File name: Pandora257s1_AustinTX_20240416_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20240417T063732.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Paul Walter Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 257 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora257_OF_v3d20221216.txt Instrument calibration file used: Pandora257s1_CF_v2d20230110.txt Level 1 file used: Pandora257s1_AustinTX_20240416_L1_smca1c2d20230110p1-8.txt Full location name: St. Edward's University Short location name: AustinTX Country of location: United States Location latitude [deg]: 30.2285 Location longitude [deg]: -97.7544 Location altitude [m]: 205 Local noon date: 20240416 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 session based on clearance session 1 First and last pixel inside fitting window: 228 370 Nominal wavelengths inside fitting window [nm]: 305.0779 305.2183 305.3587 305.4991 305.6395 305.7799 305.9203 306.0607 306.2010 306.3413 306.4817 306.6220 306.7623 306.9026 307.0429 307.1832 307.3234 307.4637 307.6039 307.7442 307.8844 308.0246 308.1648 308.3050 308.4452 308.5854 308.7255 308.8657 309.0058 309.1459 309.2860 309.4261 309.5662 309.7063 309.8464 309.9865 310.1265 310.2665 310.4066 310.5466 310.6866 310.8266 310.9666 311.1065 311.2465 311.3865 311.5264 311.6663 311.8062 311.9461 312.0860 312.2259 312.3658 312.5057 312.6455 312.7854 312.9252 313.0650 313.2048 313.3446 313.4844 313.6242 313.7639 313.9037 314.0434 314.1832 314.3229 314.4626 314.6023 314.7420 314.8816 315.0213 315.1610 315.3006 315.4402 315.5799 315.7195 315.8591 315.9986 316.1382 316.2778 316.4173 316.5569 316.6964 316.8359 316.9754 317.1149 317.2544 317.3939 317.5334 317.6728 317.8123 317.9517 318.0911 318.2305 318.3699 318.5093 318.6487 318.7880 318.9274 319.0667 319.2061 319.3454 319.4847 319.6240 319.7633 319.9025 320.0418 320.1810 320.3203 320.4595 320.5987 320.7379 320.8771 321.0163 321.1555 321.2946 321.4338 321.5729 321.7121 321.8512 321.9903 322.1294 322.2685 322.4075 322.5466 322.6856 322.8247 322.9637 323.1027 323.2417 323.3807 323.5197 323.6587 323.7976 323.9366 324.0755 324.2144 324.3533 324.4922 324.6311 324.7700 324.9089 --------------------------------------------------------------------------------------- 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 20240416T140647.2Z 8872.588047 156 1 54.90 2 64.09 92.87 126.18 10.65 0.00 1 0.00 1 0 17 6.136e-02 1.453e-02 1.360e-02 3.097e-03 2.808682e-01 1.693345e-03 3.081704e-03 -6.000000e+00 3.924288e-02 229.39 -2.00 3.25 -2.00 318.06 0.00e+00 5.844410e-04 3.124829e-04 1.897221e-04 -6.000000e+00 1.794873e-03 286.75 -2.00 20.00 -2.00 317.24 0.00e+00 2.274 0.000 302.00 328.00 3 5.8251e+00 4.5570e-03 2.6044e-02 -6.0000e+00 9.7558e-02 1.0403e-02 5.1578e-03 1.3704e-02 -6.0000e+00 1.0534e-01 2.0598e-02 3.1872e-03 6.5698e-03 -6.0000e+00 6.2858e-02 -1.7369e-02 1.5659e-03 1.9454e-03 -6.0000e+00 2.5996e-02 1.2013e-04 2.7905e-04 1.1132e-04 2.8508e-05 -6.0000e+00 2.2172e-03 2.1387e-02 1.8296e-06 12 8 8 10 0 0 99.98 28.01 0.21 0.02139 0.02348 46 4 1 5 0 1193.330 36.00 20.00 28.01 27.25 0.0 952.47 4720 -16409 -5112 5390 -24325 -19464 -23026 -5798 15739 -8988 -3646 4003 -104 13063 21421 -3207 -5502 17456 15771 9743 17985 -755 19351 1950 4548 -9038 -5013 6807 -3081 4830 3682 400 -4897 2694 -9522 -2310 -10323 -7736 -2257 2482 1664 2109 1618 -2539 -3588 -3690 -3486 5116 -1361 1971 2053 6386 -505 4945 -4589 -1718 730 744 -90 60 -215 298 5689 475 -3970 -3501 3243 2469 -706 1467 43 1410 184 922 1629 -133 728 -3269 -677 -904 -1274 -685 -3261 -1399 -2 -996 -24 679 1156 422 -1235 268 1477 -720 1476 3013 1305 465 -420 -344 -589 -769 687 165 -1084 -1377 -703 284 228 1030 355 60 -552 996 -611 -88 177 -585 -636 -503 -41 -740 252 1936 -780 -22 535 319 1127 -558 -648 -762 654 -248 -414 561 -180 427 1099 264 -296 -779 -448 312 -1427 -400 366 -2130 -1617 -2093 -483 1141 -877 -352 386 -12 1456 2458 -513 -959 2536 2424 1642 2852 -147 3179 399 945 -2192 -1155 1351 -658 961 778 93 -1269 658 -2626 -610 -3246 -2731 -877 1042 768 1023 739 -1225 -1754 -1798 -1675 2452 -695 995 1087 3437 -280 2722 -2875 -1071 449 458 -55 37 -140 204 3939 361 -3134 -2639 2194 1683 -525 1164 37 1250 165 792 1297 -99 499 -2273 -478 -703 -1103 -647 -3397 -1522 -2 -1120 -28 808 1365 484 -1350 292 1491 -731 1531 3353 1492 582 -556 -453 -741 -914 777 191 -1336 -1800 -961 404 343 1497 543 92 -838 1524 -889 -121 241 -829 -951 -790 -66 -1188 392 2847 -1123 -30 704 423 1552 -828 -1014 -1241 1083 -398 -698 982 -328 788 2024 482 -528 -1353 -764 SS 20240416T142814.1Z 8872.602941 174 1 54.78 2 59.46 95.76 125.20 16.33 0.00 1 0.00 1 0 17 3.598e-02 1.191e-02 7.973e-03 2.584e-03 2.452882e-01 1.415766e-03 2.646251e-03 -6.000000e+00 2.303394e-02 229.40 -2.00 3.25 -2.00 317.38 0.00e+00 -1.470370e-06 2.189805e-04 5.945136e-05 -6.000000e+00 1.052744e-03 286.75 -2.00 20.00 -2.00 316.57 0.00e+00 1.960 0.000 302.00 328.00 3 5.8845e+00 3.7528e-03 2.2430e-02 -6.0000e+00 5.7263e-02 1.8222e-02 4.2224e-03 1.1671e-02 -6.0000e+00 6.1814e-02 1.6550e-02 2.4854e-03 5.6554e-03 -6.0000e+00 3.6888e-02 -1.4143e-02 1.1718e-03 1.5613e-03 -6.0000e+00 1.5269e-02 1.6167e-04 9.8838e-04 9.2473e-05 2.3132e-05 -6.0000e+00 1.3004e-03 1.9652e-02 1.4086e-04 12 8 8 10 0 0 99.99 28.01 0.76 0.01965 0.02708 86 8 1 5 0 636.880 36.00 20.00 28.01 28.04 0.0 958.99 111 -12004 -5578 -4462 -16620 -13101 -8429 -1612 6978 -9797 597 -3751 -2676 5773 7765 -3960 -3281 5662 6188 4658 7295 1885 11373 3546 3094 -4090 -3941 3259 -1197 3480 2496 -775 -2613 1785 -5421 10971 -6269 -2718 -784 508 -37 1400 737 -2275 -1832 -2876 -1982 3616 -1297 1531 -166 4937 -269 3579 -3080 -660 231 637 132 527 -712 -376 4574 867 -3006 -2637 1923 1965 -1526 1746 141 683 -192 727 1343 166 486 -2030 -212 -1142 -1435 -958 -2611 -1100 312 -773 201 546 1320 828 -1209 440 -229 -455 1113 1474 882 628 -340 -775 -525 -877 222 239 -837 -1410 -818 242 -96 1071 570 366 -275 742 -463 -329 380 -534 -308 -109 126 -309 388 1807 -578 -109 431 365 918 -853 -189 -585 660 -315 -324 545 -424 541 1078 -42 -396 -818 -445 12 -1521 -663 -504 -2018 -1522 -983 -191 816 -1417 81 -562 -437 970 1416 -877 -761 1251 1408 1107 1721 477 2691 946 863 -1246 -1182 876 -325 900 676 -229 -824 545 -1770 3121 -2319 -1115 -366 241 -19 752 409 -1315 -1054 -1658 -1113 1886 -704 821 -94 2819 -171 2282 -2166 -463 162 446 92 370 -525 -293 3593 732 -2611 -2178 1448 1470 -1244 1498 132 661 -187 679 1167 134 361 -1500 -160 -946 -1317 -956 -2607 -1150 343 -911 246 683 1635 994 -1387 459 -245 -477 1194 1565 1033 799 -456 -1038 -670 -1061 257 281 -1050 -1880 -1141 323 -135 1570 872 565 -415 1044 -666 -449 510 -746 -453 -156 185 -453 553 2644 -825 -148 563 477 1244 -1242 -286 -851 974 -488 -525 918 -744 962 1914 -74 -682 -1376 -735 SS 20240416T143300.0Z 8872.606250 177 1 55.15 2 58.44 96.42 124.92 17.56 0.00 1 0.00 1 0 17 3.836e-02 1.423e-02 8.854e-03 3.055e-03 2.313226e-01 1.675671e-03 2.542602e-03 -6.000000e+00 2.453118e-02 229.40 -2.00 3.25 -2.00 317.25 0.00e+00 2.001635e-04 2.509001e-04 5.465678e-05 -6.000000e+00 1.122145e-03 286.75 -2.00 20.00 -2.00 316.45 0.00e+00 1.903 0.000 302.00 328.00 3 6.2165e+00 4.4291e-03 2.1658e-02 -6.0000e+00 6.0984e-02 1.3650e-02 4.9664e-03 1.1137e-02 -6.0000e+00 6.5851e-02 2.3518e-02 2.9177e-03 5.3876e-03 -6.0000e+00 3.9294e-02 -1.5012e-02 1.3718e-03 1.5004e-03 -6.0000e+00 1.6250e-02 1.2540e-04 6.1803e-04 1.0925e-04 2.2724e-05 -6.0000e+00 1.3861e-03 2.1143e-02 -3.4808e-05 12 8 8 10 0 0 99.99 28.01 0.20 0.02114 0.02579 37 4 1 5 0 1490.380 36.00 20.00 28.01 28.33 0.0 961.64 -1344 -5155 -1264 3365 -18551 -12099 -5284 -2292 4254 -6945 -3606 226 -3206 -7216 16076 -4898 -5397 10725 5484 4335 11066 2254 4397 2317 4621 -4326 -3714 4942 -2326 3439 3639 862 -3003 2010 -7920 12700 -7502 -5147 -1136 1584 1680 1609 821 -1844 -311 -1975 -2756 2938 -498 1553 1155 5199 -1385 2834 -3500 -1010 -275 -10 792 -213 -872 454 6124 443 -3521 -3492 1453 1504 -81 2132 126 1712 -426 636 829 925 -19 -3644 -1545 -1159 -2162 -1092 -2493 -1087 461 -923 263 890 1525 669 -1018 -537 1158 -246 484 2219 1212 491 -735 423 -823 -1030 -37 -74 -910 -729 -865 -31 84 1171 1080 700 -287 998 -868 -96 93 -754 -364 -474 75 -1211 665 1718 -1003 138 701 24 1427 -1085 -895 -732 955 51 -678 459 -533 624 1619 114 -690 -719 -313 -160 -671 -158 384 -2509 -1521 -653 -298 556 -1059 -550 35 -568 -1488 2898 -1172 -1365 2400 1336 1098 2667 602 1182 662 1340 -1391 -1167 1371 -670 932 1020 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