File name: Pandora75s1_EssexMD_20241208_L2Fit_fout2c3d20230525p1-8.txt File generation date: 20250117T120704.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 75 Spectrometer number: 1 Processing software version used: BlickP v1.8.70 Instrument operation file used: Pandora75_OF_v3d20220127.txt Instrument calibration file used: Pandora75s1_CF_v3d20230525.txt Level 1 file used: Pandora75s1_EssexMD_20241208_L1_smca1c3d20230525p1-8.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: 20241208 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 session 2 First and last pixel inside fitting window: 196 338 Nominal wavelengths inside fitting window [nm]: 305.0305 305.1717 305.3128 305.4540 305.5951 305.7363 305.8774 306.0185 306.1596 306.3007 306.4418 306.5828 306.7239 306.8649 307.0060 307.1470 307.2880 307.4290 307.5700 307.7110 307.8519 307.9929 308.1338 308.2747 308.4157 308.5566 308.6975 308.8384 308.9792 309.1201 309.2610 309.4018 309.5426 309.6834 309.8243 309.9651 310.1058 310.2466 310.3874 310.5281 310.6689 310.8096 310.9503 311.0910 311.2317 311.3724 311.5131 311.6537 311.7944 311.9350 312.0757 312.2163 312.3569 312.4975 312.6381 312.7786 312.9192 313.0598 313.2003 313.3408 313.4813 313.6218 313.7623 313.9028 314.0433 314.1838 314.3242 314.4646 314.6051 314.7455 314.8859 315.0263 315.1667 315.3070 315.4474 315.5877 315.7281 315.8684 316.0087 316.1490 316.2893 316.4296 316.5699 316.7101 316.8504 316.9906 317.1308 317.2710 317.4112 317.5514 317.6916 317.8318 317.9719 318.1121 318.2522 318.3923 318.5324 318.6725 318.8126 318.9527 319.0927 319.2328 319.3728 319.5129 319.6529 319.7929 319.9329 320.0729 320.2128 320.3528 320.4927 320.6327 320.7726 320.9125 321.0524 321.1923 321.3322 321.4721 321.6119 321.7518 321.8916 322.0314 322.1712 322.3110 322.4508 322.5906 322.7304 322.8701 323.0099 323.1496 323.2893 323.4290 323.5687 323.7084 323.8481 323.9877 324.1274 324.2670 324.4067 324.5463 324.6859 324.8255 324.9650 --------------------------------------------------------------------------------------- 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 20241208T141548.5Z 9108.594311 105 1 3.40 2 72.76 141.12 127.33 65.27 0.00 1 0.00 1 0 17 6.218e-02 8.556e-03 2.948e-02 3.754e-03 4.122009e-01 1.924838e-03 4.812761e-03 -6.000000e+00 3.652892e-02 223.19 -2.00 3.48 -2.00 318.61 0.00e+00 2.208947e-03 4.151645e-04 5.442529e-04 -6.000000e+00 1.626098e-03 279.16 -2.00 20.00 -2.00 317.95 0.00e+00 3.326 0.001 302.00 328.00 3 2.4245e+00 5.2052e-03 3.8902e-02 -6.0000e+00 8.9797e-02 -3.1540e-03 5.9685e-03 2.0605e-02 -6.0000e+00 9.7861e-02 -2.3036e-03 4.1272e-03 1.0449e-02 -6.0000e+00 5.8431e-02 -2.3362e-03 2.1485e-03 3.4601e-03 -6.0000e+00 2.4407e-02 1.0634e-03 -6.1386e-04 1.1657e-04 4.1390e-05 -6.0000e+00 1.9223e-03 1.1043e-02 -6.5976e-05 12 9 1 12 1 1 -170.47 23.01 0.58 0.01104 0.00643 6 17 1 5 0 485.490 25.90 19.99 23.01 14.50 5.6 921.98 -46062 -6729 -11758 -5170 -22719 -11243 -11638 -23667 -12341 -7660 -9491 -26461 -6422 -12981 -5359 -372 -6388 -3026 -962 -80 2940 -1470 825 -1662 -2407 2954 -5699 3222 -2629 -3300 1817 -754 2408 -2929 -1750 -3496 -6422 -4614 1291 -74 856 -471 -893 -664 136 1080 634 523 239 2333 -37 1912 1819 3120 618 1517 1581 -246 529 954 1946 546 2351 1618 1806 1251 -423 15 889 1133 1314 1316 372 749 -715 -1857 -2630 -905 -1515 -1765 -2174 -2569 -2024 -1649 -1354 -444 809 610 578 520 318 571 -1076 143 -599 15 543 383 -94 -287 -1156 -1083 -761 -412 -1261 -959 -443 -341 710 831 624 588 -84 -36 -290 6 591 52 252 271 45 801 753 898 194 63 88 353 785 85 -271 -256 -181 -256 7 379 313 359 131 -108 -436 -568 -943 -2125 -239 -465 -187 -915 -391 -426 -1083 -560 -356 -469 -1676 -388 -1008 -459 -35 -699 -345 -114 -10 361 -190 108 -236 -366 445 -945 475 -400 -520 299 -130 445 -598 -347 -706 -1451 -1192 376 -24 300 -179 -355 -269 55 441 261 216 100 997 -16 883 906 1635 348 872 926 -136 309 553 1160 332 1543 1152 1222 879 -292 10 611 870 1030 1078 306 627 -563 -1343 -1906 -636 -1074 -1425 -1879 -2338 -1982 -1710 -1412 -490 925 680 643 589 336 592 -1074 141 -643 17 652 486 -127 -384 -1468 -1337 -890 -490 -1610 -1227 -595 -462 1022 1233 945 911 -128 -55 -431 8 837 78 377 424 71 1234 1127 1350 280 87 125 492 1178 133 -434 -428 -301 -448 12 698 593 664 241 -201 -782 -1022 -1684 SS 20241208T150548.7Z 9108.629036 131 1 39.18 2 67.43 151.99 118.46 74.77 0.00 1 0.00 1 0 17 5.534e-02 1.051e-02 1.589e-02 3.006e-03 3.357532e-01 1.542319e-03 4.012889e-03 -6.000000e+00 3.250989e-02 223.19 -2.00 3.48 -2.00 318.12 0.00e+00 1.218378e-03 2.829865e-04 6.770841e-04 -6.000000e+00 1.447165e-03 279.16 -2.00 20.00 -2.00 317.47 0.00e+00 2.584 0.000 302.00 328.00 3 5.0635e+00 4.1072e-03 3.0690e-02 -6.0000e+00 7.9917e-02 2.9355e-02 4.6676e-03 1.6857e-02 -6.0000e+00 8.7094e-02 8.3510e-04 2.9966e-03 8.4437e-03 -6.0000e+00 5.2002e-02 -5.8306e-03 1.5303e-03 2.4751e-03 -6.0000e+00 2.1722e-02 1.6778e-04 -5.3073e-04 9.5416e-05 3.1229e-05 -6.0000e+00 1.7108e-03 1.0953e-02 -6.8029e-05 12 9 9 12 1 1 99.06 23.05 0.62 0.01095 0.00697 9 2 1 5 0 3917.470 25.90 20.00 23.05 15.45 5.6 929.71 -43482 -7268 5045 4759 -15298 -19264 15529 3876 -10211 -3511 -9630 2941 -1243 23274 732 -5765 -5855 -2631 684 -324 5623 4012 -176 -2064 -2994 -2537 -2427 -5236 -1058 12782 1443 -2272 1002 -2151 -2689 -3487 -5668 -766 -480 2324 -1285 1584 2020 -105 128 285 1299 -1375 -319 1524 574 1543 1933 3012 1547 2235 108 -1128 -1172 -322 1361 2750 2905 457 1808 -468 -326 -210 1858 885 507 2120 374 -579 -447 -1411 -2095 -1127 -2435 -2831 -1799 -2340 -1656 -1584 -1422 -567 -32 891 1117 1284 296 -487 -573 -691 -771 278 343 363 874 -367 -1151 -1547 -1212 -1267 -1646 -1172 -690 482 947 907 1709 752 270 -294 -372 1160 195 35 647 300 224 309 949 325 727 -282 153 -392 764 -213 -263 -720 -468 6 2 -471 324 736 -243 250 -352 -551 -491 -3569 -464 297 272 -987 -1242 737 228 -766 -262 -788 224 -112 1917 88 -830 -910 -419 111 -55 920 671 -31 -397 -614 -538 -516 -1102 -205 2162 293 -525 244 -560 -686 -892 -1603 -217 -161 884 -561 713 938 -51 62 138 618 -666 -153 733 295 845 1031 1682 912 1343 68 -710 -728 -198 851 1822 2091 358 1410 -355 -236 -150 1391 687 430 1848 331 -496 -355 -1111 -1530 -793 -1837 -2222 -1574 -2278 -1599 -1619 -1549 -652 -39 1090 1361 1501 325 -497 -591 -707 -779 309 425 461 1164 -488 -1454 -1950 -1455 -1558 -2021 -1515 -933 679 1325 1358 2674 1204 421 -434 -546 1598 271 51 931 454 343 467 1384 488 1035 -388 203 -536 1102 -312 -407 -1164 -778 10 4 -849 596 1372 -430 453 -617 -936 -823 SS 20241208T151057.5Z 9108.632610 134 1 51.62 2 66.97 153.17 117.52 75.67 0.00 1 0.00 1 0 17 2.101e-02 7.530e-03 1.937e-03 5.156e-04 3.301198e-01 2.646147e-04 3.891360e-03 -6.000000e+00 1.235244e-02 223.19 -2.00 3.48 -2.00 317.55 0.00e+00 1.201055e-03 4.171727e-05 3.320517e-04 -6.000000e+00 5.495074e-04 279.16 -2.00 20.00 -2.00 316.88 0.00e+00 2.537 0.000 302.00 328.00 3 2.2095e+00 6.9493e-04 3.0041e-02 -6.0000e+00 3.0366e-02 7.7243e-03 7.8522e-04 1.6332e-02 -6.0000e+00 3.3085e-02 -1.3133e-03 4.8175e-04 8.1588e-03 -6.0000e+00 1.9755e-02 -4.6823e-03 2.3942e-04 2.4590e-03 -6.0000e+00 8.2577e-03 3.1150e-03 2.8879e-05 1.6140e-05 2.9849e-05 -6.0000e+00 6.4953e-04 8.5295e-03 1.9506e-05 11 9 0 11 8 0 99.61 23.05 0.42 0.00853 0.00875 306 50 1 5 0 168.670 25.90 20.00 23.05 15.58 5.6 930.86 -7115 -4012 -3054 -5444 -7830 -8528 -5514 -5910 -4654 -6363 -7208 -5813 -3790 -2581 -1008 -161 -194 1400 1151 1191 1234 1625 1645 1087 525 410 -783 -1475 -1083 -417 280 774 318 -1842 -3392 -3230 -2919 -1420 -103 -209 -418 -79 167 270 326 663 414 16 -23 504 754 1144 1286 1469 986 1155 735 238 41 447 1175 1849 2250 1859 896 -15 -288 7 672 1108 787 795 573 220 -294 -1062 -1691 -1846 -1977 -1640 -1784 -1996 -1933 -1770 -838 -413 321 680 531 541 346 -181 -479 -293 -324 67 462 542 107 -320 -997 -1446 -849 -616 -922 -938 -541 -197 458 879 867 548 318 22 -109 -25 147 328 367 310 382 577 581 649 625 160 152 306 258 175 -151 -390 -188 18 39 83 348 237 67 55 -432 -820 -835 -586 -358 -282 -498 -677 -713 -465 -553 -476 -704 -828 -694 -501 -394 -160 -28 -37 277 240 258 273 361 375 262 134 109 -212 -387 -271 -104 74 223 100 -564 -1121 -1060 -946 -524 -45 -97 -216 -40 88 144 175 355 221 9 -12 271 428 695 833 938 658 789 513 166 28 307 829 1393 1722 1520 745 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