File name: Pandora187s1_PittsburghPA_20210915_L2Fit_fout2c2d20210902p1-8.txt File generation date: 20251128T073646.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Luke Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 187 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora187_OF_v2d20210517.txt Instrument calibration file used: Pandora187s1_CF_v2d20210902.txt Level 1 file used: Pandora187s1_PittsburghPA_20210915_L1_smca1c2d20210902p1-8.txt Full location name: Pittsburgh, PA - Lawrenceville ACHD (USEPA AQS ID 42-003-0008) Short location name: PittsburghPA Country of location: United States Location latitude [deg]: 40.4655 Location longitude [deg]: -79.9608 Location altitude [m]: 265 Local noon date: 20210915 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: 194 335 Nominal wavelengths inside fitting window [nm]: 305.1270 305.2683 305.4097 305.5510 305.6924 305.8337 305.9750 306.1163 306.2576 306.3989 306.5402 306.6814 306.8227 306.9639 307.1051 307.2464 307.3876 307.5288 307.6699 307.8111 307.9523 308.0934 308.2346 308.3757 308.5168 308.6579 308.7990 308.9401 309.0812 309.2222 309.3633 309.5043 309.6454 309.7864 309.9274 310.0684 310.2094 310.3504 310.4914 310.6323 310.7733 310.9142 311.0551 311.1960 311.3369 311.4778 311.6187 311.7596 311.9004 312.0413 312.1821 312.3230 312.4638 312.6046 312.7454 312.8862 313.0269 313.1677 313.3084 313.4492 313.5899 313.7306 313.8713 314.0120 314.1527 314.2934 314.4341 314.5747 314.7154 314.8560 314.9966 315.1372 315.2778 315.4184 315.5590 315.6996 315.8401 315.9807 316.1212 316.2617 316.4022 316.5427 316.6832 316.8237 316.9642 317.1046 317.2451 317.3855 317.5259 317.6663 317.8067 317.9471 318.0875 318.2279 318.3682 318.5086 318.6489 318.7892 318.9295 319.0698 319.2101 319.3504 319.4907 319.6309 319.7712 319.9114 320.0516 320.1919 320.3321 320.4723 320.6124 320.7526 320.8928 321.0329 321.1730 321.3132 321.4533 321.5934 321.7335 321.8735 322.0136 322.1537 322.2937 322.4337 322.5738 322.7138 322.8538 322.9938 323.1337 323.2737 323.4137 323.5536 323.6935 323.8335 323.9734 324.1133 324.2532 324.3930 324.5329 324.6728 324.8126 324.9524 --------------------------------------------------------------------------------------- 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 20210915T120926.5Z 7928.506557 362 1 6.28 2 77.83 96.76 163.93 330.57 0.00 1 0.00 1 0 17 2.978e-01 1.152e-02 4.075e-01 1.818e-02 5.362573e-01 9.730872e-03 6.095587e-03 -6.000000e+00 1.737719e-01 229.11 -2.00 3.49 -2.00 320.72 0.00e+00 3.610759e-03 4.130921e-03 6.433347e-04 -6.000000e+00 7.788647e-03 286.87 -2.00 20.00 -2.00 320.06 0.00e+00 4.603 0.002 302.00 328.00 3 2.6139e+00 3.1420e-02 5.3102e-02 -6.0000e+00 4.3276e-01 1.7296e-02 4.0566e-02 2.9928e-02 -6.0000e+00 4.6961e-01 -2.6259e-02 3.6883e-02 1.4590e-02 -6.0000e+00 2.7897e-01 -1.7214e-04 1.8098e-02 6.7440e-03 -6.0000e+00 1.1783e-01 2.5537e-04 -5.8908e-04 5.4121e-04 6.2380e-05 -6.0000e+00 8.4674e-03 2.1556e-02 5.9800e-04 12 9 9 12 1 1 -250.05 18.90 0.59 0.02156 0.01713 3 9 1 5 0 1526.920 22.19 15.00 18.90 29.83 10.5 999.98 -64681 -148246 -82761 -73667 -39594 -7964 900000 -83183 -25741 -107656 77533 -113704 900000 -9966 -47635 24064 -55272 101946 21124 79753 19082 6694 44430 43383 3595 -27492 -31815 90216 -17549 -9745 -11559 9998 28048 -12445 634 -2421 -8082 336 8138 -5891 -6453 8540 5923 -4246 -954 2227 2949 269 -9439 3587 3034 7122 1199 8446 4710 3969 4313 23 -899 1908 -2958 3668 6276 1916 2896 1064 -834 4041 169 254 -244 -1015 -196 438 1283 -188 -1589 -4159 -3189 -1016 -2399 -1956 -3388 857 -1161 -973 1910 1937 592 1153 -122 302 1316 356 -2109 358 234 143 -320 -296 -210 -1 61 -339 -1664 -1008 -678 284 1414 586 41 1612 309 -1430 -289 -1034 -841 -929 180 0 58 1781 -739 178 -489 -278 1100 163 1415 -590 -796 736 -254 477 866 -413 505 -35 197 -242 -329 -1019 -1146 -2845 -1466 -1305 -701 -141 900000 -1474 -456 -2081 1374 -2930 900000 -177 -1228 426 -1958 1806 408 1413 400 162 787 838 110 -1196 -1435 1598 -678 -392 -558 451 1175 -782 34 -140 -573 27 721 -693 -832 1004 744 -602 -134 309 413 40 -1612 584 552 1365 265 1850 1115 978 1070 6 -227 479 -843 1099 2052 697 1026 370 -297 1464 73 122 -125 -530 -97 201 527 -72 -601 -1735 -1531 -556 -1519 -1358 -2537 657 -974 -862 1705 1741 525 951 -95 220 948 281 -1950 371 277 169 -384 -335 -237 -1 63 -378 -1999 -1268 -830 373 2023 925 69 2635 490 -2168 -413 -1487 -1261 -1484 298 0 94 2755 -1131 259 -687 -377 1513 251 2388 -1104 -1574 1382 -510 1013 1929 -956 1181 -83 447 -523 -675 -2060 SS 20210915T122422.1Z 7928.516922 461 1 45.57 2 75.02 99.28 165.01 341.72 0.00 1 0.00 1 0 25 1.095e-01 7.507e-03 1.598e-01 5.371e-03 4.526917e-01 2.761573e-03 5.283613e-03 -6.000000e+00 6.341110e-02 229.11 -2.00 3.49 -2.00 320.06 0.00e+00 -1.165026e-06 9.440220e-04 8.821663e-04 -6.000000e+00 2.846549e-03 286.87 -2.00 20.00 -2.00 319.33 0.00e+00 3.793 0.001 302.00 328.00 3 3.4147e+00 8.2809e-03 4.3894e-02 -6.0000e+00 1.5777e-01 -9.7097e-03 1.0157e-02 2.4475e-02 -6.0000e+00 1.7115e-01 8.0409e-03 8.6006e-03 1.1724e-02 -6.0000e+00 1.0208e-01 -8.5381e-03 4.3966e-03 3.2416e-03 -6.0000e+00 4.3254e-02 2.6799e-04 -9.6859e-04 1.6035e-04 3.8576e-05 -6.0000e+00 3.0618e-03 9.1543e-03 -4.6787e-05 11 8 0 10 0 0 99.12 18.90 0.44 0.00915 0.00188 23 7 1 5 0 1980.750 22.19 15.00 18.90 30.07 10.6 1002.19 70167 50658 19985 -11969 -53763 5857 -12144 -42063 19007 -15504 18688 26574 -2328 18489 -14983 -3818 -7669 11376 -5896 7690 2150 -4965 -2304 5225 -2222 -5296 3358 9464 -7004 -2116 5934 -6393 12099 1985 -5887 -2288 -3382 -8017 -2343 -410 -5002 -1170 1270 1675 -1484 2189 -3415 -2315 -6606 767 764 -1041 -717 719 1648 78 639 548 3307 -108 1293 2368 3809 1829 3058 229 122 -530 1290 323 1020 971 12 227 -88 -603 -2635 -761 -1777 -1207 -2108 -1901 -2141 -683 -11 106 648 1103 1030 1552 670 -7 1174 -656 -510 -518 918 40 -67 -367 -642 -217 276 -604 -1286 -844 -636 -249 1051 659 118 1096 360 -342 -262 -268 -549 -508 -838 -291 -475 442 -158 100 -376 -703 1540 520 833 217 638 296 601 161 -153 -317 24 -358 -319 101 -34 -356 367 354 192 -146 -939 59 -164 -881 241 -291 261 394 -56 436 -582 -148 -335 442 -288 342 102 -260 -127 290 -142 -361 205 516 -449 -141 417 -575 987 177 -547 -219 -379 -1144 -382 -75 -1037 -245 267 354 -327 468 -775 -526 -1617 188 206 -310 -230 241 569 28 232 196 1132 -39 494 994 1739 892 1424 104 56 -258 701 198 657 631 8 134 -47 -293 -1266 -380 -1028 -801 -1595 -1569 -1877 -631 -10 101 641 1093 991 1502 604 -6 974 -597 -522 -555 1095 52 -87 -454 -727 -227 291 -690 -1574 -1081 -861 -359 1637 1035 194 1756 594 -530 -385 -392 -842 -829 -1345 -470 -752 724 -251 151 -547 -986 2159 805 1312 370 1133 547 1164 332 -311 -666 50 -767 -662 213 -68 -704 SS 20210915T123141.7Z 7928.522011 488 1 5.65 2 73.65 100.54 165.36 347.66 0.00 1 0.00 1 0 25 8.131e-02 7.937e-03 1.406e-01 9.521e-03 4.220022e-01 4.882025e-03 4.960160e-03 -6.000000e+00 4.704148e-02 229.11 -2.00 3.49 -2.00 319.64 0.00e+00 6.275214e-04 1.435410e-03 4.381962e-04 -6.000000e+00 2.113126e-03 286.87 -2.00 20.00 -2.00 318.87 0.00e+00 3.494 0.001 302.00 328.00 3 2.7433e+00 1.4086e-02 4.0459e-02 -6.0000e+00 1.1704e-01 -2.5383e-03 1.6746e-02 2.2354e-02 -6.0000e+00 1.2699e-01 -1.6615e-02 1.3036e-02 1.0826e-02 -6.0000e+00 7.5739e-02 3.9122e-03 6.7781e-03 3.0202e-03 -6.0000e+00 3.2073e-02 7.1870e-04 -1.7845e-03 2.8484e-04 3.5026e-05 -6.0000e+00 2.2727e-03 1.1520e-02 -1.1036e-04 12 9 1 12 1 1 81.08 18.89 0.25 0.01152 -0.00189 4 13 1 5 0 1093.970 22.19 15.00 18.89 30.11 10.6 1002.45 -16786 3155 -43230 -22860 -47996 24629 -30991 -31397 -13711 1773 -6028 6888 -12569 11356 -8757 1680 3420 328 -6575 -6777 5599 -11876 5531 -4878 10942 -3355 1690 3305 -285 6817 -7420 -503 -350 3461 -1790 -3728 -2890 107 -511 2419 -3789 -2212 -1637 -642 1645 -1431 40 -1886 -730 827 2269 1355 908 -9 3839 -685 264 -846 878 412 993 1674 2600 247 2020 176 -1574 -147 1289 1368 828 674 -211 -179 856 -134 -1540 186 -490 -1893 -1954 -1216 -1753 -1088 -428 -99 -666 573 1506 2090 726 -320 479 2 74 573 1354 11 -375 -1018 -1788 -162 332 -1254 -1535 -723 -935 74 647 1430 -147 353 935 -96 145 -963 -549 -418 -352 -433 -4 427 -24 342 -151 445 1144 97 265 589 359 651 506 150 -323 -398 178 -285 -259 533 -325 -733 -336 56 -1235 -490 -1234 317 -775 -897 -362 42 -159 182 -485 414 -457 88 188 20 -451 -484 386 -992 415 -438 889 -324 152 276 -24 591 -838 -60 -45 420 -220 -496 -440 19 -111 535 -961 -578 -437 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