4441 323.5836 323.7230 323.8624 324.0018 324.1413 324.2806 324.4200 324.5594 324.6988 324.8381 324.9774 --------------------------------------------------------------------------------------- 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: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Temperature at electronics board 1 [°C], 999=no temperature signal Column 98: Temperature at electronics board 2 [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: 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 20220822T123127.4Z 8269.521845 207 1 15.23 2 68.69 93.83 21.24 134.08 0.00 1 0.00 1 0 25 2.565e-02 5.206e-03 1.063e-02 1.373e-03 3.816839e-01 6.890376e-04 4.529985e-03 -6.000000e+00 1.452436e-02 231.24 -2.00 3.55 -2.00 318.73 0.00e+00 5.798201e-04 1.494959e-04 1.598367e-04 -6.000000e+00 6.471377e-04 287.41 -2.00 20.00 -2.00 317.89 0.00e+00 2.726 0.000 302.00 328.00 3 2.5113e+00 1.9023e-03 3.3629e-02 -6.0000e+00 3.6349e-02 1.9139e-02 2.1855e-03 2.0274e-02 -6.0000e+00 3.9413e-02 -1.0847e-02 1.5062e-03 9.8407e-03 -6.0000e+00 2.3473e-02 3.6686e-04 7.8874e-04 2.7371e-03 -6.0000e+00 9.9392e-03 1.8496e-03 -7.4130e-05 3.7886e-05 2.7254e-05 -6.0000e+00 6.5508e-04 -2.8483e-03 3.6244e-05 12 1 1 12 1 1 85.87 18.66 0.28 -0.00285 -0.00341 65 131 1 8 0 228.170 15.00 18.66 28.48 22.09 22.09 12.0 989.39 -9265 -2006 -7169 -6018 -11655 -6679 -11134 -4136 -9489 2625 -9624 -8490 -5153 -2314 -597 -1130 52 -406 -399 -289 225 -1842 131 -418 453 -2877 -712 -3285 -1886 -1178 407 140 1453 -882 -3076 -2607 -2834 -1432 -700 -1143 -675 -34 -511 -98 -781 -37 -212 -125 -484 71 977 537 1362 888 931 1299 1029 630 283 493 1185 1304 1686 2033 531 181 -222 -248 598 637 606 171 230 461 88 -120 -450 -602 -322 -774 -997 -1100 -1742 -1587 -925 -574 -161 -227 499 110 568 349 234 517 319 280 414 567 -71 -254 -396 -672 -673 -181 -793 -923 -681 -369 -216 13 527 162 310 74 8 116 111 126 -57 -35 -360 46 399 190 702 402 646 1004 520 312 168 26 -167 -11 36 -150 123 148 -118 -202 -253 -295 -502 -351 -79 -311 -243 -438 -235 -446 -175 -479 125 -517 -479 -333 -172 -52 -111 5 -45 -47 -35 28 -231 17 -58 66 -459 -112 -497 -264 -168 64 24 280 -181 -595 -497 -607 -355 -191 -372 -240 -13 -198 -38 -306 -14 -83 -48 -188 28 418 251 674 473 515 734 599 365 160 277 685 752 1070 1398 371 118 -138 -153 399 489 509 138 199 380 67 -82 -281 -400 -212 -593 -869 -991 -1688 -1608 -1004 -618 -181 -262 573 121 616 349 218 477 322 317 491 754 -94 -327 -510 -793 -799 -208 -1002 -1222 -943 -503 -312 20 823 258 477 114 12 156 151 180 -88 -57 -589 73 616 280 979 577 880 1406 749 488 279 42 -277 -20 67 -275 230 283 -226 -372 -474 -530 -884 SS 20220822T134534.3Z 8269.573314 246 1 30.58 2 55.41 107.90 16.18 183.76 0.00 1 0.00 1 0 17 3.073e-02 1.015e-02 2.995e-02 7.891e-03 2.538222e-01 3.942098e-03 3.061773e-03 -6.000000e+00 1.739850e-02 231.23 -2.00 3.55 -2.00 317.77 0.00e+00 2.970698e-04 6.420867e-04 2.255602e-04 -6.000000e+00 7.751739e-04 287.40 -2.00 20.00 -2.00 316.93 0.00e+00 1.756 0.000 302.00 328.00 3 6.9609e+00 1.0600e-02 2.1960e-02 -6.0000e+00 4.3541e-02 5.0084e-02 1.1996e-02 1.3526e-02 -6.0000e+00 4.7211e-02 2.7536e-02 7.3395e-03 6.5178e-03 -6.0000e+00 2.8117e-02 -1.7939e-02 3.6725e-03 1.8356e-03 -6.0000e+00 1.1907e-02 6.3995e-05 -2.1108e-04 2.2118e-04 1.8995e-05 -6.0000e+00 7.8471e-04 -3.9214e-03 3.9490e-06 12 8 8 10 0 0 99.96 18.65 0.92 -0.00392 -0.00551 18 18 1 8 0 1698.830 15.00 18.65 30.11 21.98 21.98 12.0 999.02 -13833 15461 -6346 -944 -6838 3277 2082 5733 -10692 3918 9501 -9084 2520 1653 1031 -2241 6483 -1874 1544 3309 2040 -7093 6437 -1313 2687 441 1979 5965 -3057 2549 -198 4547 3552 1040 -1847 859 -1488 -3174 2570 -2269 -1421 -2569 -392 -1513 784 -511 -1632 -2443 -22 -829 -809 449 -461 1102 910 1286 -341 1729 -833 -356 -1576 1594 332 2046 391 -370 -2928 -1991 701 260 1583 496 1880 964 2993 -947 -29 -43 -907 -94 -1104 -2096 -1516 -210 -643 593 -195 1505 346 600 831 827 -87 -395 -1096 -684 1442 1042 901 -4 350 -992 -1325 -1619 -6 -1337 -1794 58 -75 -271 418 330 -709 -66 -1842 -482 -833 -620 -324 1203 -111 683 676 -105 470 -193 408 796 1375 779 1601 -162 1160 -853 -96 -266 380 378 280 -187 -385 -454 -1304 -1387 1305 -662 -89 -598 251 174 518 -1275 426 950 -1121 315 238 171 -424 1161 -379 314 688 437 -1636 1336 -314 645 113 499 1340 -692 543 -46 1089 939 290 -483 222 -424 -1070 989 -1075 -724 -1328 -205 -829 418 -276 -870 -1277 -11 -418 -435 256 -279 693 589 843 -232 1141 -551 -233 -1081 1143 262 1637 323 -280 -2115 -1389 510 218 1425 453 1741 864 2430 -713 -20 -28 -641 -73 -961 -2036 -1551 -221 -709 692 -241 1880 438 722 944 855 -83 -367 -1096 -753 1727 1349 1227 -5 432 -1180 -1490 -1920 -7 -1752 -2470 82 -111 -430 671 533 -1137 -98 -2520 -633 -1104 -860 -467 1822 -173 1035 1001 -154 647 -255 507 999 1848 1120 2399 -245 1811 -1369 -163 -474 686 700 521 -337 -671 -764 -2166 SS 20220822T140254.9Z 8269.585357 254 1 4.55 2 52.43 111.65 16.74 197.00 0.00 1 0.00 1 0 17 1.133e-02 6.609e-03 1.071e-02 4.824e-03 2.332652e-01 2.425715e-03 2.819980e-03 -6.000000e+00 6.413301e-03 231.23 -2.00 3.55 -2.00 316.42 0.00e+00 3.164373e-04 2.843490e-04 4.234914e-05 -6.000000e+00 2.857357e-04 287.40 -2.00 20.00 -2.00 315.63 0.00e+00 1.636 0.000 302.00 328.00 3 4.8038e+00 6.3684e-03 2.0285e-02 -6.0000e+00 1.6050e-02 2.4857e-02 7.1280e-03 1.2274e-02 -6.0000e+00 1.7402e-02 6.5185e-03 4.1275e-03 5.9494e-03 -6.0000e+00 1.0364e-02 -7.3713e-03 1.9384e-03 1.6410e-03 -6.0000e+00 4.3890e-03 6.5722e-04 -3.1992e-05 1.3151e-04 1.8378e-05 -6.0000e+00 2.8924e-04 -3.8583e-03 1.4510e-05 12 9 1 12 1 1 999.00 18.65 0.35 -0.00386 -0.00410 2 20 1 8 0 1461.500 15.00 18.65 30.93 21.98 22.09 12.1 1004.90 -4585 -2011 -412 -4593 -4296 -2271 -437 -1829 -1375 116 255 722 -2159 -225 -1237 -478 2089 -706 2362 1198 1821 412 1308 52 1866 -166 -901 -548 -956 2170 1416 1796 1749 -465 -639 -1196 -2591 -637 -622 293 -864 -319 -276 -851 -638 -632 -599 -271 -798 -313 516 1255 973 509 792 1263 968 201 -269 772 554 1423 965 1584 110 -111 -914 -1477 510 -332 648 756 571 282 -257 0 -233 -511 -1313 -482 -793 -217 -2376 -1279 -1351 -513 351 -140 203 517 352 278 441 906 -168 -7 681 602 437 -477 -777 -606 -80 -228 -577 -725 -889 -521 -575 287 519 409 522 204 -544 -976 498 78 27 187 -227 120 350 269 679 561 645 656 920 531 295 -27 -330 209 225 -90 347 -298 8 -323 -213 -310 -974 -806 -374 -77 -825 -668 -351 -71 -321 -269 23 50 143 -497 -58 -348 -146 641 -230 775 412 633 142 460 20 693 -65 -356 -209 -336 730 512 688 729 -195 -254 -470 -1100 -308 -348 183 -568 -216 -192 -599 -445 -441 -407 -178 -533 -208 348 896 706 391 623 1003 786 163 -214 606 452 1196 855 1481 102 -97 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