File name: Pandora179s1_CornwallCT_20230107_L2Fit_fout2c40d20221201p1-8.txt File generation date: 20260624T053621.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c40p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 179 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora179_OF_v3d20220331.txt Instrument calibration file used: Pandora179s1_CF_v40d20221201.txt Level 1 file used: Pandora179s1_CornwallCT_20230107_L1_smca1c40d20221201p1-8.txt Full location name: Cornwall - Mohawk Mt CTDEEP (USEPA AQS Site ID 09-005-0005) Short location name: CornwallCT Country of location: United States Location latitude [deg]: 41.8213 Location longitude [deg]: -73.2973 Location altitude [m]: 505 Local noon date: 20230107 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: 205 347 Nominal wavelengths inside fitting window [nm]: 305.0173 305.1585 305.2997 305.4409 305.5821 305.7232 305.8644 306.0055 306.1467 306.2878 306.4289 306.5700 306.7111 306.8521 306.9932 307.1343 307.2753 307.4163 307.5573 307.6983 307.8393 307.9803 308.1213 308.2623 308.4032 308.5442 308.6851 308.8260 308.9669 309.1078 309.2487 309.3896 309.5304 309.6713 309.8121 309.9529 310.0938 310.2346 310.3754 310.5161 310.6569 310.7977 310.9384 311.0792 311.2199 311.3606 311.5013 311.6420 311.7827 311.9234 312.0640 312.2047 312.3453 312.4859 312.6265 312.7672 312.9077 313.0483 313.1889 313.3295 313.4700 313.6105 313.7511 313.8916 314.0321 314.1726 314.3131 314.4535 314.5940 314.7344 314.8749 315.0153 315.1557 315.2961 315.4365 315.5769 315.7173 315.8576 315.9980 316.1383 316.2786 316.4189 316.5592 316.6995 316.8398 316.9801 317.1203 317.2606 317.4008 317.5410 317.6812 317.8214 317.9616 318.1018 318.2420 318.3821 318.5223 318.6624 318.8025 318.9426 319.0827 319.2228 319.3629 319.5029 319.6430 319.7830 319.9231 320.0631 320.2031 320.3431 320.4831 320.6230 320.7630 320.9029 321.0429 321.1828 321.3227 321.4626 321.6025 321.7424 321.8823 322.0221 322.1620 322.3018 322.4416 322.5814 322.7212 322.8610 323.0008 323.1406 323.2803 323.4201 323.5598 323.6995 323.8392 323.9789 324.1186 324.2583 324.3980 324.5376 324.6773 324.8169 324.9565 --------------------------------------------------------------------------------------- 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 20230107T170026.8Z 8407.708643 436 1 49.71 2 64.16 180.25 112.62 350.95 0.00 1 0.00 1 0 17 6.057e-02 8.359e-03 1.629e-02 2.392e-03 3.992651e-01 1.186492e-03 4.774357e-03 -6.000000e+00 3.408700e-02 223.19 -2.00 3.52 -2.00 318.32 0.00e+00 4.505677e-04 2.252086e-04 2.054417e-04 -6.000000e+00 1.467223e-03 272.02 -2.00 20.00 -2.00 317.79 0.00e+00 2.281 0.000 302.00 328.00 3 5.1295e+00 3.1671e-03 2.9459e-02 -6.0000e+00 8.4107e-02 7.3393e-02 3.6092e-03 2.0142e-02 -6.0000e+00 9.1830e-02 -2.0835e-02 2.4964e-03 1.0127e-02 -6.0000e+00 5.4568e-02 1.4210e-03 1.3208e-03 2.9708e-03 -6.0000e+00 2.3028e-02 2.1055e-04 -3.9963e-04 6.7699e-05 3.2769e-05 -6.0000e+00 1.6498e-03 1.6642e-03 0.0000e+00 11 9 0 11 32 0 99.01 22.59 0.47 0.00166 -0.00134 18 4 1 5 0 2760.580 25.79 20.00 22.59 8.62 17.1 949.65 -8503 26465 -13409 2539 -20150 -35109 1973 -26885 -3138 5503 -17139 -8673 -23363 -11008 -15 -587 3389 3793 -1756 3723 3831 1997 12135 -5017 4048 2940 -5501 1974 -3811 -987 7271 1416 4693 7282 -1353 628 -4452 -4434 -62 3633 -3177 -78 1317 697 -1039 -780 -3108 -126 315 -987 1104 -121 789 2522 1341 2499 677 -946 -191 23 623 1364 1713 1158 389 -1407 1219 -1826 32 -442 940 769 259 -150 -201 -172 912 -658 419 -924 -2584 -1366 -1766 -3019 -381 175 48 39 323 -80 1226 695 851 1117 662 917 254 838 47 -438 264 -543 -428 -843 -335 -389 -819 -943 -245 256 483 -51 -363 -52 65 650 -219 553 268 -399 -234 -174 162 229 -210 1003 -155 1407 521 314 97 -258 141 -17 -85 190 -133 121 -379 -97 -66 -358 -192 -351 888 -715 113 -1016 -1928 78 -1587 -166 289 -1156 -557 -1987 -988 -1 -65 392 464 -241 504 534 282 1579 -827 653 505 -1046 335 -644 -161 1183 274 979 1581 -308 135 -1074 -1240 -18 1253 -1316 -33 577 313 -475 -357 -1449 -57 141 -457 534 -60 418 1400 788 1494 422 -598 -117 14 380 885 1145 849 295 -1033 821 -1249 23 -359 782 672 228 -127 -167 -129 652 -460 305 -730 -2230 -1303 -1728 -3145 -412 201 55 46 381 -91 1352 707 850 1092 696 1016 302 1110 64 -593 351 -662 -511 -1025 -413 -509 -1069 -1299 -357 383 772 -80 -588 -79 95 897 -303 792 410 -616 -365 -264 250 339 -296 1404 -210 1904 734 483 152 -420 236 -29 -150 337 -242 223 -703 -174 -118 -610 -319 SS 20230107T170554.8Z 8407.712440 440 1 2.44 2 64.18 181.66 112.77 352.22 0.00 1 0.00 1 0 17 2.961e-02 6.581e-03 1.335e-02 2.550e-03 3.978529e-01 1.266305e-03 4.759589e-03 -6.000000e+00 1.666445e-02 223.19 -2.00 3.52 -2.00 317.97 0.00e+00 7.962162e-04 2.183920e-04 1.382955e-04 -6.000000e+00 7.172797e-04 272.02 -2.00 20.00 -2.00 317.44 0.00e+00 2.282 0.000 302.00 328.00 3 2.2608e+00 3.3526e-03 2.9373e-02 -6.0000e+00 4.1118e-02 5.7907e-02 3.8017e-03 1.9988e-02 -6.0000e+00 4.4892e-02 -2.8630e-02 2.5034e-03 1.0041e-02 -6.0000e+00 2.6676e-02 5.5768e-03 1.3067e-03 2.9951e-03 -6.0000e+00 1.1259e-02 3.7525e-03 -4.0218e-04 7.1812e-05 3.2384e-05 -6.0000e+00 8.0650e-04 7.9623e-04 0.0000e+00 12 9 1 12 1 1 29.68 22.59 0.28 0.00080 -0.00223 9 51 1 5 0 227.170 25.79 20.00 22.59 8.64 17.1 948.84 -9217 -180 -10390 -6798 -10231 -17260 -6194 -13246 -2063 -5933 -6607 -9817 -5403 -2540 -1451 1900 290 2369 -1603 1985 631 3239 878 522 -255 1638 -1005 -840 -614 -1065 539 871 4097 732 -2610 -745 -1627 -1638 -879 29 -1321 -1200 -854 69 101 455 -555 -236 -1336 586 1147 763 1375 1129 928 301 1340 755 465 305 943 1146 1301 1704 216 -280 -309 -318 915 859 415 331 -380 121 83 -685 -205 -542 88 -497 -839 -1314 -2257 -1941 -1200 -731 -403 194 404 354 445 972 277 668 945 428 734 579 -239 -491 10 -851 -226 448 -559 -911 -1076 -852 -515 230 -356 118 -127 238 272 508 756 381 223 -251 -360 -63 206 309 724 658 508 1609 644 251 -115 -108 -1 -49 -3 -156 -131 225 -283 -344 -70 -431 -345 -504 -10 -708 -438 -616 -1043 -348 -893 -141 -456 -522 -830 -500 -273 -183 243 41 349 -261 325 108 537 152 96 -51 336 -215 -173 -119 -205 111 201 1017 201 -712 -192 -451 -526 -310 12 -577 -557 -411 33 49 222 -272 -115 -656 288 597 434 776 681 587 197 888 503 303 195 614 799 933 1328 176 -217 -226 -229 692 691 370 310 -359 109 69 -552 -149 -407 65 -420 -761 -1261 -2364 -2014 -1317 -853 -468 231 480 407 500 1056 281 663 1001 482 879 738 -329 -674 13 -1055 -273 517 -703 -1155 -1431 -1191 -728 333 -556 189 -200 350 388 715 1056 530 331 -377 -546 -93 309 444 1034 899 663 2111 926 376 -176 -172 -1 -80 -5 -272 -235 408 -515 -607 -122 -723 -564 SS 20230107T171003.8Z 8407.715321 443 1 6.33 2 64.21 182.72 112.87 353.19 0.00 1 0.00 1 0 17 6.789e-02 1.162e-02 5.253e-02 8.208e-03 4.014945e-01 4.073236e-03 4.769809e-03 -6.000000e+00 3.821092e-02 223.19 -2.00 3.52 -2.00 318.17 0.00e+00 6.881699e-04 7.455961e-04 2.096401e-04 -6.000000e+00 1.644667e-03 272.02 -2.00 20.00 -2.00 317.65 0.00e+00 2.285 0.000 302.00 328.00 3 4.8858e+00 1.0822e-02 2.9502e-02 -6.0000e+00 9.4283e-02 7.7207e-02 1.2297e-02 2.0161e-02 -6.0000e+00 1.0293e-01 -2.9998e-02 8.3250e-03 1.0098e-02 -6.0000e+00 6.1166e-02 7.9144e-03 4.3842e-03 2.9940e-03 -6.0000e+00 2.5819e-02 2.6644e-04 -3.7103e-04 2.3102e-04 3.2167e-05 -6.0000e+00 1.8491e-03 1.1839e-04 0.0000e+00 12 9 9 12 1 1 999.00 22.59 0.46 0.00012 -0.00267 1 4 1 5 0 3076.850 25.79 20.00 22.59 8.51 17.0 947.97 3300 16214 2050 39401 -28267 887 -17618 -3102 -16046 15132 -32133 13268 -22537 -6004 10657 2019 5805 -2740 6814 -9274 4149 -5085 -5195 -12233 9658 2415 -4488 1173 -5833 10054 2443 2131 323 3784 -2872 -1444 -4834 -4078 2886 2933 -262 -4478 3373 -2449 -200 -839 -436 5745 874 -2909 -102 1939 2741 4675 1076 4088 -79 -1189 -154 -492 2511 507 1187 606 820 -1671 -268 -2204 25 550 610 -633 226 -706 1809 312 1425 -86 -1857 495 -1767 -1491 -3122 -2475 -257 -367 786 -110 496 -844 187 420 575 2726 -1988 1607 -1078 1109 482 256 33 -895 -1021 288 -365 -636 381 -554 -447 91 31 -613 -603 638 313 183 1327 497 -96 -279 -193 517 -363 203 -30 824 -69 2375 771 -487 60 -1178 322 -790 778 464 990 -707 -321 0 -355 -62 -808 140 699 109 1407 -1793 39 -976 -166 -1107 829 -2889 784 -2179 -588 1050 250 754 -382 916 -1527 614 -823 -856 -2301 1563 442 -896 213 -1067 1678 443 435 75 904 -706 -336 -1241 -1203 959 1083 -112 -1994 1539 -1131 -91 -383 -198 2594 414 -1371 -50 1011 1522 2715 639 2419 -50 -759 -95 -299 1509 333 855 453 629 -1249 -197 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