File name: Pandora64s1_NewHavenCT_20240901_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240902T051128.1Z 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_20240901_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: 20240901 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 20240901T144407.0Z 9010.613970 235 1 48.48 2 43.67 130.84 28.98 142.77 0.00 1 0.00 1 0 17 1.157e-02 8.055e-03 1.165e-03 6.810e-04 1.935536e-01 3.708133e-04 2.364264e-03 -6.000000e+00 7.064116e-03 230.34 -2.00 3.52 -2.00 315.60 0.00e+00 3.183352e-04 3.625372e-05 5.410811e-05 -6.000000e+00 3.163077e-04 288.68 -2.00 20.00 -2.00 314.87 0.00e+00 1.381 0.000 302.00 328.00 3 3.8935e+00 9.5874e-04 1.7182e-02 -6.0000e+00 1.7618e-02 1.6717e-02 1.0621e-03 1.0103e-02 -6.0000e+00 1.8988e-02 2.7228e-03 6.0849e-04 4.9212e-03 -6.0000e+00 1.1328e-02 -5.1627e-03 2.7306e-04 1.3650e-03 -6.0000e+00 4.8219e-03 2.1941e-03 7.4464e-05 2.1092e-05 1.8948e-05 -6.0000e+00 3.4418e-04 -5.5180e-03 6.9631e-05 11 8 0 10 0 0 100.00 21.83 0.16 -0.00552 -0.00496 169 41 1 5 0 286.830 26.21 19.97 21.83 31.30 40.7 1050.43 911 -326 227 -2221 -6399 -661 -527 1455 1436 829 -3519 -1063 -175 186 672 956 -1090 1061 15 1869 866 -33 1006 1039 235 1074 374 -663 -611 218 1526 30 2203 73 -4446 -2457 -1601 -1097 106 -99 -953 -1086 -339 -1121 -452 -33 -633 -238 -679 -555 1077 1026 901 1225 321 684 1231 537 329 318 600 1233 1252 2039 756 -1271 -187 -1542 656 1634 229 406 -177 472 189 -811 -720 -2165 -625 -345 -1143 -842 -1960 -2011 -303 -438 221 173 885 379 287 432 -683 -93 845 434 -62 1149 659 -489 -460 -1486 -1746 170 267 -1407 -321 -623 -165 419 865 465 184 81 -229 -58 544 -290 404 393 -107 -244 652 21 857 924 -704 716 902 339 531 -489 -664 -412 564 -48 -449 316 118 -433 -44 -749 233 -87 60 -543 -1489 -145 -124 371 396 235 -1017 -317 -58 63 249 375 -444 439 7 811 381 -15 454 490 115 533 181 -301 -262 93 675 14 1078 36 -2134 -1206 -869 -641 67 -71 -728 -805 -255 -846 -338 -26 -484 -176 -493 -408 824 826 711 1005 270 582 1053 457 277 272 534 1099 1182 1972 706 -1175 -163 -1351 615 1584 238 408 -187 473 175 -726 -595 -1765 -539 -329 -1138 -860 -2121 -2299 -348 -533 279 222 1115 453 334 459 -720 -97 886 499 -74 1471 863 -623 -552 -1779 -2063 200 336 -1774 -421 -852 -235 594 1255 664 262 106 -295 -72 681 -384 542 553 -152 -343 885 27 1108 1138 -846 875 1166 461 711 -672 -936 -605 829 -73 -705 479 179 -670 -66 -1102 SS 20240901T144849.5Z 9010.617239 238 1 24.55 2 43.01 132.24 28.48 144.82 0.00 1 0.00 1 0 17 1.083e-02 8.454e-03 2.317e-03 1.456e-03 1.925961e-01 7.937946e-04 2.342554e-03 -6.000000e+00 6.611498e-03 230.34 -2.00 3.52 -2.00 315.31 0.00e+00 3.207988e-04 7.367026e-05 4.484548e-05 -6.000000e+00 2.960430e-04 288.68 -2.00 20.00 -2.00 314.61 0.00e+00 1.366 0.000 302.00 328.00 3 4.7489e+00 2.0459e-03 1.7014e-02 -6.0000e+00 1.6489e-02 2.4193e-02 2.2633e-03 1.0012e-02 -6.0000e+00 1.7771e-02 1.4632e-03 1.2957e-03 4.8769e-03 -6.0000e+00 1.0602e-02 -3.7212e-03 5.7599e-04 1.3545e-03 -6.0000e+00 4.5128e-03 9.4518e-04 3.7696e-05 4.4881e-05 1.8822e-05 -6.0000e+00 3.2214e-04 -5.3821e-03 7.0349e-05 12 9 1 12 9 1 99.92 21.82 0.13 -0.00538 -0.00510 18 9 1 5 0 1291.060 26.21 20.02 21.82 31.52 40.6 1051.10 763 -1070 -428 -3079 -2571 -244 -875 1365 795 844 -2947 -1084 241 -934 735 217 -1030 1420 693 1744 1253 -45 1215 1149 656 1701 530 -855 -961 -893 1564 110 2378 11 -4392 -1702 -1370 -1040 -95 1 -771 -1486 -221 -1355 -414 -228 -1111 -285 -849 -715 1501 790 886 1405 347 646 1246 562 160 415 824 1336 1360 2341 721 -1501 -333 -1458 663 1574 380 543 -66 582 64 -916 -530 -2189 -803 -375 -1090 -1030 -1878 -2064 -320 -440 85 294 916 643 369 612 -1097 -53 631 548 -222 1189 529 -400 -408 -1309 -1838 -116 364 -1486 -516 -391 -293 485 945 427 205 50 -385 -294 502 -369 429 448 72 -132 528 161 907 846 -782 570 1001 669 634 -534 -547 -338 523 -77 -429 314 125 -509 -79 -954 219 -324 -128 -854 -647 -60 -231 391 247 268 -948 -361 83 -362 293 92 -450 629 316 814 589 -21 587 580 325 851 275 -416 -443 -411 739 55 1240 6 -2248 -884 -749 -627 -64 0 -591 -1185 -178 -1099 -332 -180 -856 -212 -649 -553 1146 639 747 1176 297 562 1087 488 138 361 747 1236 1332 2250 699 -1359 -296 -1300 606 1519 393 574 -69 580 62 -834 -465 -1897 -705 -349 -1077 -1107 -2051 -2295 -377 -530 107 373 1141 758 417 656 -1150 -55 695 634 -272 1502 684 -502 -500 -1516 -2107 -139 450 -1879 -680 -535 -405 676 1347 599 282 66 -487 -358 619 -481 575 608 98 -179 716 207 1151 1063 -958 710 1268 891 846 -732 -767 -478 752 -115 -638 472 187 -771 -116 -1375 SS 20240901T145248.9Z 9010.620010 241 1 42.97 2 42.46 133.45 28.07 146.61 0.00 1 0.00 1 0 17 1.072e-02 7.993e-03 5.318e-04 3.430e-04 1.889300e-01 1.870464e-04 2.307384e-03 -6.000000e+00 6.546052e-03 230.34 -2.00 3.52 -2.00 315.22 0.00e+00 3.050329e-04 1.704901e-05 4.342245e-05 -6.000000e+00 2.931132e-04 288.68 -2.00 20.00 -2.00 314.53 0.00e+00 1.354 0.000 302.00 328.00 3 2.5369e+00 4.8196e-04 1.6811e-02 -6.0000e+00 1.6326e-02 9.5861e-03 5.3276e-04 9.8431e-03 -6.0000e+00 1.7595e-02 2.1315e-03 3.0504e-04 4.7927e-03 -6.0000e+00 1.0497e-02 -4.3906e-03 1.3521e-04 1.3288e-03 -6.0000e+00 4.4682e-03 8.8554e-03 3.9201e-05 1.0526e-05 1.8765e-05 -6.0000e+00 3.1896e-04 -5.4766e-03 6.2977e-05 12 9 1 12 9 1 99.98 21.82 0.21 -0.00548 -0.00518 381 103 1 5 0 112.460 26.21 20.00 21.82 31.61 40.6 1052.13 860 -674 230 -2698 -4496 -1311 -284 1238 1330 320 -3081 -1440 -61 -83 1057 554 -790 904 326 1729 1155 -282 882 963 413 1159 620 -888 -483 337 1876 -33 2150 -48 -4189 -2200 -1648 -1098 133 -17 -1084 -1185 -340 -1084 -454 -55 -680 -179 -584 -226 1266 618 739 1353 274 792 1139 576 228 418 555 1343 1132 2057 622 -1311 -235 -1509 691 1604 218 326 -151 532 207 -701 -772 -1923 -533 -212 -1164 -748 -2010 -1974 -455 -476 -11 36 786 403 320 451 -687 97 893 393 -79 1121 539 -415 -427 -1376 -1627 151 400 -1381 -263 -737 -300 312 722 373 240 163 -138 -23 568 -163 501 430 -56 -192 587 3 924 980 -645 654 1001 406 554 -466 -626 -407 456 -102 -522 243 99 -550 -27 -716 264 -201 73 -795 -1230 -348 -80 379 439 101 -977 -474 -22 -33 431 240 -353 412 153 826 557 -137 438 498 222 588 329 -443 -227 157 904 -17 1149 -26 -2186 -1174 -911 -703 93 -12 -858 -915 -266 -852 -354 -45 -537 -137 -437 -171 996 486 605 1149 239 698 1010 508 199 369 485 1247 1115 1970 605 -1188 -212 -1365 634 1617 224 344 -157 527 199 -648 -659 -1616 -475 -198 -1144 -796 -2164 -2243 -524 -580 -13 44 951 482 371 501 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