File name: Pandora64s1_NewHavenCT_20230704_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20230708T080825.8Z 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 v1.8.49 Instrument operation file used: Pandora64_OF_v3d20190516.txt Instrument calibration file used: Pandora64s1_CF_v4d20190911.txt Level 1 file used: Pandora64s1_NewHavenCT_20230704_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: 20230704 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 20230704T124015.0Z 8585.527952 266 1 43.84 2 55.91 88.28 114.27 255.57 0.00 1 0.00 1 0 25 1.079e-02 7.383e-03 7.688e-04 3.402e-04 2.466741e-01 1.859470e-04 2.963519e-03 -6.000000e+00 6.657916e-03 232.95 -2.00 3.52 -2.00 316.46 0.00e+00 2.702887e-04 2.189934e-05 8.710199e-05 -6.000000e+00 2.947250e-04 288.26 -2.00 20.00 -2.00 315.67 0.00e+00 1.779 0.000 302.00 328.00 3 1.9287e+00 4.8850e-04 2.2179e-02 -6.0000e+00 1.6715e-02 1.1758e-02 5.4229e-04 1.3009e-02 -6.0000e+00 1.7978e-02 6.1744e-04 3.1381e-04 6.2807e-03 -6.0000e+00 1.0698e-02 -3.9697e-03 1.4566e-04 1.7149e-03 -6.0000e+00 4.5308e-03 9.5987e-03 -4.4757e-05 1.0545e-05 2.2180e-05 -6.0000e+00 3.2125e-04 -9.7480e-03 5.8798e-05 12 9 1 12 1 1 99.99 21.84 0.21 -0.00975 -0.01008 686 180 1 5 0 63.550 26.21 20.01 21.84 29.27 38.3 1055.98 897 -1034 480 -2899 -5043 -1449 -356 895 1373 520 -3007 -1573 212 -153 576 583 -858 891 246 1508 1117 -407 655 984 370 1108 560 -1103 -758 295 1711 -46 1896 -27 -4245 -2147 -1643 -1112 -19 -4 -1008 -1170 -306 -931 -617 21 -792 -210 -672 -312 1227 1102 676 1331 219 754 1053 591 120 526 557 1433 1134 2010 688 -1243 -238 -1311 621 1655 332 450 -203 511 189 -653 -560 -1779 -537 -305 -1143 -657 -1901 -2006 -452 -447 88 97 793 453 320 549 -600 41 972 447 -97 972 552 -542 -445 -1316 -1600 163 415 -1357 -272 -683 -287 279 687 316 165 148 -85 -50 596 -215 515 348 -60 -311 496 1 763 1016 -765 537 956 342 565 -413 -587 -352 403 -49 -533 298 150 -438 32 -663 145 -178 82 -466 -828 -231 -60 153 254 100 -593 -327 49 -40 168 168 -259 277 79 498 373 -138 228 360 141 431 214 -399 -261 102 620 -18 782 -11 -1730 -895 -762 -557 -10 -2 -673 -762 -203 -621 -410 14 -544 -141 -445 -211 814 776 502 1031 175 611 811 481 97 428 446 1223 1035 1790 633 -1073 -196 -1084 552 1533 331 460 -205 490 178 -558 -472 -1485 -450 -286 -1126 -668 -2059 -2296 -522 -547 107 120 959 547 357 591 -642 44 1049 506 -121 1247 728 -696 -538 -1571 -1876 200 518 -1793 -358 -941 -416 406 1031 469 234 203 -114 -65 779 -297 722 511 -85 -454 701 2 1024 1300 -959 688 1299 471 810 -610 -853 -534 617 -78 -873 493 247 -705 50 -1052 SS 20230704T130429.3Z 8585.544783 282 1 47.56 2 51.36 92.30 118.46 258.99 0.00 1 0.00 1 0 17 1.046e-02 7.323e-03 9.427e-04 4.380e-04 2.240004e-01 2.393586e-04 2.699459e-03 -6.000000e+00 6.452932e-03 232.95 -2.00 3.52 -2.00 316.33 0.00e+00 2.091144e-04 2.742562e-05 8.061584e-05 -6.000000e+00 2.856438e-04 288.27 -2.00 20.00 -2.00 315.56 0.00e+00 1.598 0.000 302.00 328.00 3 2.6257e+00 6.2825e-04 2.0014e-02 -6.0000e+00 1.6201e-02 1.4545e-02 6.9705e-04 1.1826e-02 -6.0000e+00 1.7424e-02 3.9900e-03 4.0160e-04 5.7077e-03 -6.0000e+00 1.0369e-02 -6.2513e-03 1.8532e-04 1.5539e-03 -6.0000e+00 4.3915e-03 5.9277e-03 6.2570e-07 1.3646e-05 2.0295e-05 -6.0000e+00 3.1133e-04 -9.9845e-03 6.4743e-05 11 9 0 11 8 0 99.99 21.84 0.19 -0.00998 -0.00998 706 170 1 5 0 67.360 26.21 19.98 21.84 31.73 38.4 1067.82 1326 -890 428 -2362 -4596 -778 234 1382 1920 724 -2559 -1569 297 -351 1004 439 -994 470 116 1323 1023 -517 971 799 310 746 733 -942 -483 197 1818 -46 2153 -11 -4154 -2255 -1437 -1231 183 -86 -1036 -1301 -338 -925 -520 -46 -750 -326 -810 -514 977 878 537 1277 172 746 974 649 210 547 649 1371 1044 2024 704 -1203 -220 -1214 625 1642 341 395 -207 555 217 -598 -535 -1719 -525 -170 -1182 -713 -1889 -1956 -459 -392 20 165 811 522 386 538 -566 111 957 441 -84 1002 606 -473 -440 -1374 -1634 108 384 -1322 -276 -704 -255 252 742 358 117 102 -96 -93 617 -208 511 315 -148 -308 528 -84 814 912 -766 480 923 360 487 -455 -560 -327 537 20 -526 277 163 -470 38 -630 232 -166 79 -407 -807 -132 42 251 377 148 -531 -342 71 -95 300 141 -332 161 41 480 375 -191 339 293 119 291 279 -367 -178 72 698 -17 858 -4 -1633 -906 -640 -639 103 -55 -708 -923 -228 -625 -374 -33 -521 -221 -540 -347 691 613 394 975 135 594 782 518 166 437 541 1218 928 1849 625 -1066 -185 -1022 565 1533 342 407 -211 537 195 -519 -430 -1363 -443 -159 -1157 -758 -2011 -2199 -549 -469 25 208 1007 614 445 568 -595 116 1003 509 -100 1293 803 -610 -534 -1665 -1947 127 484 -1760 -363 -968 -367 362 1093 521 171 138 -127 -118 796 -283 703 455 -217 -444 734 -118 1082 1157 -949 607 1234 510 679 -652 -823 -502 823 32 -862 461 269 -759 59 -964 SS 20230704T131039.3Z 8585.549066 285 1 0.80 2 50.21 93.36 119.53 259.87 0.00 1 0.00 1 0 25 1.302e-02 8.825e-03 7.015e-03 4.078e-03 2.155764e-01 2.235821e-03 2.615932e-03 -6.000000e+00 8.029932e-03 232.95 -2.00 3.52 -2.00 315.66 0.00e+00 4.773221e-04 2.208539e-04 2.856128e-05 -6.000000e+00 3.554929e-04 288.27 -2.00 20.00 -2.00 314.93 0.00e+00 1.559 0.000 302.00 328.00 3 2.6260e+00 5.8185e-03 1.9431e-02 -6.0000e+00 2.0160e-02 4.8518e-04 6.4321e-03 1.1393e-02 -6.0000e+00 2.1685e-02 6.4900e-03 3.6758e-03 5.5030e-03 -6.0000e+00 1.2904e-02 -4.4052e-03 1.6444e-03 1.5339e-03 -6.0000e+00 5.4635e-03 6.2733e-03 -3.2968e-04 1.2526e-04 2.0572e-05 -6.0000e+00 3.8765e-04 -9.8730e-03 -5.9138e-06 12 9 1 12 1 1 999.00 21.83 0.24 -0.00987 -0.01235 2 55 1 5 0 210.240 26.21 20.00 21.83 32.47 38.4 1072.33 -427 -647 -126 -2594 -5192 -888 -1635 4204 2032 3288 -3194 -1257 -272 1404 582 1460 -607 -153 329 916 3262 65 621 1088 -967 2115 -732 -576 -14 -371 1607 -685 2227 -334 -4344 -3464 -729 -1393 -72 1027 -318 -2550 -783 -1500 -345 118 -348 -527 -1259 -472 1546 592 848 892 810 1341 1646 -61 297 -215 11 1717 1662 1696 1266 -1510 529 -1228 466 1545 -214 503 16 61 376 -254 -454 -1515 -698 98 -1689 -807 -2717 -1599 42 -858 -431 433 844 675 -30 695 -1009 178 1532 530 323 1540 335 -302 -509 -908 -1268 -420 340 -1308 -151 -546 -506 293 151 888 366 -17 -768 -402 400 -487 151 838 -30 -291 369 53 917 869 -1030 305 1248 292 810 -186 -525 -408 638 -157 -459 156 306 -556 -44 -634 -105 -167 -32 -619 -1250 -205 -408 1019 546 896 -911 -373 -90 476 222 589 -240 -63 138 396 1385 28 279 510 -451 977 -339 -263 -6 -161 727 -333 1061 -161 -2170 -1682 -385 -815 -47 704 -235 -1900 -588 -1132 -257 87 -262 -389 -916 -346 1180 459 685 721 665 1117 1383 -52 247 -182 10 1532 1578 1601 1200 -1350 463 -1085 424 1481 -222 510 16 61 361 -231 -383 -1318 -619 92 -1701 -845 -2927 -1797 48 -1017 -532 538 1035 814 -34 765 -1049 190 1663 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