File name: Pandora21s1_Bremen_20240617_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240618T220836.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Tom Hanisco Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 21 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora21_OF_v4d20190904.txt Instrument calibration file used: Pandora21s1_CF_v1d20201116.txt Level 1 file used: Pandora21s1_Bremen_20240617_L1_smca1c1d20201116p1-8.txt Full location name: Bremen University Short location name: Bremen Country of location: Germany Location latitude [deg]: 53.0813 Location longitude [deg]: 8.8126 Location altitude [m]: 50 Local noon date: 20240617 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: None First and last pixel inside fitting window: 286 428 Nominal wavelengths inside fitting window [nm]: 305.0633 305.2039 305.3445 305.4851 305.6257 305.7662 305.9068 306.0473 306.1878 306.3283 306.4688 306.6093 306.7497 306.8902 307.0306 307.1711 307.3115 307.4519 307.5923 307.7326 307.8730 308.0134 308.1537 308.2940 308.4343 308.5747 308.7149 308.8552 308.9955 309.1357 309.2760 309.4162 309.5564 309.6966 309.8368 309.9770 310.1172 310.2573 310.3975 310.5376 310.6777 310.8178 310.9579 311.0980 311.2380 311.3781 311.5181 311.6582 311.7982 311.9382 312.0782 312.2182 312.3581 312.4981 312.6380 312.7779 312.9179 313.0578 313.1976 313.3375 313.4774 313.6172 313.7571 313.8969 314.0367 314.1765 314.3163 314.4561 314.5959 314.7356 314.8754 315.0151 315.1548 315.2945 315.4342 315.5739 315.7135 315.8532 315.9928 316.1325 316.2721 316.4117 316.5513 316.6908 316.8304 316.9700 317.1095 317.2490 317.3885 317.5280 317.6675 317.8070 317.9465 318.0859 318.2254 318.3648 318.5042 318.6436 318.7830 318.9224 319.0617 319.2011 319.3404 319.4798 319.6191 319.7584 319.8977 320.0369 320.1762 320.3155 320.4547 320.5939 320.7331 320.8723 321.0115 321.1507 321.2899 321.4290 321.5682 321.7073 321.8464 321.9855 322.1246 322.2637 322.4028 322.5418 322.6808 322.8199 322.9589 323.0979 323.2369 323.3759 323.5148 323.6538 323.7927 323.9317 324.0706 324.2095 324.3484 324.4872 324.6261 324.7650 324.9038 --------------------------------------------------------------------------------------- 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 20240617T065247.2Z 8934.286658 225 1 47.50 2 58.55 92.25 139.70 345.80 0.00 1 0.00 1 0 17 2.647e-02 7.161e-03 2.779e-02 4.360e-03 3.246821e-01 2.320074e-03 4.271717e-03 -6.000000e+00 1.620070e-02 233.64 -2.00 3.88 -2.00 318.57 0.00e+00 4.821575e-04 4.175321e-04 1.144856e-04 -6.000000e+00 6.351383e-04 280.25 -2.00 20.00 -2.00 318.26 0.00e+00 1.909 0.000 302.00 328.00 3 5.9353e+00 6.2885e-03 2.7277e-02 -6.0000e+00 4.1113e-02 2.4888e-02 7.0311e-03 1.9014e-02 -6.0000e+00 4.4396e-02 2.8902e-04 4.8476e-03 9.4254e-03 -6.0000e+00 2.5980e-02 -4.3281e-03 2.5318e-03 2.6994e-03 -6.0000e+00 1.0723e-02 1.3379e-04 -2.4406e-04 1.3833e-04 3.2313e-05 -6.0000e+00 7.9495e-04 -4.3717e-02 8.2260e-05 12 9 1 12 1 1 99.99 22.27 0.34 -0.04372 -0.04555 14 3 1 5 0 3165.849 25.39 20.00 22.27 23.74 35.6 1015.34 -3683 -7055 -9220 -3974 -7045 20458 -2203 -1809 -1504 4347 -2222 -4258 935 -4987 1608 3286 -32 -1825 -4034 -1434 3435 166 300 2441 -3205 1377 -5835 3632 -1456 1050 -3955 -1196 3183 -1244 -1480 581 807 1230 80 -1805 -1250 -2070 -2261 -605 -2365 1123 -284 1826 -1755 1134 -173 490 1124 72 997 913 945 -484 2183 1370 2298 1799 1073 255 -250 1632 -490 1268 -378 1209 138 -29 67 -258 666 -993 624 -532 1385 -15 -825 -1548 -1589 -1098 -1258 -240 -658 553 -455 -30 -83 904 746 629 1656 1049 1335 407 -63 -629 -235 -1118 -108 43 -1096 -817 -821 -594 -623 -92 -130 79 -231 -485 -88 278 1199 162 839 -632 -121 -780 303 384 318 375 1290 1723 68 727 -246 724 431 371 -73 40 54 -153 -298 -198 -305 -756 -92 -173 -384 -539 -217 -368 784 -107 -97 -89 262 -146 -296 68 -444 155 351 -4 -233 -553 -200 471 24 43 364 -535 231 -1063 588 -236 163 -670 -215 599 -258 -303 114 165 285 22 -598 -461 -823 -936 -252 -1008 465 -119 738 -728 462 -74 223 543 37 532 502 531 -278 1211 758 1278 1059 685 176 -179 1117 -323 793 -247 853 108 -24 57 -215 523 -731 414 -335 865 -10 -638 -1334 -1480 -1075 -1300 -261 -757 654 -550 -36 -94 947 727 585 1553 1064 1485 501 -83 -858 -311 -1400 -126 50 -1326 -1043 -1097 -824 -903 -140 -210 131 -383 -778 -133 394 1636 225 1216 -977 -192 -1256 476 586 467 530 1738 2263 93 1053 -381 1154 706 625 -128 73 104 -297 -585 -386 -583 -1404 -164 SS 20240617T065819.9Z 8934.290508 228 1 50.12 2 57.72 93.38 139.91 347.79 0.00 1 0.00 1 0 17 6.720e-02 1.097e-02 4.041e-02 6.013e-03 3.235530e-01 3.203259e-03 4.255542e-03 -6.000000e+00 4.112531e-02 233.64 -2.00 3.88 -2.00 318.71 0.00e+00 -1.079314e-04 5.939534e-04 1.174847e-04 -6.000000e+00 1.612696e-03 280.25 -2.00 20.00 -2.00 318.39 0.00e+00 1.866 0.000 302.00 328.00 3 5.9596e+00 8.7038e-03 2.6948e-02 -6.0000e+00 1.0436e-01 2.4590e-02 9.7463e-03 1.8962e-02 -6.0000e+00 1.1271e-01 2.2224e-02 6.7794e-03 9.4185e-03 -6.0000e+00 6.5956e-02 -1.4621e-02 3.5473e-03 2.7078e-03 -6.0000e+00 2.7212e-02 1.3537e-04 -8.5769e-04 1.9218e-04 3.2725e-05 -6.0000e+00 2.0190e-03 -4.2975e-02 1.6026e-05 12 8 8 10 0 0 99.98 22.27 0.40 -0.04297 -0.04942 77 15 1 5 0 650.809 25.39 20.00 22.27 23.96 35.7 1016.59 -10375 23422 20644 17649 1356 -4458 23264 -6772 29889 -21140 20754 -726 20278 -6561 1163 7792 -11598 3376 -15612 6617 -3108 17996 -4611 12018 -549 3772 6729 -7034 13028 -10718 10155 -6957 4868 -5619 4429 -1395 -2434 4892 -4306 3412 -6740 -942 -2781 1220 -2202 -249 -2705 -2553 1049 -1767 5091 -1612 5331 -1593 2749 327 755 1268 -1790 2449 -1699 2475 -728 1931 -1069 895 -195 -547 1518 -15 1661 -1353 1702 -654 1117 -272 1312 867 519 467 -1530 226 -1521 -248 -1245 417 -1659 916 133 -693 1000 -1012 935 -884 2557 72 1419 319 784 -345 -1401 365 -976 1161 -2174 -412 -1162 307 -193 504 -63 -703 457 -444 418 -511 1065 121 -281 -45 -317 665 -1264 980 -587 1611 -148 2030 -394 402 62 20 574 -603 236 -763 252 57 398 133 -224 -306 -424 -532 1003 949 819 68 -224 950 -390 1395 -1638 1151 -50 1269 -590 112 785 -1496 400 -2304 830 -439 2124 -680 1598 -87 602 1062 -1227 1804 -1806 1466 -1276 870 -1167 828 -269 -495 1053 -1194 1032 -2514 -356 -1112 480 -900 -100 -1109 -1030 406 -708 1987 -717 2374 -803 1389 174 411 692 -996 1296 -947 1396 -457 1270 -748 598 -124 -336 941 -10 1245 -1111 1385 -534 851 -193 836 520 315 308 -1155 186 -1385 -236 -1265 445 -1911 1072 159 -822 1111 -1063 891 -814 2319 72 1552 389 1029 -469 -1869 447 -1133 1297 -2624 -520 -1551 422 -280 767 -103 -1193 766 -721 631 -729 1446 168 -410 -70 -510 1067 -2024 1493 -870 2240 -200 2624 -537 580 96 32 944 -1033 419 -1438 489 114 798 266 -437 -578 -774 SS 20240617T071128.4Z 8934.299634 237 1 18.92 2 55.76 96.11 140.28 352.54 0.00 1 0.00 1 0 17 1.539e-02 5.434e-03 8.909e-03 2.254e-03 3.053741e-01 1.200070e-03 4.056533e-03 -6.000000e+00 9.422304e-03 233.64 -2.00 3.88 -2.00 317.59 0.00e+00 3.379195e-04 1.679737e-04 8.222230e-05 -6.000000e+00 3.693593e-04 280.25 -2.00 20.00 -2.00 317.28 0.00e+00 1.772 0.000 302.00 328.00 3 4.6842e+00 3.2056e-03 2.5470e-02 -6.0000e+00 2.3911e-02 2.8378e-02 3.5577e-03 1.7837e-02 -6.0000e+00 2.5820e-02 -1.2363e-03 2.2221e-03 8.7613e-03 -6.0000e+00 1.5110e-02 -3.6049e-03 1.1134e-03 2.4601e-03 -6.0000e+00 6.2369e-03 5.5015e-04 -3.3953e-04 6.9790e-05 3.0037e-05 -6.0000e+00 4.6227e-04 -4.4145e-02 9.8107e-05 12 1 1 12 1 1 99.96 22.27 0.21 -0.04414 -0.04670 16 9 1 5 0 1112.299 25.39 20.00 22.27 24.36 35.6 1018.08 3521 -3732 855 -6607 -3020 -752 -5476 911 -8291 -1929 -6175 1406 -1555 2066 -1996 -2881 -282 -1580 1678 -1071 451 1226 2240 754 -111 1906 -1483 1157 -719 2097 348 2890 -773 -869 -504 -180 -55 -1096 -397 -1221 -857 -1544 98 -837 -854 -658 -97 -442 -760 607 447 1142 119 1300 934 1338 751 11 1234 435 1790 332 1522 446 516 483 489 150 781 593 -286 -2 -576 -384 -390 86 78 333 337 -566 -489 -1272 -1359 -1089 -589 -794 -488 -647 -332 8 -90 349 362 1114 765 813 928 451 -128 -371 -360 -797 74 123 -635 -1001 -342 -265 47 264 68 -189 -7 134 -80 647 275 410 11 120 -410 -219 -252 -112 363 153 771 952 729 664 315 202 136 87 -158 -47 -159 168 -123 -164 -262 -536 -294 259 -328 76 -614 -252 -58 -453 78 -858 -202 -688 150 -186 273 -314 -508 -52 -310 334 -226 97 264 484 172 -27 475 -385 286 -172 478 83 729 -217 -257 -146 -51 -16 -364 -153 -545 -421 -807 52 -458 -469 -361 -53 -238 -407 322 245 657 73 827 617 902 518 8 846 298 1226 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