File name: Pandora132s1_Berlin_20220906_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T181341.7Z 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_20220906_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: 20220906 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 20220906T052719.5Z 8284.227309 81 1 49.40 2 81.54 90.43 147.43 309.80 0.00 1 0.00 1 0 25 4.920e-01 2.307e-02 4.172e-01 1.878e-02 7.202072e-01 1.058931e-02 8.536957e-03 -6.000000e+00 2.865854e-01 229.84 -2.00 3.85 -2.00 321.85 0.00e+00 -1.438732e-03 5.610724e-03 8.398256e-04 -6.000000e+00 1.302463e-02 280.61 -2.00 20.00 -2.00 321.32 0.00e+00 6.395 0.006 302.00 328.00 3 2.5351e+00 3.8622e-02 7.6196e-02 -6.0000e+00 7.1606e-01 4.1904e-01 5.2229e-02 4.3565e-02 -6.0000e+00 7.7919e-01 -6.7221e-01 4.8292e-02 2.2252e-02 -6.0000e+00 4.6248e-01 2.9065e-01 2.2511e-02 6.7568e-03 -6.0000e+00 1.9467e-01 4.0031e-05 -1.1402e-03 5.6379e-04 8.8550e-05 -6.0000e+00 1.3716e-02 1.6831e-03 0.0000e+00 12 8 8 10 0 0 53.38 16.89 0.52 0.00168 -0.00688 37 8 4 8 0 1334.930 14.99 16.89 21.42 21.17 21.58 26.4 982.27 -131688 900000 900000 -141681 -187627 900000 -196567 46173 -54560 -207770 -97242 76885 900000 9118 137312 -10503 900000 -4713 129441 -7227 9820 59826 -44819 58732 -65381 14417 -95654 -10161 900000 900000 141 -28184 97060 -26850 190958 -24630 -24120 5930 14863 127132 7502 44749 7585 40055 16686 14733 16060 -3081 3896 11946 40831 7078 15930 11605 38569 17046 36135 37240 13708 7666 -453 26422 -2205 8790 8155 10246 14855 5117 4350 4828 12005 -604 6374 -1065 -6071 16707 9990 7981 -5405 5883 -5337 2645 -2577 -744 1914 447 362 2638 -1505 -4288 -3075 -1470 574 -1314 963 -3404 -3691 179 -5490 183 -404 -1473 507 -479 -3416 -3402 -1670 -2707 1930 -1531 724 -263 89 131 -1224 279 356 -20 -674 -655 902 1060 2866 1180 2204 -918 3402 549 2367 915 398 450 -291 299 -1179 295 -52 1206 -138 -283 499 -1368 -1823 -2408 900000 900000 -2826 -5302 900000 -6535 844 -998 -10016 -1778 1406 900000 167 2511 -192 900000 -86 2367 -144 180 1094 -1475 1074 -2826 316 -5565 -260 900000 900000 4 -1288 1775 -1375 3492 -1171 -1279 282 788 2557 549 2373 596 2271 1190 1078 1175 -282 349 1070 3061 828 1864 1528 4091 2338 4163 4154 1855 1079 -72 3575 -452 1784 1715 2061 2852 1151 1122 1413 3534 -188 1970 -329 -1776 3513 2156 1853 -1660 1926 -2076 1077 -1204 -364 974 245 208 1509 -883 -2466 -1636 -728 276 -693 570 -2462 -3105 164 -5695 176 -360 -1193 380 -376 -2970 -3133 -1608 -2853 2176 -2021 1030 -396 133 189 -1706 375 490 -30 -1048 -1041 1380 1551 3978 1616 2887 -1195 4208 757 3672 1626 775 930 -643 704 -3005 773 -138 3212 -366 -717 1169 -3068 -4076 SS 20220906T053524.1Z 8284.232917 85 1 49.72 2 80.31 92.04 148.30 312.55 0.00 1 0.00 1 0 17 4.956e-01 1.248e-02 3.357e-01 9.255e-03 6.598799e-01 5.057459e-03 8.064229e-03 -6.000000e+00 2.847895e-01 229.84 -2.00 3.85 -2.00 321.69 0.00e+00 8.826357e-03 2.639764e-03 1.316493e-03 -6.000000e+00 1.242930e-02 280.61 -2.00 20.00 -2.00 321.15 0.00e+00 5.669 0.004 302.00 328.00 3 2.1863e+00 1.8141e-02 6.8254e-02 -6.0000e+00 7.1126e-01 1.5286e-01 2.4728e-02 4.0416e-02 -6.0000e+00 7.7341e-01 -2.5945e-01 2.4751e-02 2.1816e-02 -6.0000e+00 4.5924e-01 1.0790e-01 1.1639e-02 1.1609e-02 -6.0000e+00 1.9156e-01 1.1860e-04 -4.0998e-04 2.7519e-04 1.4503e-04 -6.0000e+00 1.3572e-02 7.8136e-04 0.0000e+00 12 8 8 10 0 0 43.60 16.90 0.39 0.00078 -0.00230 88 19 4 8 0 564.960 15.00 16.90 21.85 21.17 21.58 26.4 984.07 -159825 -192108 -149836 -147629 -251112 -19294 -151148 107571 -189200 9344 -179330 -112967 -92439 -64528 -33732 9663 -4513 -55673 -63990 2892 -43514 -15314 -48636 63363 -48595 20195 -30975 -56752 -10896 -51500 -36331 -36797 -26040 -7394 -21316 -10310 12114 36459 203 21864 -5843 24809 1080 26734 11866 23063 9225 -2008 8538 -9817 12994 4758 6573 7037 10852 6213 11569 -3525 1908 4324 7485 7586 10293 5354 9800 5001 6089 -302 4818 413 1133 3176 1681 1730 2938 734 936 -1800 -4470 -646 -1174 994 -1153 -627 -2585 -427 -776 252 1096 162 473 1082 491 287 -997 -1295 -795 701 -1557 118 -179 -1318 -1059 -23 -1517 -1956 -946 -2113 26 -426 24 -279 710 -333 -1284 -1020 -81 209 431 329 859 1175 1587 365 1240 11 -76 508 467 479 523 27 -67 472 -144 -163 340 223 0 -506 -140 -969 -194 -1574 -2995 -1598 -1454 -6388 -174 -1488 971 -3260 84 -3090 -1326 -1168 -815 -396 87 -53 -1206 -1617 39 -943 -249 -1141 572 -1272 273 -699 -1639 -207 -1673 -1246 -1528 -1105 -267 -847 -372 394 1119 11 1085 -422 1411 82 1617 857 1540 733 -187 755 -1134 1337 593 878 1004 1557 965 1723 -601 301 671 1203 1376 2081 1261 2273 1187 1424 -72 1245 127 374 1050 548 525 878 203 249 -522 -1405 -233 -496 463 -594 -342 -1536 -264 -506 165 705 101 273 583 262 164 -661 -1006 -713 701 -1692 124 -173 -1154 -877 -19 -1408 -1929 -981 -2396 32 -594 36 -440 1098 -497 -1839 -1425 -115 314 683 535 1361 1782 2315 522 1694 15 -101 720 755 869 1027 55 -149 1108 -361 -426 904 601 1 -1292 -334 -2205 -435 SS 20220906T054404.1Z 8284.238936 89 1 49.34 2 78.99 93.77 149.19 315.62 0.00 1 0.00 1 0 25 3.963e-01 1.002e-02 2.572e-01 5.019e-03 6.033749e-01 2.714794e-03 7.379366e-03 -6.000000e+00 2.277175e-01 229.84 -2.00 3.85 -2.00 321.42 0.00e+00 4.137356e-03 1.325542e-03 1.847580e-03 -6.000000e+00 9.938550e-03 280.61 -2.00 20.00 -2.00 320.85 0.00e+00 5.049 0.003 302.00 328.00 3 2.0023e+00 9.3443e-03 6.1301e-02 -6.0000e+00 5.6872e-01 3.4728e-02 1.2650e-02 3.6370e-02 -6.0000e+00 6.1842e-01 -8.7405e-02 1.2595e-02 1.9819e-02 -6.0000e+00 3.6721e-01 3.3566e-02 5.9887e-03 7.1856e-03 -6.0000e+00 1.5317e-01 2.7423e-04 -4.1870e-04 1.5159e-04 9.5895e-05 -6.0000e+00 1.0853e-02 8.5333e-04 0.0000e+00 12 8 8 10 0 0 70.61 16.90 0.40 0.00085 -0.00229 128 27 4 8 0 385.440 15.01 16.90 22.21 21.17 21.69 26.4 985.90 -171050 -67918 -179172 101926 -55683 -139669 -19625 -154764 129865 -171063 -8466 -112306 -60723 -43653 22702 -9794 -48767 48200 -56082 36379 -59350 19536 -34836 -28249 -10823 -43608 31751 -42855 6490 -41754 10019 -17402 106 9381 -23559 16289 -25946 12403 -6054 10185 -5354 8633 2748 -5208 13952 -6699 13253 425 10831 5111 6707 7211 2251 8375 3172 7392 463 9781 -2841 5030 4511 2181 4254 1961 4131 760 2938 -1344 4054 -17 1613 1596 -1165 2243 -3256 2072 -4636 2343 -3142 638 -651 -2788 -1467 -2662 55 -1952 1712 -370 912 1006 688 78 -2570 556 -781 212 -671 1076 208 -657 -354 -2133 -440 -1832 -744 -1257 -466 -440 378 1002 -1 761 185 -36 -405 96 189 -95 498 -387 660 -627 1160 -227 1024 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