File name: Pandora132s1_Berlin_20240606_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T221022.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c13p1-8 Local principal investigator: Thomas Ruhtz Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 132 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora132_OF_v1d20200910.txt Instrument calibration file used: Pandora132s1_CF_v13d20210422.txt Level 1 file used: Pandora132s1_Berlin_20240606_L1_smca1c13d20210422p1-8.txt Full location name: Institute of Space Sciences FU Berlin Short location name: Berlin Country of location: Germany Location latitude [deg]: 52.4600 Location longitude [deg]: 13.3100 Location altitude [m]: 100 Local noon date: 20240606 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: Modification of session 11, but different RefDay (April 2021). First and last pixel inside fitting window: 243 385 Nominal wavelengths inside fitting window [nm]: 305.1071 305.2480 305.3889 305.5298 305.6707 305.8116 305.9524 306.0932 306.2341 306.3749 306.5157 306.6565 306.7973 306.9380 307.0788 307.2195 307.3603 307.5010 307.6417 307.7824 307.9231 308.0638 308.2044 308.3451 308.4857 308.6264 308.7670 308.9076 309.0482 309.1888 309.3293 309.4699 309.6104 309.7510 309.8915 310.0320 310.1725 310.3130 310.4534 310.5939 310.7344 310.8748 311.0152 311.1556 311.2960 311.4364 311.5768 311.7172 311.8575 311.9979 312.1382 312.2785 312.4188 312.5591 312.6994 312.8397 312.9800 313.1202 313.2604 313.4007 313.5409 313.6811 313.8213 313.9615 314.1016 314.2418 314.3819 314.5221 314.6622 314.8023 314.9424 315.0825 315.2225 315.3626 315.5026 315.6427 315.7827 315.9227 316.0627 316.2027 316.3427 316.4827 316.6226 316.7626 316.9025 317.0424 317.1823 317.3222 317.4621 317.6020 317.7418 317.8817 318.0215 318.1613 318.3012 318.4410 318.5807 318.7205 318.8603 319.0000 319.1398 319.2795 319.4192 319.5589 319.6986 319.8383 319.9780 320.1177 320.2573 320.3969 320.5366 320.6762 320.8158 320.9554 321.0949 321.2345 321.3741 321.5136 321.6531 321.7927 321.9322 322.0717 322.2111 322.3506 322.4901 322.6295 322.7689 322.9084 323.0478 323.1872 323.3266 323.4659 323.6053 323.7447 323.8840 324.0233 324.1627 324.3020 324.4413 324.5805 324.7198 324.8591 324.9983 --------------------------------------------------------------------------------------- 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 20240606T041912.8Z 8923.180009 104 1 49.43 2 78.87 67.09 73.84 68.70 0.00 1 0.00 1 0 17 6.005e-01 1.536e-02 2.494e-01 5.796e-03 7.810028e-01 3.318483e-03 9.383633e-03 -6.000000e+00 3.529676e-01 232.86 -2.00 3.85 -2.00 321.79 0.00e+00 7.210031e-03 1.739073e-03 2.329694e-03 -6.000000e+00 1.528705e-02 278.94 -2.00 20.00 -2.00 321.30 0.00e+00 4.996 0.003 302.00 328.00 3 1.9682e+00 1.1930e-02 7.1434e-02 -6.0000e+00 8.9152e-01 2.8063e-01 1.7133e-02 5.5623e-02 -6.0000e+00 9.6682e-01 -4.1935e-01 1.7777e-02 2.5674e-02 -6.0000e+00 5.6921e-01 1.7819e-01 8.2198e-03 1.0851e-02 -6.0000e+00 2.3821e-01 2.2335e-04 -1.6016e-03 1.6524e-04 1.1282e-04 -6.0000e+00 1.6633e-02 8.3607e-02 0.0000e+00 12 9 8 11 4 0 57.83 27.05 0.23 0.08361 0.07157 128 27 4 8 0 386.090 14.98 27.05 19.78 31.74 32.08 30.5 987.59 -151880 -225885 -185393 -184571 -248407 -53327 -235164 900000 -230780 -145750 -218175 -100595 67756 -122440 14354 -86660 -24235 -87161 900000 -67598 30962 -61772 -68634 25904 -96098 19859 -70250 29947 -62371 29152 -13621 20521 18502 11159 23436 -54058 20666 -22224 42665 12035 23558 16614 11730 15698 1183 12507 11183 42440 2506 19986 6818 18829 24550 654 17477 8542 22284 -5458 16884 4833 12521 7418 15601 11074 3281 16029 382 11806 1368 7517 2246 3848 3737 2163 2283 -972 4765 -6244 2609 -983 1305 -2498 -67 -1152 -2291 743 -1710 1799 -859 1390 -1297 -461 -2626 -710 -1263 -2083 372 -1343 -447 -1962 597 -1172 847 -1507 -2647 -382 -1868 330 -1284 313 -340 463 -415 -385 1121 -23 101 -1051 273 -437 1542 472 867 1652 712 1049 1049 957 -463 951 -591 836 366 31 -243 -184 588 -177 -139 -613 -112 -879 900000 -1092 -3712 -1999 -1801 -4337 -301 -4106 900000 -4504 -1400 -4482 -909 383 -2421 89 -1713 -288 -2117 900000 -1451 245 -1256 -1590 249 -3257 213 -1826 288 -1656 379 -339 429 429 271 490 -2626 560 -1130 1350 585 1105 882 676 887 80 777 739 2182 208 1558 686 1861 2496 90 2113 1158 2618 -820 1984 658 1740 1249 2516 2019 649 2766 80 2450 363 2081 686 1144 1046 559 528 -217 1128 -1700 781 -363 544 -1198 -34 -620 -1325 439 -1068 1082 -513 762 -685 -233 -1412 -424 -891 -1740 351 -1422 -478 -2009 533 -963 673 -1303 -2462 -367 -1954 374 -1681 453 -533 733 -648 -574 1587 -33 152 -1686 448 -713 2358 697 1233 2251 943 1343 1404 1454 -819 1845 -1252 1849 869 78 -599 -463 1487 -490 -368 -1527 -257 -1958 900000 SS 20240606T042552.7Z 8923.184638 107 1 50.18 2 77.93 68.33 72.91 69.85 0.00 1 0.00 1 0 17 5.456e-01 9.290e-03 2.411e-01 4.248e-03 7.288776e-01 2.376025e-03 8.841223e-03 -6.000000e+00 3.192947e-01 232.86 -2.00 3.85 -2.00 321.56 0.00e+00 5.862221e-03 1.195267e-03 8.592042e-04 -6.000000e+00 1.366136e-02 278.94 -2.00 20.00 -2.00 321.05 0.00e+00 4.637 0.002 302.00 328.00 3 1.9018e+00 8.2721e-03 6.4253e-02 -6.0000e+00 8.0400e-01 1.1734e-01 1.1916e-02 4.5816e-02 -6.0000e+00 8.7045e-01 -1.5029e-01 1.2738e-02 2.4400e-02 -6.0000e+00 5.1495e-01 5.4593e-02 5.9435e-03 9.8524e-03 -6.0000e+00 2.1643e-01 3.5857e-04 -1.2531e-03 1.2146e-04 1.1491e-04 -6.0000e+00 1.5019e-02 8.3230e-02 0.0000e+00 11 9 0 11 4 0 40.07 27.06 0.34 0.08323 0.07381 168 36 4 8 0 295.150 14.98 27.06 20.20 31.74 32.08 30.5 989.35 -124077 -188060 -205382 -139124 -211688 -82403 -238954 136965 -223868 -56766 -184489 -97790 -115804 -137181 -39798 -58738 -20944 -73933 -147 -56767 -48939 -50499 -23914 -58177 -28726 8091 -65499 -31154 -26443 -6870 12732 -10750 -18025 -17303 -8222 -6911 -1716 -15713 16633 -342 11786 1776 11259 15054 196 2157 -907 12927 7223 8980 8490 13125 5506 3258 7012 2639 3914 -4925 7179 3524 6334 3637 6459 3306 2503 3262 2076 4840 663 3176 1303 1036 1146 1546 81 -906 1035 -3377 -947 -691 -1708 -1548 -1275 -2367 -1164 -275 -700 162 -187 2188 816 -67 -308 -6 -279 -842 578 358 -379 -679 -536 -529 -334 -1612 -1892 -542 -1039 -24 367 288 -94 570 -509 292 348 473 392 388 -153 -523 445 349 392 727 3 -95 1448 709 -241 88 -648 184 -48 36 -278 -237 434 -70 105 -135 -53 -291 900000 -514 -1487 -1933 -629 -1913 -341 -3419 567 -3372 -235 -2522 -729 -1391 -2670 -363 -754 -208 -1378 -1 -987 -790 -858 -337 -1253 -488 97 -1628 -555 -493 -128 243 -307 -605 -566 -242 -218 -61 -794 730 -20 674 119 713 941 15 164 -75 985 631 863 928 1522 753 442 1054 389 569 -838 1064 559 1078 664 1306 742 565 722 482 1212 200 1036 454 359 375 460 22 -231 263 -1011 -331 -285 -818 -818 -718 -1434 -742 -184 -483 111 -124 1327 470 -37 -178 -4 -212 -749 583 398 -431 -728 -514 -462 -288 -1501 -1877 -559 -1153 -29 499 436 -153 934 -820 443 508 690 597 626 -257 -874 707 532 577 1027 4 -126 1969 1096 -428 172 -1369 407 -114 83 -680 -593 1093 -176 255 -335 -123 -652 900000 SS 20240606T043113.8Z 8923.188355 109 1 50.26 2 77.17 69.33 72.16 70.78 0.00 1 0.00 1 0 25 4.536e-01 9.397e-03 1.956e-01 3.571e-03 6.959926e-01 1.979751e-03 8.462279e-03 -6.000000e+00 2.654165e-01 232.86 -2.00 3.85 -2.00 321.41 0.00e+00 3.564068e-03 9.502348e-04 7.230779e-04 -6.000000e+00 1.135645e-02 278.94 -2.00 20.00 -2.00 320.89 0.00e+00 4.381 0.002 302.00 328.00 3 1.8792e+00 6.7135e-03 6.0810e-02 -6.0000e+00 6.6833e-01 1.0573e-01 9.3734e-03 4.3071e-02 -6.0000e+00 7.2358e-01 -1.3886e-01 9.7696e-03 2.2290e-02 -6.0000e+00 4.2806e-01 5.0623e-02 4.6158e-03 7.7566e-03 -6.0000e+00 1.7991e-01 4.8420e-04 -1.4057e-03 1.0246e-04 9.1549e-05 -6.0000e+00 1.2485e-02 8.3380e-02 0.0000e+00 12 9 8 11 4 0 56.93 27.06 0.27 0.08338 0.07282 209 44 4 8 0 237.010 14.93 27.06 20.36 31.74 32.08 30.6 990.25 -21211 -227730 97690 -209289 -4466 -136324 -159861 -109666 -175295 -117411 -161267 -58461 -116346 -55753 -26040 -40513 -74597 -38075 -5629 -50372 -11708 -59980 -8714 -42481 10914 -39944 -15081 -34811 -43563 1314 -20372 13514 -23608 304 -11378 -2298 1068 -2032 7102 -8223 4720 -7697 16870 -2566 9093 3750 9341 11084 4071 4665 5880 11400 1671 10096 -442 4135 1989 1092 3028 1833 10213 3881 5334 2460 5944 3359 1526 2959 2977 1898 103 711 -1375 1571 -3073 1814 -724 70 -1103 -1719 -516 -2698 -988 -1725 321 -828 234 706 1082 1127 -475 354 -1739 609 -1135 332 -528 -356 3 -967 -298 -834 1278 -1308 -1753 -1360 -836 11 340 306 -71 261 -251 436 121 835 -81 613 -389 -557 542 331 745 198 643 -291 1348 413 -6 193 -756 280 -199 517 -442 -114 218 106 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