File name: Pandora132s1_Berlin_20221031_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T183726.5Z 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_20221031_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: 20221031 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 20221031T070102.5Z 8339.292390 65 1 49.73 2 82.80 124.62 140.59 64.65 0.00 1 0.00 1 0 25 4.727e-01 2.667e-02 3.329e-01 1.946e-02 7.234544e-01 1.075601e-02 8.887373e-03 -6.000000e+00 2.668278e-01 222.51 -2.00 3.85 -2.00 321.85 0.00e+00 1.895556e-02 5.314327e-03 1.616297e-03 -6.000000e+00 1.358328e-02 273.21 -2.00 20.00 -2.00 321.37 0.00e+00 7.359 0.009 302.00 328.00 3 1.5171e+00 3.6945e-02 8.6733e-02 -6.0000e+00 6.5914e-01 7.7419e-01 4.6627e-02 5.7775e-02 -6.0000e+00 7.2321e-01 -9.7075e-01 4.2323e-02 2.1588e-02 -6.0000e+00 4.2841e-01 3.9889e-01 2.0707e-02 1.7739e-02 -6.0000e+00 1.8323e-01 3.9764e-05 -1.6148e-03 5.7691e-04 1.9630e-04 -6.0000e+00 1.3094e-02 -6.1841e-04 0.0000e+00 12 8 8 10 0 0 58.55 16.92 0.61 -0.00062 -0.01275 46 10 4 8 0 1080.880 15.00 16.92 20.49 21.27 21.69 26.8 1006.93 900000 -70918 900000 -129850 180117 -145296 -150751 51513 900000 900000 -144734 900000 -46625 37126 -62399 900000 -58336 -47724 182543 21425 900000 -45535 206243 -49437 900000 -16446 -40382 -20652 -16035 900000 -5729 73500 -6591 139367 -37612 28439 -48888 9724 16905 -23472 70130 29946 70370 -2603 12952 16213 52393 70517 46490 68256 13428 45425 7021 21813 28079 20679 -2852 23170 22835 -9794 17062 -12122 22799 11097 23472 16260 26499 15135 12791 17879 7500 12581 1443 5453 214 -3364 5378 -10239 3021 -3901 4522 -2787 -1789 -3016 -3381 600 -2180 4421 5399 7946 378 -4280 -2180 -5330 752 -3503 -784 -4651 -1000 -3761 1100 -2759 -3162 -2906 -4114 -2596 -4467 843 -1390 -1324 -1987 -554 595 -2478 1466 -1419 2113 -1171 1790 -1286 2381 2415 2114 2964 234 3155 -69 3622 -561 1084 -193 423 1526 220 1348 -715 607 -829 -503 -1024 389 -1051 -1325 900000 -1954 900000 -5814 3412 -5755 -5971 976 900000 900000 -4985 900000 -964 703 -2579 900000 -3014 -2383 3458 553 900000 -2039 3907 -2341 900000 -530 -1606 -665 -516 900000 -239 1671 -375 2640 -2708 1024 -4075 516 961 -2223 2790 1872 3066 -242 1055 1321 3077 3607 3171 4008 1501 4045 984 2769 3404 2703 -465 2809 2682 -1596 2263 -2434 3714 2270 4402 3204 4669 3125 3029 4539 2259 3647 448 1498 56 -816 1151 -2735 830 -1382 1722 -1288 -885 -1449 -1730 312 -1220 2360 3099 4245 203 -2270 -1115 -3029 466 -2437 -622 -4390 -978 -3731 955 -2214 -2375 -2232 -3429 -2258 -4216 820 -1556 -1682 -2813 -812 861 -3564 1934 -1886 2788 -1690 2654 -2009 3502 3394 2877 3885 336 4243 -95 5249 -889 1918 -379 876 3316 516 3338 -1878 1603 -2237 -1333 -2596 905 -2326 -2908 SS 20221031T071406.1Z 8339.301460 68 1 49.64 2 81.19 127.37 138.85 68.00 0.00 1 0.00 1 0 17 5.009e-01 1.250e-02 2.616e-01 7.375e-03 6.500425e-01 3.969709e-03 7.820404e-03 -6.000000e+00 2.806781e-01 222.51 -2.00 3.85 -2.00 321.63 0.00e+00 8.904677e-03 1.947983e-03 8.266751e-04 -6.000000e+00 1.253106e-02 273.21 -2.00 20.00 -2.00 321.16 0.00e+00 6.178 0.005 302.00 328.00 3 1.4118e+00 1.3368e-02 7.1744e-02 -6.0000e+00 6.9255e-01 2.0959e-01 1.8474e-02 4.1447e-02 -6.0000e+00 7.5849e-01 -2.6269e-01 1.9709e-02 2.0952e-02 -6.0000e+00 4.4976e-01 1.1006e-01 9.4170e-03 1.2173e-02 -6.0000e+00 1.9024e-01 1.6114e-04 -4.5062e-04 2.2056e-04 1.3251e-04 -6.0000e+00 1.3708e-02 -8.9811e-04 0.0000e+00 12 8 8 10 0 0 15.79 16.94 0.31 -0.00090 -0.00428 114 24 4 8 0 435.350 15.01 16.94 21.28 21.27 21.69 26.9 1011.29 -198246 900000 -163872 -182681 -187618 -171710 -206109 -150673 900000 -122427 160486 -130339 27658 -48402 50448 -46342 -30350 26521 -59646 68411 -47096 -18349 -22681 -27247 -37371 -28927 14459 -74613 -7201 -58004 50307 -2668 32549 10562 -25475 -3316 -34436 82711 -2634 36657 3733 18957 4789 7733 5130 10239 17313 -1805 21009 2089 15757 8579 13911 7484 1724 6904 -2987 10257 -620 5073 2136 5035 5457 4846 6694 800 6219 -886 5977 4836 3380 2669 2258 1383 -2868 4575 -2387 1227 -4681 88 273 -3226 -2245 -3386 542 -1479 1124 -1162 1189 -525 1083 -750 -4003 1564 -1832 -724 -607 637 13 -388 -311 -1612 170 -96 78 -1753 6 -1881 625 -170 -78 994 -181 -460 -1437 449 -289 168 -11 -41 649 318 1728 125 1416 -126 -163 759 355 305 -600 698 -487 231 -102 -117 104 568 293 -511 492 -1083 -555 -3369 900000 -2356 -2985 -2943 -2245 -4042 -1871 900000 -1280 1154 -1874 199 -592 363 -757 -524 286 -1482 541 -1185 -343 -457 -607 -967 -707 229 -2843 -145 -2210 796 -86 842 349 -1154 -122 -1931 1725 -155 1687 263 1227 375 606 424 832 1357 -179 1752 228 1677 1092 1830 1022 260 1020 -492 1600 -96 817 343 889 1099 1090 1523 188 1378 -222 1586 1476 1129 918 756 435 -851 1142 -615 322 -1515 33 117 -1609 -1199 -1941 319 -943 732 -789 778 -333 631 -418 -2266 895 -1243 -567 -551 645 14 -414 -304 -1430 140 -82 71 -1731 6 -2133 771 -236 -119 1554 -284 -690 -2064 617 -410 250 -18 -66 1023 482 2498 177 1918 -167 -213 1066 571 551 -1185 1435 -1070 536 -254 -301 273 1499 764 -1285 1146 -2423 -1231 SS 20221031T072217.9Z 8339.307152 72 1 49.58 2 80.21 129.13 137.73 70.01 0.00 1 0.00 1 0 17 3.714e-01 8.673e-03 1.946e-01 5.053e-03 5.992228e-01 2.672362e-03 7.296198e-03 -6.000000e+00 2.076403e-01 222.51 -2.00 3.85 -2.00 321.38 0.00e+00 5.557687e-03 1.221235e-03 1.291329e-03 -6.000000e+00 9.034080e-03 273.21 -2.00 20.00 -2.00 320.89 0.00e+00 5.622 0.004 302.00 328.00 3 1.5092e+00 8.6918e-03 6.4574e-02 -6.0000e+00 5.1117e-01 1.1035e-01 1.1684e-02 3.4522e-02 -6.0000e+00 5.5948e-01 -1.2221e-01 1.2239e-02 1.9819e-02 -6.0000e+00 3.3269e-01 4.5225e-02 5.9534e-03 9.3715e-03 -6.0000e+00 1.4005e-01 2.6379e-04 -6.6552e-06 1.5195e-04 1.1214e-04 -6.0000e+00 1.0150e-02 -5.2316e-04 0.0000e+00 11 8 0 10 0 0 92.04 16.95 0.37 -0.00052 -0.00057 128 27 4 8 0 387.260 15.01 16.95 21.98 21.27 21.69 26.9 1013.97 -133318 -100176 -143808 -156147 -69089 -160936 -6494 -163296 -46612 -110864 -112292 -91578 -65746 -39727 -24873 6063 -57842 5427 -50251 -10878 -23416 -31264 -7087 -8637 19592 -40540 -12867 -42619 -8744 -33303 15524 11406 -7912 -5520 -20992 -9936 -25253 7716 -6414 1568 -1271 1075 6743 -1214 9515 -274 8579 914 6218 4921 3468 7274 2767 11173 2707 4180 979 3213 616 2034 3613 4087 7998 2789 4596 -260 2014 1536 3298 877 134 2109 -503 4588 -2193 303 -2845 -1927 -1510 -767 -786 -2300 -1455 -1866 -727 -812 -411 801 822 631 418 346 -1579 -160 -1234 -729 -43 809 -11 -763 386 -2073 -127 -692 -765 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