File name: Pandora64s1_NewHavenCT_20230904_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20230905T144724.8Z 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_20230904_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: 20230904 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 20230904T112725.7Z 8647.477381 241 1 11.85 2 78.40 90.61 45.22 249.69 0.00 1 0.00 1 0 25 3.570e-01 1.495e-02 1.489e-01 4.617e-03 6.186596e-01 2.594044e-03 7.406991e-03 -6.000000e+00 2.178332e-01 230.18 -2.00 3.52 -2.00 320.65 0.00e+00 4.811117e-03 1.090613e-03 2.352753e-03 -6.000000e+00 9.754966e-03 288.53 -2.00 20.00 -2.00 319.98 0.00e+00 4.807 0.002 302.00 328.00 3 2.0960e+00 8.3277e-03 5.8956e-02 -6.0000e+00 5.4308e-01 7.3285e-02 1.0638e-02 3.4838e-02 -6.0000e+00 5.8547e-01 -1.3170e-01 9.4673e-03 1.8451e-02 -6.0000e+00 3.4930e-01 5.2472e-02 4.6684e-03 6.0964e-03 -6.0000e+00 1.4866e-01 2.7638e-04 -1.2150e-03 1.3741e-04 9.8643e-05 -6.0000e+00 1.0626e-02 -6.0876e-03 -5.6820e-05 12 9 9 12 1 1 15.17 21.91 0.24 -0.00609 -0.01522 19 20 1 5 0 591.940 26.32 20.00 21.91 28.87 38.1 1040.14 -142101 -23449 -101331 -110449 -256561 -106825 -152799 -83423 -61799 -16084 -84632 -7511 -32959 -26190 -9937 33875 -28163 9015 17472 11170 -11772 17360 1563 41154 14082 9662 -20873 -3497 -12233 -35353 2566 3210 2656 16087 10576 1522 5884 12226 5528 1573 3181 1564 11462 -2253 8317 2925 7981 9686 5763 -1534 6454 3907 7338 2518 1742 1722 3329 1209 1820 2362 4802 2701 3611 6501 5771 -1078 1424 692 3595 702 2039 1552 -240 480 -817 -2918 -1197 -1620 -2575 308 -724 -1173 -1998 -2317 -831 -525 -561 110 899 1133 -610 -547 -1784 -1377 -700 -386 -436 870 952 -258 -866 -1807 -3396 -372 -53 -1655 -278 -794 -346 351 895 357 58 571 93 -414 509 -99 494 821 17 -117 641 773 1324 1497 -1439 1041 1164 89 723 -533 -525 -742 519 -407 -664 397 508 -141 69 -1126 -2210 -137 -1244 -1401 -12128 -1268 -3127 -956 -696 -123 -1247 -68 -490 -418 -167 473 -738 181 343 247 -332 369 42 871 375 281 -829 -115 -451 -1852 110 158 150 816 545 91 383 891 520 164 358 191 1333 -307 1045 399 1063 1326 863 -268 1165 797 1572 612 444 456 884 324 477 625 1319 845 1159 2231 2024 -395 518 265 1510 343 1049 822 -125 234 -369 -1231 -484 -688 -1270 173 -437 -802 -1480 -1830 -696 -463 -482 95 764 979 -501 -429 -1391 -1141 -610 -385 -494 1025 1171 -312 -986 -2015 -3671 -409 -62 -1931 -343 -1057 -476 530 1454 598 95 901 141 -615 771 -157 826 1397 28 -191 1006 1161 1916 2228 -2049 1565 1960 157 1376 -1024 -1065 -1603 1121 -918 -1527 916 1153 -307 150 -2366 SS 20230904T113148.4Z 8647.480421 244 1 48.36 2 77.57 91.34 45.96 250.68 0.00 1 0.00 1 0 25 2.757e-01 8.630e-03 3.221e-02 1.231e-03 5.875980e-01 6.857276e-04 6.880449e-03 -6.000000e+00 1.682410e-01 230.18 -2.00 3.52 -2.00 320.41 0.00e+00 1.727013e-03 2.685051e-04 1.515998e-03 -6.000000e+00 7.533347e-03 288.53 -2.00 20.00 -2.00 319.73 0.00e+00 4.513 0.002 302.00 328.00 3 1.3098e+00 2.1213e-03 5.5207e-02 -6.0000e+00 4.1945e-01 -6.0788e-04 2.6711e-03 3.2284e-02 -6.0000e+00 4.5215e-01 -2.6719e-02 2.3692e-03 1.6207e-02 -6.0000e+00 2.6976e-01 4.8205e-03 1.1865e-03 4.6646e-03 -6.0000e+00 1.1483e-01 8.4467e-04 -6.6014e-04 3.6744e-05 6.5315e-05 -6.0000e+00 8.2045e-03 -6.3484e-03 -1.2318e-05 11 8 0 10 0 0 32.03 21.92 0.12 -0.00635 -0.01131 242 58 1 5 0 199.780 26.32 19.97 21.92 29.08 38.3 1041.99 -80100 -87138 -79214 -98518 -177143 -93001 -87067 -79900 -62535 -52451 -70626 -43865 -37777 -25989 -25092 -10415 -28207 -1774 -15282 -872 -13284 5014 -9977 -3696 -12886 -852 -9992 -3318 -14065 -4444 -7170 5583 -3179 4326 -6790 -1022 -4585 1615 -1246 2878 -727 2982 943 617 -927 3562 557 2812 -1159 -837 2342 3041 2098 2469 957 1930 1167 1303 317 1127 1341 2133 2190 3532 2367 -393 687 -1025 1378 1936 860 598 -245 -129 53 -2228 -649 -2686 -875 -679 -935 -1008 -1339 -2173 -246 -474 734 306 1271 511 757 113 -666 -489 615 72 -316 848 645 -653 -498 -1814 -2246 -150 309 -1660 -631 -668 -233 447 934 357 248 250 -209 -194 453 -78 687 335 -124 -308 809 464 819 622 -1299 331 943 253 350 -649 -712 -350 355 14 -552 366 327 -219 167 -511 -769 -1004 -894 -1277 -4368 -1139 -1118 -1093 -811 -667 -1153 -653 -667 -508 -596 -249 -809 -43 -457 -24 -423 136 -340 -129 -527 -33 -421 -127 -614 -196 -386 302 -214 278 -471 -71 -380 151 -134 347 -100 421 143 95 -148 559 92 473 -212 -165 502 714 541 634 261 544 339 374 91 323 407 713 817 1424 975 -162 284 -451 668 979 470 336 -135 -67 27 -1061 -296 -1300 -476 -399 -629 -764 -1020 -1775 -212 -433 692 294 1194 459 635 91 -528 -412 578 73 -363 1014 805 -800 -606 -2039 -2429 -167 366 -2095 -794 -900 -343 681 1523 567 408 394 -314 -285 680 -124 1137 568 -207 -500 1262 695 1184 923 -1938 495 1567 439 655 -1223 -1415 -736 753 31 -1244 830 729 -469 340 -1052 SS 20230904T113728.7Z 8647.484359 247 1 48.32 2 76.51 92.29 46.93 251.92 0.00 1 0.00 1 0 25 1.797e-01 7.727e-03 2.140e-02 9.545e-04 5.467199e-01 5.253356e-04 6.376214e-03 -6.000000e+00 1.096885e-01 230.18 -2.00 3.52 -2.00 320.08 0.00e+00 1.946960e-03 1.838474e-04 9.105630e-04 -6.000000e+00 4.911311e-03 288.53 -2.00 20.00 -2.00 319.37 0.00e+00 4.182 0.001 302.00 328.00 3 1.2173e+00 1.5628e-03 5.0962e-02 -6.0000e+00 2.7347e-01 -7.7070e-03 1.9202e-03 2.9262e-02 -6.0000e+00 2.9478e-01 -1.1203e-02 1.6423e-03 1.4832e-02 -6.0000e+00 1.7587e-01 -2.8163e-03 8.3790e-04 4.5919e-03 -6.0000e+00 7.4874e-02 1.3228e-03 -5.7412e-04 2.8651e-05 5.7221e-05 -6.0000e+00 5.3483e-03 -6.7490e-03 1.4180e-08 11 9 0 11 8 0 57.36 21.91 0.18 -0.00675 -0.01106 308 74 1 5 0 156.840 26.32 20.00 21.91 29.63 38.2 1044.21 -59102 -52263 -51260 -56997 -115961 -60932 -55475 -51900 -43378 -34598 -47663 -33176 -29549 -16805 -17254 -4901 -15032 -1192 -9435 -3145 -6512 1820 -870 -1055 -3073 -897 -4858 -2569 -5569 -3525 -753 2449 2119 4162 -5663 -1989 -1423 765 827 1391 34 146 595 -362 -57 1361 525 753 -13 -80 1862 -4673 1296 2207 642 1453 795 813 576 331 908 1839 2126 3171 1817 -764 299 -946 935 1842 814 618 -111 33 -167 -1575 -1094 -2357 -681 -346 -1078 -513 -1672 -1967 -363 -298 460 466 1320 958 516 468 -832 -399 627 192 -190 975 748 -464 -442 -1714 -2056 -116 287 -1421 -408 -730 -223 451 943 375 312 66 -156 -213 531 -221 510 359 -334 -323 416 105 1080 745 -1261 401 863 206 382 -563 -698 -465 317 -90 -475 517 481 -207 77 -557 -704 -647 -663 -737 -2569 -811 -774 -797 -686 -541 -901 -639 -685 -424 -483 -140 -523 -40 -365 -121 -265 69 -37 -48 -153 -46 -260 -130 -295 -202 -49 176 173 342 -494 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