File name: Pandora75s1_EssexMD_20240715_L2Fit_fout2c1d20221230p1-8.txt File generation date: 20240716T052311.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 75 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora75_OF_v3d20220127.txt Instrument calibration file used: Pandora75s1_CF_v104d20221230.txt Level 1 file used: Pandora75s1_EssexMD_20240715_L1_smca1c1d20221230p1-8.txt Full location name: MDE Essex Monitoring Site Short location name: EssexMD Country of location: United States Location latitude [deg]: 39.3109 Location longitude [deg]: -76.4745 Location altitude [m]: 12 Local noon date: 20240715 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-data based on session 103 First and last pixel inside fitting window: 196 337 Nominal wavelengths inside fitting window [nm]: 305.0663 305.2078 305.3493 305.4908 305.6322 305.7737 305.9151 306.0566 306.1980 306.3394 306.4807 306.6221 306.7635 306.9048 307.0461 307.1874 307.3287 307.4700 307.6112 307.7524 307.8937 308.0349 308.1761 308.3172 308.4584 308.5996 308.7407 308.8818 309.0229 309.1640 309.3051 309.4461 309.5872 309.7282 309.8692 310.0102 310.1512 310.2921 310.4331 310.5740 310.7149 310.8558 310.9967 311.1376 311.2784 311.4193 311.5601 311.7009 311.8417 311.9825 312.1233 312.2640 312.4048 312.5455 312.6862 312.8269 312.9676 313.1083 313.2489 313.3896 313.5302 313.6708 313.8114 313.9520 314.0925 314.2331 314.3736 314.5141 314.6547 314.7951 314.9356 315.0761 315.2165 315.3570 315.4974 315.6378 315.7782 315.9186 316.0590 316.1993 316.3397 316.4800 316.6203 316.7606 316.9009 317.0411 317.1814 317.3216 317.4619 317.6021 317.7423 317.8825 318.0227 318.1628 318.3030 318.4431 318.5832 318.7233 318.8634 319.0035 319.1436 319.2836 319.4237 319.5637 319.7037 319.8437 319.9837 320.1237 320.2636 320.4036 320.5435 320.6834 320.8233 320.9632 321.1031 321.2430 321.3828 321.5227 321.6625 321.8023 321.9421 322.0819 322.2217 322.3615 322.5012 322.6409 322.7807 322.9204 323.0601 323.1998 323.3395 323.4791 323.6188 323.7584 323.8980 324.0376 324.1772 324.3168 324.4564 324.5960 324.7355 324.8750 --------------------------------------------------------------------------------------- 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 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: 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 20240715T113056.9Z 8962.479825 81 1 6.62 2 73.10 75.88 157.54 342.36 0.00 1 0.00 1 0 17 8.355e-02 8.627e-03 2.736e-02 2.839e-03 4.410800e-01 1.546575e-03 5.226661e-03 -6.000000e+00 5.173987e-02 232.75 -2.00 3.48 -2.00 318.95 0.00e+00 1.823773e-03 3.641933e-04 1.098229e-03 -6.000000e+00 2.296114e-03 290.49 -2.00 20.00 -2.00 318.12 0.00e+00 3.387 0.001 302.00 328.00 3 2.1401e+00 4.2954e-03 4.1354e-02 -6.0000e+00 1.2967e-01 3.2432e-03 4.9463e-03 2.3732e-02 -6.0000e+00 1.3916e-01 -5.0235e-02 3.5060e-03 1.1552e-02 -6.0000e+00 8.2998e-02 1.4356e-02 1.8388e-03 3.1929e-03 -6.0000e+00 3.5416e-02 1.2589e-03 -1.0566e-03 8.7899e-05 4.0469e-05 -6.0000e+00 2.5761e-03 -3.7223e-02 1.6320e-04 12 9 1 12 1 1 8.43 23.58 0.53 -0.03722 -0.04516 16 22 1 5 0 389.380 26.32 19.99 23.58 37.10 4.3 1071.65 -21443 -33481 -20316 -30884 -35586 -25166 -31680 -22398 -27992 -20601 -29081 -13397 -18100 -8951 -11280 -771 -1617 -2960 1220 -1312 2420 740 -94 159 -499 2893 321 -4461 -1167 -7073 418 -1950 -433 -1667 -5176 -3733 -3924 -2163 -863 -2836 -945 461 1061 2140 2161 1240 953 1096 349 1069 1241 781 814 2960 926 474 305 -41 288 -487 938 1729 2790 2684 1497 -151 171 165 976 2220 842 1207 1059 423 -113 -1156 -2377 -2960 -2629 -1733 -1865 -2490 -2267 -1350 -311 410 594 1365 1162 583 643 -82 -414 -852 -864 62 -218 237 194 -624 -1247 -1289 -1254 -365 -891 -1044 -693 -397 350 984 1043 631 265 204 -405 145 509 281 168 327 343 462 1073 542 379 -203 -188 364 -178 -129 -220 -364 -597 265 160 186 443 472 33 -296 -605 -837 -558 -1140 -652 -1094 -1231 -752 -1052 -750 -1108 -821 -1320 -556 -912 -496 -765 -55 -128 -256 108 -126 230 73 -10 17 -58 340 39 -559 -137 -899 54 -292 -71 -294 -931 -658 -750 -428 -202 -801 -295 152 363 744 760 445 344 397 130 409 467 322 362 1382 464 247 163 -22 152 -258 507 924 1625 1696 982 -98 106 103 650 1522 642 964 847 327 -82 -824 -1587 -1955 -1855 -1281 -1575 -2212 -2182 -1285 -314 438 628 1476 1261 653 672 -80 -410 -850 -870 70 -261 297 259 -835 -1588 -1610 -1482 -435 -1137 -1335 -933 -537 504 1449 1641 1025 425 311 -616 210 736 426 257 520 552 730 1637 841 562 -290 -262 520 -277 -208 -360 -627 -1026 475 304 354 867 940 65 -574 -1128 -1572 SS 20240715T115429.5Z 8962.496175 92 1 51.58 2 68.66 79.27 158.41 356.51 0.00 1 0.00 1 0 17 3.045e-02 7.768e-03 4.436e-03 8.526e-04 3.621383e-01 4.632687e-04 4.325655e-03 -6.000000e+00 1.885543e-02 232.75 -2.00 3.48 -2.00 318.07 0.00e+00 1.075302e-03 8.332940e-05 6.196583e-04 -6.000000e+00 8.368614e-04 290.49 -2.00 20.00 -2.00 317.22 0.00e+00 2.722 0.000 302.00 328.00 3 2.6000e+00 1.2491e-03 3.3398e-02 -6.0000e+00 4.7256e-02 5.3963e-03 1.4044e-03 1.9200e-02 -6.0000e+00 5.0718e-02 -1.8844e-02 8.8842e-04 9.2238e-03 -6.0000e+00 3.0249e-02 5.6020e-04 4.5529e-04 2.4911e-03 -6.0000e+00 1.2904e-02 1.6491e-03 -1.4248e-03 2.6711e-05 3.1141e-05 -6.0000e+00 9.3910e-04 -3.6034e-02 1.3515e-04 11 8 0 10 0 0 99.98 23.58 0.40 -0.03603 -0.04674 132 21 1 5 0 390.750 26.32 20.00 23.58 38.34 4.3 1079.68 -6623 -7142 -392 -7349 -13215 -13372 -7634 -12683 -8572 -6765 -9787 -8457 -7095 -3477 -3054 1713 -482 731 2274 2068 3059 1146 1466 334 1136 788 1301 -962 -536 -2432 219 -623 -384 -1193 -3619 -3336 -4771 -2061 -1432 -871 -101 -153 135 815 589 647 863 -209 49 -273 491 719 1425 1614 821 937 819 581 43 529 632 1421 2184 2153 915 158 -314 -280 736 1227 1219 967 790 238 -62 -1075 -2054 -2552 -2240 -1850 -1831 -2067 -1878 -1233 -585 -98 541 873 920 730 351 -304 -485 -671 -235 -55 395 687 187 -231 -1005 -1455 -945 -641 -977 -1134 -600 -311 471 955 823 544 284 19 -62 -19 256 256 518 433 412 578 660 534 271 -31 62 274 184 -45 -426 -553 -400 -89 4 100 376 428 27 -105 -479 -818 -354 -438 -24 -472 -832 -803 -448 -864 -624 -522 -805 -721 -673 -373 -382 233 -73 116 377 359 540 208 272 60 216 157 261 -191 -101 -469 44 -140 -94 -309 -941 -856 -1337 -650 -491 -349 -45 -73 61 375 273 301 399 -97 24 -130 246 389 820 986 491 576 514 366 27 328 404 967 1611 1588 694 115 -236 -209 539 998 1019 850 698 203 -52 -839 -1594 -1932 -1666 -1541 -1617 -2034 -1876 -1299 -619 -110 636 1054 1112 853 384 -327 -490 -671 -249 -61 489 890 244 -301 -1316 -1777 -1153 -796 -1229 -1513 -797 -435 663 1436 1252 846 432 28 -87 -26 359 375 767 673 651 899 998 777 395 -43 85 378 273 -69 -659 -892 -667 -149 8 177 682 791 49 -190 -834 -1441 SS 20240715T120447.4Z 8962.503326 95 1 51.59 2 66.70 80.76 158.46 2.90 0.00 1 0.00 1 0 17 2.009e-02 7.901e-03 1.104e-03 3.033e-04 3.338628e-01 1.645017e-04 3.975887e-03 -6.000000e+00 1.244325e-02 232.75 -2.00 3.48 -2.00 317.46 0.00e+00 1.055846e-03 2.492106e-05 4.591145e-04 -6.000000e+00 5.521996e-04 290.49 -2.00 20.00 -2.00 316.60 0.00e+00 2.508 0.000 302.00 328.00 3 8.5521e-01 4.3800e-04 3.0689e-02 -6.0000e+00 3.1186e-02 -2.9479e-03 4.8941e-04 1.7469e-02 -6.0000e+00 3.3467e-02 -2.0283e-02 2.9619e-04 8.4409e-03 -6.0000e+00 1.9960e-02 1.9987e-03 1.4701e-04 2.3144e-03 -6.0000e+00 8.5177e-03 1.2146e-02 -9.5255e-04 9.4798e-06 2.8868e-05 -6.0000e+00 6.1948e-04 -3.7007e-02 1.8999e-04 11 8 0 10 0 0 26.79 23.58 0.43 -0.03701 -0.04416 793 129 1 5 0 65.050 26.32 20.00 23.58 38.63 4.3 1082.32 -4534 -2785 -2015 -3267 -6841 -7012 -6339 -6351 -5030 -5796 -6461 -6721 -4302 -3213 -1018 114 361 1177 1934 2008 1921 1741 1411 1406 1188 1267 555 -471 -830 -1247 -258 363 78 -1226 -3370 -3881 -3683 -2341 -737 -401 -281 -14 299 443 488 727 206 -70 -331 4 517 945 1073 1260 1001 912 772 402 146 371 848 1616 2172 1962 1078 179 -285 -240 621 1277 935 962 776 377 -81 -1080 -1864 -2378 -2210 -1881 -1901 -2032 -1917 -1651 -682 -180 429 853 820 622 326 -59 -587 -532 -346 -67 446 565 182 -351 -966 -1480 -997 -658 -874 -1062 -612 -247 454 890 941 658 375 68 -132 2 211 482 611 443 481 581 610 493 361 -15 20 218 254 -11 -245 -470 -377 27 32 86 343 310 -7 -179 -544 -932 -374 -256 -194 -312 -624 -608 -563 -620 -539 -672 -777 -844 -590 -507 -166 21 71 243 418 451 444 406 338 354 317 352 157 -130 -219 -328 -71 101 24 -393 -1076 -1230 -1252 -906 -309 -182 -142 -7 165 250 277 412 117 -39 -185 2 289 566 686 799 664 622 537 281 101 255 599 1215 1663 1607 901 144 -219 -182 495 1064 855 875 709 352 -71 -915 -1462 -1813 -1767 -1587 -1808 -2033 -1964 -1788 -745 -209 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