File name: Pandora272s1_Lauder_20260301_L2Fit_fout2c2d20241202p1-8.txt File generation date: 20260301T130100.8Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Richard Querel Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 272 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora272_OF_v3d20240829.txt Instrument calibration file used: Pandora272s1_CF_v2d20241202.txt Level 1 file used: Pandora272s1_Lauder_20260301_L1_smca1c2d20241202p1-8.txt Full location name: Lauder Atmospheric Research Station Short location name: Lauder Country of location: New Zealand Location latitude [deg]: -45.0380 Location longitude [deg]: 169.6840 Location altitude [m]: 370 Local noon date: 20260301 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are latency correction, matrix method stray light correction (replaced by simple method) Data caveats: OoB based on session 1 First and last pixel inside fitting window: 196 338 Nominal wavelengths inside fitting window [nm]: 305.0435 305.1840 305.3244 305.4648 305.6052 305.7456 305.8860 306.0263 306.1667 306.3070 306.4473 306.5877 306.7280 306.8683 307.0086 307.1488 307.2891 307.4293 307.5696 307.7098 307.8500 307.9902 308.1304 308.2706 308.4108 308.5510 308.6911 308.8313 308.9714 309.1115 309.2516 309.3917 309.5318 309.6719 309.8119 309.9520 310.0920 310.2321 310.3721 310.5121 310.6521 310.7921 310.9320 311.0720 311.2120 311.3519 311.4918 311.6317 311.7717 311.9115 312.0514 312.1913 312.3312 312.4710 312.6109 312.7507 312.8905 313.0303 313.1701 313.3099 313.4496 313.5894 313.7292 313.8689 314.0086 314.1483 314.2880 314.4277 314.5674 314.7071 314.8467 314.9864 315.1260 315.2656 315.4052 315.5448 315.6844 315.8240 315.9636 316.1031 316.2427 316.3822 316.5217 316.6612 316.8007 316.9402 317.0797 317.2192 317.3586 317.4981 317.6375 317.7769 317.9163 318.0557 318.1951 318.3345 318.4738 318.6132 318.7525 318.8918 319.0312 319.1705 319.3097 319.4490 319.5883 319.7276 319.8668 320.0060 320.1453 320.2845 320.4237 320.5629 320.7020 320.8412 320.9804 321.1195 321.2586 321.3977 321.5368 321.6759 321.8150 321.9541 322.0932 322.2322 322.3713 322.5103 322.6493 322.7883 322.9273 323.0663 323.2052 323.3442 323.4831 323.6221 323.7610 323.8999 324.0388 324.1777 324.3166 324.4554 324.5943 324.7331 324.8719 --------------------------------------------------------------------------------------- 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 20260228T202724.4Z 9555.852366 488 1 36.80 2 68.08 78.57 143.31 241.99 0.00 1 0.00 1 0 25 2.586e-01 2.112e-02 8.862e-02 4.522e-03 3.429066e-01 2.313156e-03 4.283528e-03 -6.000000e+00 1.496514e-01 229.47 -2.00 3.69 -2.00 318.36 0.00e+00 5.972925e-04 4.330891e-04 2.683012e-04 -6.000000e+00 6.473252e-03 279.33 -2.00 20.00 -2.00 317.69 0.00e+00 2.655 0.000 302.00 328.00 3 5.5986e+00 6.2318e-03 3.1582e-02 -6.0000e+00 3.7374e-01 7.2355e-02 7.0636e-03 1.8812e-02 -6.0000e+00 4.0499e-01 -5.5466e-02 4.6249e-03 9.1889e-03 -6.0000e+00 2.4039e-01 3.0803e-02 2.3712e-03 2.5888e-03 -6.0000e+00 1.0204e-01 9.9818e-05 -3.2373e-03 1.3088e-04 2.8748e-05 -6.0000e+00 7.1246e-03 2.7621e-02 -6.6159e-04 12 9 9 12 9 1 99.99 25.31 -0.07 0.02762 0.00329 11 2 1 8 0 3065.870 19.99 25.31 17.66 35.00 34.00 1.1 955.21 38316 -25024 8759 -11398 273810 -15308 -14017 -69252 -20354 -47783 -33607 -22213 16706 1347 3970 5548 -9798 16865 -11261 7340 -1451 9755 -1003 -588 12036 25017 -7651 10478 -1526 2432 -5577 15019 5153 24680 -20203 7986 3760 -6253 5534 6508 -1988 14197 -173 1198 1913 5953 544 2657 -6017 3092 5541 2726 2834 -1651 208 797 3471 -2973 -4047 6566 7540 4459 2242 1755 -2212 -2023 4225 -5955 2710 -895 1646 817 -2932 2918 -1617 -2786 -1441 -2555 -1461 -465 -2323 -1036 -3096 -3672 -2278 -54 -355 -1201 1507 -1196 968 -643 621 -781 -1354 -2128 -775 2281 658 2704 234 -1164 -2880 -600 1052 274 891 1332 -707 -106 374 -294 -221 895 1518 -278 -944 924 -793 1502 65 -689 1393 659 3057 509 -690 -1690 -348 -764 1239 -320 1020 -1323 235 -8 -350 173 453 6 -45 -498 -1347 1521 -2053 525 -779 1208 -952 -921 -8796 -1759 -5732 -3498 -2175 1275 140 464 712 -1551 2150 -1991 1117 -245 1458 -173 -107 2028 3850 -1640 1765 -271 419 -1131 2709 1125 4604 -5551 1627 877 -1867 1762 2420 -806 5647 -75 517 819 2451 234 1101 -2702 1287 2397 1309 1445 -936 121 470 2033 -1855 -2496 3601 4205 2752 1547 1316 -1751 -1500 2769 -4247 1863 -721 1311 689 -2579 2332 -1373 -2156 -997 -1702 -1001 -356 -2055 -927 -3059 -3830 -2502 -63 -400 -1410 1743 -1380 1099 -681 600 -736 -1344 -2360 -950 2807 889 3578 301 -1407 -3542 -718 1340 345 1167 1832 -1047 -155 584 -478 -354 1339 2250 -391 -1307 1296 -1202 2377 99 -1054 2199 1012 4332 705 -924 -2245 -485 -1155 1956 -500 1613 -2205 408 -15 -667 312 829 11 -82 -889 -2340 SS 20260301T002654.4Z 9556.018686 658 1 55.07 2 37.83 10.86 149.58 135.25 0.00 1 0.00 1 0 17 2.726e-02 1.551e-02 4.792e-03 2.841e-03 1.774101e-01 1.467069e-03 2.135786e-03 -6.000000e+00 1.582475e-02 229.45 -2.00 3.69 -2.00 315.61 0.00e+00 -4.763698e-05 1.395281e-04 3.334674e-05 -6.000000e+00 6.829856e-04 279.32 -2.00 20.00 -2.00 315.02 0.00e+00 1.265 0.000 302.00 328.00 3 6.7864e+00 3.7927e-03 1.5327e-02 -6.0000e+00 3.9523e-02 5.7632e-02 4.2109e-03 9.2862e-03 -6.0000e+00 4.2777e-02 -1.3871e-02 2.4224e-03 4.5254e-03 -6.0000e+00 2.5392e-02 7.8505e-03 1.0906e-03 1.2635e-03 -6.0000e+00 1.0816e-02 1.4765e-04 8.0682e-05 8.1718e-05 1.4893e-05 -6.0000e+00 7.4977e-04 1.8155e-02 -6.3533e-05 12 9 8 11 32 0 99.93 25.28 -0.51 0.01815 0.01876 25 3 2 8 0 2202.730 19.99 25.28 16.35 35.00 33.75 1.1 948.42 3454 -3701 1576 2655 9177 -3743 -406 -12593 -1783 -8498 -6803 -4756 4002 3328 1044 2514 -3584 4210 -2664 2442 -51 2988 -1827 2735 2165 5091 -1941 1992 684 -2210 -3375 4753 428 9109 -8543 -147 -1516 -3748 2008 3369 -2077 -1192 -734 494 392 1227 -577 174 -3589 -966 1309 1535 1619 -1183 911 616 1650 208 -1120 3131 4791 3105 1594 1751 -1907 -2266 -2583 -3252 1160 408 1518 798 -802 1704 -465 -940 -931 -2128 -1817 -1068 -2447 -210 -2028 -3195 -1903 129 -178 -38 1894 -690 1157 -516 30 -1241 -487 -1412 -921 2195 1090 2505 339 -343 -2690 54 471 -62 310 758 -1205 -176 637 460 243 1095 1324 -19 -1094 -50 -1207 1395 -13 -777 1103 690 2591 838 -656 -1302 -958 -1166 752 -347 430 -983 -88 368 -229 208 670 -212 132 -411 -846 911 -1121 455 699 1988 -880 -97 -3740 -523 -2785 -2137 -1465 1229 1141 407 946 -1467 1623 -1130 1009 -22 1224 -798 1193 984 2312 -944 868 303 -974 -1551 2104 210 4192 -3968 -67 -757 -1988 1191 2301 -1497 -883 -555 371 292 980 -456 132 -2713 -700 960 1188 1309 -944 733 502 1350 172 -922 2671 4115 2637 1476 1712 -1926 -2108 -2204 -2910 1019 369 1501 836 -862 1735 -455 -834 -807 -1729 -1477 -947 -2246 -208 -2184 -3627 -2272 150 -219 -49 2402 -873 1332 -596 31 -1223 -485 -1537 -1097 2586 1389 3128 410 -422 -3167 63 587 -76 396 1010 -1702 -258 972 663 367 1524 1681 -25 -1381 -64 -1542 1874 -19 -1115 1528 927 3483 1088 -819 -1588 -1210 -1562 954 -460 572 -1350 -126 555 -359 332 1009 -341 205 -623 -1252 SS 20260301T012448.2Z 9556.058891 701 1 0.36 2 38.00 347.41 141.57 117.21 0.00 1 0.00 1 0 17 1.026e-02 8.555e-03 6.017e-03 4.614e-03 1.772321e-01 2.413177e-03 2.276213e-03 -6.000000e+00 5.959363e-03 229.45 -2.00 3.69 -2.00 314.33 0.00e+00 3.944662e-04 1.795068e-04 4.239313e-05 -6.000000e+00 2.570759e-04 279.32 -2.00 20.00 -2.00 313.84 0.00e+00 1.268 0.000 302.00 328.00 3 2.5700e+00 6.1697e-03 1.5508e-02 -6.0000e+00 1.4884e-02 3.7644e-02 6.8108e-03 9.5755e-03 -6.0000e+00 1.6107e-02 -6.4342e-03 3.9076e-03 4.6876e-03 -6.0000e+00 9.5611e-03 2.1124e-04 1.7024e-03 1.3125e-03 -6.0000e+00 4.0742e-03 1.0017e-02 -4.4115e-04 1.2965e-04 1.8157e-05 -6.0000e+00 2.8219e-04 1.7369e-02 2.6007e-05 12 9 1 12 1 1 999.00 25.29 0.40 0.01737 0.01405 1 32 1 8 0 178.970 20.00 25.29 17.87 35.00 33.75 1.0 953.21 -2135 -638 384 90 -1609 -2835 -13 1067 -822 256 -137 -1943 62 94 1209 872 -156 919 -444 1628 773 -353 1669 929 1209 2030 -477 -254 -663 1069 1638 975 2731 -951 -2478 -2529 -2255 -1453 -1144 108 -586 -89 -1512 -937 -2122 0 -259 -239 -1107 -483 137 941 1498 1741 583 872 296 126 576 1293 936 721 1965 1937 1072 -70 -222 -1465 300 277 569 386 346 990 -601 282 -915 -1369 -1183 -583 -1607 -243 -1514 -2437 -1097 -1212 -508 233 388 141 329 724 -869 -10 -21 299 917 542 1387 -243 30 -1346 -1066 -548 -743 -1150 -74 -974 210 359 216 922 563 437 184 -507 343 164 501 287 -129 931 584 324 513 650 18 566 214 -193 -319 -173 -121 -632 -184 -111 -443 244 650 31 485 -397 -1371 -894 -270 162 37 -626 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