File name: Pandora25s1_HoustonTX_20231120_L2Fit_fout2c9d20230101p1-8.txt File generation date: 20241218T042015.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c9p1-8 Local principal investigator: Jimmy Flynn Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 25 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora25_OF_v7d20190903.txt Instrument calibration file used: Pandora25s1_CF_v9d20230101.txt Level 1 file used: Pandora25s1_HoustonTX_20231120_L1_smca1c9d20230101p1-8.txt Full location name: University Of Houston Short location name: HoustonTX Country of location: United States Location latitude [deg]: 29.7200 Location longitude [deg]: -95.3400 Location altitude [m]: 19 Local noon date: 20231120 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: Modification of session 8, but repeated E-MLE of HCHO. First and last pixel inside fitting window: 281 423 Nominal wavelengths inside fitting window [nm]: 305.0808 305.2213 305.3618 305.5022 305.6427 305.7831 305.9235 306.0640 306.2044 306.3447 306.4851 306.6255 306.7658 306.9062 307.0465 307.1868 307.3272 307.4675 307.6077 307.7480 307.8883 308.0285 308.1688 308.3090 308.4492 308.5894 308.7296 308.8698 309.0100 309.1501 309.2903 309.4304 309.5705 309.7106 309.8507 309.9908 310.1309 310.2710 310.4110 310.5511 310.6911 310.8311 310.9711 311.1111 311.2511 311.3911 311.5310 311.6710 311.8109 311.9508 312.0907 312.2306 312.3705 312.5104 312.6503 312.7901 312.9300 313.0698 313.2096 313.3494 313.4892 313.6290 313.7688 313.9085 314.0483 314.1880 314.3277 314.4675 314.6072 314.7468 314.8865 315.0262 315.1658 315.3055 315.4451 315.5847 315.7243 315.8639 316.0035 316.1431 316.2826 316.4222 316.5617 316.7013 316.8408 316.9803 317.1198 317.2592 317.3987 317.5382 317.6776 317.8170 317.9564 318.0958 318.2352 318.3746 318.5140 318.6534 318.7927 318.9320 319.0714 319.2107 319.3500 319.4893 319.6285 319.7678 319.9070 320.0463 320.1855 320.3247 320.4639 320.6031 320.7423 320.8815 321.0206 321.1598 321.2989 321.4380 321.5771 321.7162 321.8553 321.9944 322.1334 322.2725 322.4115 322.5506 322.6896 322.8286 322.9676 323.1065 323.2455 323.3845 323.5234 323.6623 323.8012 323.9402 324.0790 324.2179 324.3568 324.4957 324.6345 324.7733 324.9122 --------------------------------------------------------------------------------------- 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 20231120T142917.3Z 8724.603672 80 1 49.36 2 72.03 126.40 151.29 66.76 0.00 1 0.00 1 0 17 1.333e-01 1.387e-02 2.405e-02 2.935e-03 3.579374e-01 1.486816e-03 3.981963e-03 -6.000000e+00 7.641850e-02 224.93 -2.00 3.24 -2.00 318.93 0.00e+00 1.797982e-03 3.466092e-04 1.078848e-04 -6.000000e+00 3.480709e-03 288.21 -2.00 20.00 -2.00 318.12 0.00e+00 3.198 0.000 302.00 328.00 3 4.3124e+00 4.1014e-03 3.6027e-02 -6.0000e+00 1.8819e-01 4.0098e-02 4.7520e-03 1.7261e-02 -6.0000e+00 2.0430e-01 -2.4618e-02 3.2424e-03 8.4887e-03 -6.0000e+00 1.2238e-01 1.2526e-02 1.6930e-03 2.8585e-03 -6.0000e+00 5.2673e-02 1.9129e-04 -1.2557e-03 8.7908e-05 3.1723e-05 -6.0000e+00 3.7301e-03 8.7654e-03 0.0000e+00 12 8 8 10 0 0 99.98 24.66 0.33 0.00877 -0.00067 80 17 1 5 0 616.880 27.15 20.00 24.66 30.35 30.4 1079.47 -111655 24563 -5221 15999 -1401 -3012 68967 -7844 62287 -4412 -4120 18084 -6298 3937 2551 11523 7941 18878 4093 13367 7882 8651 -2535 2294 -5018 6143 -288 406 -160 -6654 12356 598 6912 2240 -792 4324 8748 15391 4918 -943 -846 1718 -1195 340 2393 1471 -2871 -1171 3767 2128 2951 839 -184 2678 1638 985 1135 -2501 -733 -795 1309 295 1280 237 -37 -212 442 -642 1924 631 122 -233 -391 -924 805 1276 -2915 359 406 486 -1205 -1033 -2586 -660 -1058 -1442 -697 -328 -752 285 924 136 785 -151 235 637 60 370 121 -824 468 -966 -346 -1010 134 -416 -1007 -782 450 204 -34 426 -141 355 29 600 517 383 -330 -285 -244 109 546 325 610 931 627 1244 725 230 332 -19 69 941 -296 -268 -452 169 -496 -374 -125 -646 -151 -12680 903 -256 616 -58 -123 1591 -396 1854 -248 -233 894 -445 297 225 1038 788 1790 465 1449 913 994 -332 304 -749 860 -43 57 -22 -979 1663 99 1179 411 -143 739 1561 3000 1248 -290 -284 593 -438 125 867 540 -1093 -437 1346 789 1154 360 -84 1266 810 502 587 -1335 -379 -410 682 166 777 155 -25 -134 266 -386 1204 443 93 -186 -312 -717 580 839 -1838 214 254 338 -950 -892 -2407 -632 -1073 -1553 -779 -376 -867 319 971 134 728 -138 226 667 70 465 161 -1106 595 -1163 -394 -1168 163 -532 -1345 -1085 648 312 -55 699 -230 553 43 844 721 551 -500 -452 -394 173 852 495 895 1316 860 1697 1045 355 538 -33 118 1644 -544 -512 -884 334 -991 -738 -238 -1205 -274 SS 20231120T170717.2Z 8724.713393 185 1 22.37 2 51.51 161.96 118.90 91.64 0.00 1 0.00 1 0 17 7.942e-03 5.347e-03 2.621e-03 1.644e-03 1.862732e-01 8.425804e-04 2.112853e-03 -6.000000e+00 4.557203e-03 224.92 -2.00 3.24 -2.00 315.32 0.00e+00 1.300304e-04 7.953350e-05 2.251092e-05 -6.000000e+00 2.074453e-04 288.20 -2.00 20.00 -2.00 314.63 0.00e+00 1.603 0.000 302.00 328.00 3 4.6925e+00 2.1516e-03 1.8168e-02 -6.0000e+00 1.1223e-02 3.3017e-02 2.3988e-03 8.7705e-03 -6.0000e+00 1.2179e-02 1.2903e-03 1.3766e-03 4.3168e-03 -6.0000e+00 7.2957e-03 -3.1314e-03 6.2353e-04 1.2244e-03 -6.0000e+00 3.1441e-03 8.1139e-04 -1.7509e-04 4.7812e-05 1.6535e-05 -6.0000e+00 2.2211e-04 8.2217e-04 0.0000e+00 12 1 1 12 1 1 99.99 24.64 0.23 0.00082 -0.00049 18 9 1 5 0 1177.300 27.15 20.00 24.64 31.95 30.7 1090.67 247 -618 -1956 -1860 -3083 -957 2125 902 2725 -211 -914 292 -1301 938 226 -1192 73 956 216 1404 467 795 294 496 27 -22 -73 -1196 401 -318 2087 1421 1020 -407 -1841 -823 -270 1061 578 -691 -973 -460 -1022 -753 -255 -756 -1602 -629 -492 -196 482 498 907 648 674 748 663 -295 548 526 778 552 965 1178 -89 -370 -508 100 727 589 396 84 75 478 301 430 -348 -255 14 -386 -800 -1288 -1691 -1099 -849 -774 -320 0 -116 364 373 458 220 617 269 652 197 521 55 -215 -301 -312 -153 -97 -583 -690 -389 -836 31 312 324 138 64 137 166 289 449 -34 107 -134 -337 -69 134 234 216 577 241 940 330 317 122 -178 -280 312 -217 -151 74 186 -124 -205 -147 -402 -188 70 -187 -600 -533 -812 -240 545 257 824 -67 -288 92 -450 349 92 -517 32 426 99 651 220 371 140 244 14 -11 -38 -593 186 -145 963 689 519 -211 -920 -403 -140 608 375 -498 -742 -359 -813 -600 -202 -598 -1254 -478 -366 -145 365 392 736 542 573 643 575 -257 470 450 678 502 917 1154 -88 -346 -450 86 645 562 400 87 78 488 296 395 -301 -212 11 -347 -774 -1325 -1812 -1208 -969 -921 -393 -1 -146 448 439 510 231 629 280 714 230 640 70 -274 -372 -368 -175 -112 -709 -870 -504 -1111 42 436 465 200 90 187 215 359 551 -43 140 -183 -470 -96 184 314 282 729 296 1140 412 410 163 -241 -384 433 -310 -223 112 283 -190 -313 -220 -593 -273 SS 20231120T171117.8Z 8724.716179 188 1 21.85 2 51.25 163.12 118.06 92.09 0.00 1 0.00 1 0 17 6.807e-03 5.300e-03 2.758e-04 1.858e-04 1.825603e-01 9.555707e-05 2.093518e-03 -6.000000e+00 3.905640e-03 224.92 -2.00 3.24 -2.00 315.02 0.00e+00 1.758445e-04 8.499278e-06 2.429321e-05 -6.000000e+00 1.777964e-04 288.20 -2.00 20.00 -2.00 314.36 0.00e+00 1.594 0.000 302.00 328.00 3 4.7420e-01 2.4333e-04 1.8024e-02 -6.0000e+00 9.6182e-03 1.8910e-03 2.7074e-04 8.6483e-03 -6.0000e+00 1.0438e-02 2.2654e-03 1.5543e-04 4.2570e-03 -6.0000e+00 6.2528e-03 -2.0047e-03 6.9572e-05 1.2143e-03 -6.0000e+00 2.6943e-03 5.6684e-02 -1.1406e-04 5.4128e-06 1.6987e-05 -6.0000e+00 1.9039e-04 1.6849e-03 0.0000e+00 12 1 1 12 1 1 99.97 24.65 0.30 0.00168 0.00083 1140 562 1 5 0 18.650 27.15 19.99 24.65 32.43 30.7 1093.38 -310 -1068 -1411 -2577 -2040 -991 211 1192 921 -225 -614 -20 274 301 569 -147 63 587 587 927 533 535 985 579 267 171 -346 -384 192 912 1344 1491 1132 -538 -1440 -828 -781 -71 31 -646 -911 -879 -852 -1044 -658 -668 -826 -565 -612 85 474 653 742 783 516 763 521 475 510 693 899 1009 1073 801 65 -300 -94 -104 714 470 -54 -17 -121 84 87 6 26 -33 174 -349 -822 -1012 -1618 -1326 -918 -746 -462 -195 -28 148 268 438 486 903 834 375 442 419 -68 -316 -201 -357 37 249 -533 -892 -558 -570 -235 192 23 -13 -39 69 67 469 485 331 209 -62 -419 -209 -8 146 434 565 540 1081 707 388 236 -43 55 158 26 -108 -283 25 -257 -265 -218 -268 -356 -99 -366 -483 -820 -615 -284 64 370 315 -80 -215 -7 106 123 258 -68 30 282 290 470 274 273 509 297 144 95 -190 -197 96 440 669 786 602 -293 -742 -441 -427 -42 21 -482 -706 -708 -702 -829 -542 -545 -658 -433 -476 65 360 525 600 661 448 671 465 423 447 604 805 923 1014 798 65 -287 -85 -91 653 445 -54 -17 -127 85 86 6 23 -28 152 -311 -789 -1027 -1761 -1453 -1031 -866 -565 -239 -34 182 315 486 508 932 856 405 508 511 -85 -396 -246 -418 43 292 -634 -1133 -715 -736 -316 263 33 -18 -55 93 84 570 601 411 269 -84 -584 -290 -10 197 554 708 666 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