File name: Pandora107s1_LynnMA_20240728_L2Fit_fout2c7d20230718p1-8.txt File generation date: 20240916T091409.3Z Data description: Level 2 spectral fitting results file Data file version: fout2c7p1-8 Local principal investigator: Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 107 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora107_OF_v1d20230601.txt Instrument calibration file used: Pandora107s1_CF_v7d20230718.txt Level 1 file used: Pandora107s1_LynnMA_20240728_L1_smca1c7d20230718p1-8.txt Full location name: Lynn Massachusetts Department of Environmental Protection Short location name: LynnMA Country of location: United States Location latitude [deg]: 42.4746 Location longitude [deg]: -70.9708 Location altitude [m]: 52 Local noon date: 20240728 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: OOB session based on clearance session 6 First and last pixel inside fitting window: 220 362 Nominal wavelengths inside fitting window [nm]: 305.0382 305.1791 305.3200 305.4608 305.6017 305.7426 305.8834 306.0242 306.1650 306.3059 306.4467 306.5874 306.7282 306.8690 307.0097 307.1505 307.2912 307.4319 307.5727 307.7134 307.8540 307.9947 308.1354 308.2761 308.4167 308.5573 308.6980 308.8386 308.9792 309.1198 309.2604 309.4009 309.5415 309.6820 309.8226 309.9631 310.1036 310.2441 310.3846 310.5251 310.6656 310.8060 310.9465 311.0869 311.2273 311.3678 311.5082 311.6485 311.7889 311.9293 312.0697 312.2100 312.3504 312.4907 312.6310 312.7713 312.9116 313.0519 313.1922 313.3324 313.4727 313.6129 313.7531 313.8934 314.0336 314.1738 314.3139 314.4541 314.5943 314.7344 314.8746 315.0147 315.1548 315.2949 315.4350 315.5751 315.7152 315.8552 315.9953 316.1353 316.2754 316.4154 316.5554 316.6954 316.8354 316.9753 317.1153 317.2552 317.3952 317.5351 317.6750 317.8149 317.9548 318.0947 318.2346 318.3744 318.5143 318.6541 318.7939 318.9338 319.0736 319.2134 319.3531 319.4929 319.6327 319.7724 319.9121 320.0519 320.1916 320.3313 320.4710 320.6107 320.7503 320.8900 321.0296 321.1693 321.3089 321.4485 321.5881 321.7277 321.8673 322.0068 322.1464 322.2859 322.4255 322.5650 322.7045 322.8440 322.9835 323.1230 323.2624 323.4019 323.5413 323.6808 323.8202 323.9596 324.0990 324.2384 324.3777 324.5171 324.6564 324.7958 324.9351 --------------------------------------------------------------------------------------- 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 20240728T110625.9Z 8975.462800 246 1 30.06 2 74.56 78.44 25.87 191.65 0.00 1 0.00 1 0 25 2.282e-01 9.432e-03 5.395e-02 2.065e-03 5.950459e-01 1.121957e-03 7.021434e-03 -6.000000e+00 1.383662e-01 232.53 -2.00 3.54 -2.00 320.28 0.00e+00 5.400283e-03 4.171168e-04 1.920974e-03 -6.000000e+00 6.216850e-03 288.63 -2.00 20.00 -2.00 319.57 0.00e+00 3.685 0.001 302.00 328.00 3 2.3137e+00 3.4182e-03 4.9189e-02 -6.0000e+00 3.4693e-01 1.0557e-01 4.2774e-03 3.2581e-02 -6.0000e+00 3.7382e-01 -1.0215e-01 3.7349e-03 1.8250e-02 -6.0000e+00 2.2274e-01 2.8072e-02 1.8802e-03 7.2306e-03 -6.0000e+00 9.3682e-02 6.3014e-04 -2.3055e-04 5.9304e-05 8.8413e-05 -6.0000e+00 6.7254e-03 -2.8038e-02 0.0000e+00 12 8 8 10 0 0 0.02 22.14 0.47 -0.02804 -0.02977 66 66 1 5 0 455.280 26.32 20.00 22.14 27.37 0.0 951.25 -77721 -86132 -50675 -97074 -55089 -85749 -94059 -37724 -91776 -56719 -70686 -49049 -39903 -29111 -28061 -25106 2849 -16380 -1854 -2731 4361 -4986 -14350 1519 -10406 -5489 -18691 -15202 -3293 -9172 3496 -5852 1965 -3243 586 -1693 -6552 4951 -5185 -2456 -6467 -3715 -2317 -1751 -82 568 2631 1841 3889 3592 2820 3663 2576 3787 2063 2227 1296 -1452 -335 152 3978 2737 3065 1762 -327 1596 2519 2793 3260 1250 144 -1122 -843 -1203 413 -676 -247 -236 420 136 -756 -864 -2283 -1293 -511 -729 172 -830 -373 -571 251 798 728 1837 1166 240 129 313 -1156 -1698 -1079 -518 1396 1264 -1070 -1885 -1279 -331 583 678 -199 -670 -259 -64 944 1761 2123 1295 459 -452 -839 -78 445 -68 -492 -224 710 1745 737 -421 -651 -557 9 328 -234 -421 83 105 -329 -653 -125 58 806 -783 -1145 -521 -1603 -577 -1157 -1402 -357 -1682 -788 -1196 -741 -659 -551 -667 -698 69 -534 -57 -90 140 -179 -572 54 -453 -241 -945 -738 -143 -442 166 -364 133 -249 44 -128 -542 425 -599 -327 -1013 -620 -368 -286 -13 105 486 352 756 672 576 822 647 1014 593 669 404 -468 -105 47 1204 905 1130 733 -148 717 1086 1196 1507 667 79 -659 -497 -685 234 -353 -118 -110 209 78 -469 -612 -1807 -1089 -453 -635 157 -798 -357 -533 221 705 606 1506 1041 227 140 357 -1467 -2245 -1358 -631 1533 1369 -1243 -2355 -1558 -421 794 1021 -309 -1112 -434 -104 1434 2706 3211 1901 718 -747 -1412 -127 692 -102 -773 -336 1013 2487 1155 -700 -1192 -1013 16 655 -470 -894 180 233 -733 -1432 -259 119 1588 SS 20240728T111656.1Z 8975.470094 249 1 30.06 2 72.65 80.11 26.30 197.15 0.00 1 0.00 1 0 25 1.215e-01 9.528e-03 2.335e-02 1.198e-03 5.377082e-01 6.423734e-04 6.329729e-03 -6.000000e+00 7.367972e-02 232.53 -2.00 3.54 -2.00 319.76 0.00e+00 4.245575e-03 2.012795e-04 1.117695e-03 -6.000000e+00 3.310406e-03 288.63 -2.00 20.00 -2.00 319.00 0.00e+00 3.305 0.001 302.00 328.00 3 1.7751e+00 1.8713e-03 4.4054e-02 -6.0000e+00 1.8474e-01 7.9598e-02 2.2511e-03 2.8843e-02 -6.0000e+00 1.9906e-01 -6.8100e-02 1.8279e-03 1.5281e-02 -6.0000e+00 1.1861e-01 1.4145e-02 9.4459e-04 5.8839e-03 -6.0000e+00 4.9887e-02 1.6649e-03 -1.1049e-04 3.5056e-05 6.6020e-05 -6.0000e+00 3.5811e-03 -2.8199e-02 0.0000e+00 12 9 8 11 8 0 28.70 22.13 0.36 -0.02820 -0.02903 134 134 1 5 0 224.260 26.32 19.99 22.13 28.13 0.0 955.32 -56735 -34686 -33740 -45309 -25259 -56055 -32389 -39177 -24161 -30626 -45465 -22995 -32462 -15130 -11487 -800 -1313 -3735 1215 -3713 -709 -6797 545 -3140 -6071 -2860 -10610 -8142 -5134 -2825 -855 -3345 1084 -3018 -1885 -503 -966 -45 -1570 -2055 -4587 -2113 -2074 -872 -634 -400 1227 954 1961 2063 2963 2388 2664 1938 874 1449 -118 -940 -261 865 2509 3069 2224 1297 -498 786 2081 2591 3330 1405 -625 -829 -1094 -1536 -828 -773 239 599 1224 -257 -1023 -1169 -2211 -1148 -381 -541 -170 -496 -182 -171 296 698 1399 2000 1721 601 459 27 -1400 -1783 -1275 -382 1634 1225 -1219 -2171 -1248 -555 507 552 -76 -548 -253 112 890 1849 1938 1475 654 -675 -966 -369 213 -195 -121 -264 700 1918 823 -620 -724 -557 264 369 -52 -547 -110 81 -321 -533 -270 85 819 -848 -498 -524 -794 -348 -995 -462 -668 -401 -583 -1057 -467 -853 -419 -382 -28 -53 -171 57 -195 -38 -391 29 -185 -398 -192 -777 -575 -352 -195 -64 -299 108 -334 -209 -54 -109 -6 -228 -354 -915 -449 -465 -199 -148 -95 291 231 483 531 813 725 889 699 335 577 -49 -396 -108 349 1015 1327 988 643 -266 415 1042 1276 1755 851 -428 -555 -740 -1007 -543 -461 129 313 677 -165 -708 -919 -1926 -1061 -344 -520 -173 -525 -193 -176 288 629 1260 1772 1639 607 530 32 -1887 -2337 -1697 -457 1891 1411 -1409 -2703 -1624 -754 687 822 -117 -892 -414 176 1391 2716 2804 2210 1045 -1080 -1577 -587 344 -305 -184 -382 1026 2790 1226 -984 -1257 -1017 470 692 -104 -1100 -228 171 -678 -1108 -535 167 1538 SS 20240728T112401.5Z 8975.475018 253 1 30.06 2 71.36 81.24 26.69 200.76 0.00 1 0.00 1 0 25 8.311e-02 9.373e-03 1.356e-02 8.929e-04 5.029290e-01 4.779617e-04 5.937938e-03 -6.000000e+00 5.039747e-02 232.53 -2.00 3.54 -2.00 319.45 0.00e+00 3.086866e-03 1.343968e-04 8.379364e-04 -6.000000e+00 2.264433e-03 288.63 -2.00 20.00 -2.00 318.67 0.00e+00 3.090 0.001 302.00 328.00 3 1.4840e+00 1.3583e-03 4.1181e-02 -6.0000e+00 1.2636e-01 6.4088e-02 1.6021e-03 2.6924e-02 -6.0000e+00 1.3616e-01 -5.8778e-02 1.2350e-03 1.3727e-02 -6.0000e+00 8.1129e-02 1.2600e-02 6.4288e-04 4.7483e-03 -6.0000e+00 3.4121e-02 2.8742e-03 -1.3251e-04 2.6168e-05 5.1247e-05 -6.0000e+00 2.4497e-03 -2.7852e-02 0.0000e+00 12 8 8 10 0 0 35.11 22.11 0.36 -0.02785 -0.02885 204 204 1 5 0 147.290 26.21 20.00 22.11 28.90 0.0 958.44 -35759 -21633 -26551 -24519 -27082 -30941 -24651 -25422 -25628 -26571 -24113 -21953 -19452 -9643 -8525 -4089 -3349 -2686 -172 -1519 -433 1505 1672 -2022 -3733 -5201 -9205 -7491 -3916 -2183 179 666 923 -3770 -2141 -235 465 405 -520 -1787 -3146 -2063 -2014 -1099 283 -3 580 947 1145 2058 2484 2289 2022 1979 923 1524 -3 -278 -250 925 2114 3107 1815 941 -537 6 1893 2137 3135 856 -376 -962 -1248 -1031 -768 -338 501 821 1181 -83 -1028 -1281 -2148 -993 -518 -493 -286 -562 -210 -319 181 752 1468 2086 1585 745 455 133 -1331 -1951 -1154 -502 1372 1455 -1179 -2016 -1241 -555 573 407 -29 -546 -235 216 1001 1860 1996 1443 573 -580 -837 -526 168 -35 -47 -309 861 1978 741 -519 -705 -591 204 291 46 -524 12 183 -448 -582 -251 20 756 -635 -396 -553 -500 -542 -609 -464 -540 -618 -696 -647 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