File name: Pandora64s1_NewHavenCT_20231229_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240113T081556.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 64 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora64_OF_v3d20190516.txt Instrument calibration file used: Pandora64s1_CF_v4d20190911.txt Level 1 file used: Pandora64s1_NewHavenCT_20231229_L1_smca1c4d20190911p1-8.txt Full location name: New Haven - Criscuolo Park CTDEEP (USEPA AQS ID 34-017-0006) Short location name: NewHavenCT Country of location: USA Location latitude [deg]: 41.3014 Location longitude [deg]: -72.9029 Location altitude [m]: 4 Local noon date: 20231229 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: Mod WL cal slit func 9 First and last pixel inside fitting window: 249 390 Nominal wavelengths inside fitting window [nm]: 305.1279 305.2688 305.4097 305.5506 305.6915 305.8324 305.9732 306.1141 306.2549 306.3958 306.5366 306.6774 306.8182 306.9590 307.0997 307.2405 307.3812 307.5220 307.6627 307.8034 307.9441 308.0848 308.2255 308.3662 308.5068 308.6475 308.7881 308.9287 309.0693 309.2099 309.3505 309.4911 309.6316 309.7722 309.9127 310.0533 310.1938 310.3343 310.4748 310.6153 310.7557 310.8962 311.0366 311.1771 311.3175 311.4579 311.5983 311.7387 311.8791 312.0195 312.1598 312.3002 312.4405 312.5808 312.7211 312.8614 313.0017 313.1420 313.2822 313.4225 313.5627 313.7030 313.8432 313.9834 314.1236 314.2638 314.4039 314.5441 314.6842 314.8244 314.9645 315.1046 315.2447 315.3848 315.5249 315.6649 315.8050 315.9450 316.0851 316.2251 316.3651 316.5051 316.6451 316.7850 316.9250 317.0649 317.2049 317.3448 317.4847 317.6246 317.7645 317.9044 318.0442 318.1841 318.3239 318.4638 318.6036 318.7434 318.8832 319.0230 319.1628 319.3025 319.4423 319.5820 319.7217 319.8614 320.0011 320.1408 320.2805 320.4202 320.5598 320.6995 320.8391 320.9787 321.1183 321.2579 321.3975 321.5371 321.6766 321.8162 321.9557 322.0953 322.2348 322.3743 322.5138 322.6532 322.7927 322.9322 323.0716 323.2110 323.3504 323.4899 323.6292 323.7686 323.9080 324.0474 324.1867 324.3260 324.4654 324.6047 324.7440 324.8833 --------------------------------------------------------------------------------------- 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 20231229T193842.3Z 8763.818545 535 1 36.94 2 74.99 218.87 116.92 6.28 0.00 1 0.00 1 0 25 2.466e-01 1.224e-02 5.013e-02 2.224e-03 5.959666e-01 1.194552e-03 7.039961e-03 -6.000000e+00 1.464902e-01 223.17 -2.00 3.52 -2.00 319.99 0.00e+00 3.844506e-03 3.963381e-04 9.880987e-04 -6.000000e+00 6.396207e-03 276.02 -2.00 20.00 -2.00 319.49 0.00e+00 3.787 0.001 302.00 328.00 3 2.9545e+00 3.4200e-03 4.8642e-02 -6.0000e+00 3.6087e-01 7.9594e-02 4.1633e-03 3.0829e-02 -6.0000e+00 3.9190e-01 -6.1830e-02 3.7848e-03 1.6722e-02 -6.0000e+00 2.3334e-01 2.1264e-02 1.9530e-03 6.3627e-03 -6.0000e+00 9.9497e-02 3.0498e-04 -1.1634e-03 6.4739e-05 7.7110e-05 -6.0000e+00 7.3246e-03 -3.1097e-03 -9.1225e-05 12 9 9 12 1 1 99.61 21.36 0.08 -0.00311 -0.01185 38 12 1 5 0 947.050 25.90 20.00 21.36 16.98 37.3 986.96 -98122 -58759 -68082 -24029 -206433 -62179 -69108 -52357 -49239 -30738 -55877 -21812 -37495 -18286 -7318 -10853 -8794 7551 -5217 5092 -5248 8808 6811 -1728 -2423 2353 -7101 -3011 -298 -11535 4188 3631 10975 4402 1049 -2521 -1295 -1400 2507 253 1988 634 2427 -1766 1289 1403 3800 1695 2734 -1453 4853 435 4716 2196 2712 669 1415 -173 1385 839 1798 2214 2874 3492 3717 150 1235 -444 981 1869 1168 349 -268 277 -825 -2191 -126 -3774 -1357 -361 -1435 -1868 -1724 -2286 -534 -713 -207 219 898 646 -298 124 -1307 -569 -105 -61 -255 1403 843 -279 -562 -1584 -2238 -118 184 -1395 -810 -491 -234 592 1008 481 554 160 -144 -562 419 -243 650 551 -191 7 630 584 1309 707 -1303 653 1212 276 385 -492 -903 -457 280 -281 -385 370 452 -396 94 -683 -1649 -743 -997 -232 -9885 -787 -1024 -738 -748 -455 -1040 -347 -888 -449 -198 -355 -312 251 -209 194 -225 331 279 -83 -124 120 -368 -159 -16 -706 261 260 831 364 86 -227 -131 -169 351 39 329 113 446 -344 249 278 751 356 596 -356 1247 128 1443 693 884 230 491 -60 464 286 645 879 1267 1675 1794 73 603 -229 528 1120 749 230 -172 165 -454 -1189 -65 -1982 -797 -245 -1055 -1548 -1524 -2034 -501 -705 -211 225 904 617 -268 112 -1172 -509 -106 -66 -299 1804 1132 -366 -688 -1872 -2538 -137 227 -1733 -1068 -658 -343 907 1654 774 913 253 -217 -866 624 -381 1061 915 -312 11 957 888 1911 1003 -1861 989 1946 469 703 -911 -1764 -902 584 -584 -811 783 938 -817 184 -1338 SS 20231229T194923.9Z 8763.825971 538 1 10.18 2 76.28 221.02 116.69 8.93 0.00 1 0.00 1 0 25 2.895e-01 9.436e-03 8.350e-02 2.809e-03 6.444952e-01 1.518128e-03 7.488440e-03 -6.000000e+00 1.719383e-01 223.17 -2.00 3.52 -2.00 320.25 0.00e+00 2.636519e-03 5.484368e-04 7.505625e-04 -6.000000e+00 7.507552e-03 276.02 -2.00 20.00 -2.00 319.75 0.00e+00 4.119 0.001 302.00 328.00 3 1.8007e+00 4.4509e-03 5.2800e-02 -6.0000e+00 4.2355e-01 6.2931e-02 5.5724e-03 3.3499e-02 -6.0000e+00 4.6000e-01 -4.9003e-02 5.3892e-03 1.7827e-02 -6.0000e+00 2.7388e-01 1.2254e-02 2.7425e-03 6.1377e-03 -6.0000e+00 1.1678e-01 6.7984e-04 -1.2449e-03 8.0546e-05 7.5056e-05 -6.0000e+00 8.5976e-03 -3.3154e-03 -1.2301e-04 12 9 9 12 1 1 -19.26 21.36 0.21 -0.00332 -0.01267 27 32 1 5 0 363.240 25.90 20.00 21.36 17.34 37.2 988.88 -102503 -109477 -79638 -67504 -201560 -85498 -57523 -113828 -32754 -61563 -44286 -66028 -27124 -33405 -20886 -25033 -16164 -15862 -8437 -8940 -2847 -7127 -3276 -8917 -3842 -11093 -13973 -4002 -677 -7212 -2952 4102 123 908 -6778 -2944 -1703 28 388 -2081 608 1184 2899 -2103 973 1360 3485 -1135 1154 -1701 4306 3289 3271 1915 2056 1404 485 -913 350 389 382 1853 2284 3048 2266 33 1033 -614 1316 1871 985 1767 -387 368 -578 -956 -283 -1630 -929 -358 -1141 -1397 -1369 -2197 -120 -808 -175 311 1041 287 466 -4 -482 -781 218 303 -526 1246 917 -435 -799 -1760 -1950 146 82 -1456 -599 -626 -328 580 743 431 183 390 -110 -471 443 -201 553 260 -252 -332 1038 345 1128 883 -1395 434 835 127 553 -684 -674 -388 494 -158 -753 493 486 -179 122 -719 -1095 -1410 -807 -573 -5672 -867 -488 -1933 -278 -759 -497 -1121 -401 -668 -458 -611 -403 -438 -231 -260 -79 -211 -101 -318 -139 -453 -592 -150 -25 -329 -155 232 8 62 -486 -216 -141 3 42 -270 85 175 441 -342 157 225 581 -208 218 -361 967 824 894 531 594 425 151 -284 105 118 123 657 906 1322 1006 15 465 -295 651 1037 586 1064 -230 203 -292 -478 -137 -846 -513 -230 -791 -1095 -1150 -1849 -106 -756 -170 302 989 260 420 -4 -414 -677 213 319 -634 1560 1198 -557 -955 -2036 -2148 165 99 -1751 -764 -859 -470 912 1198 714 300 610 -173 -727 694 -314 901 430 -407 -518 1632 522 1642 1247 -1995 663 1357 218 1024 -1286 -1337 -780 1046 -347 -1617 1057 1064 -373 252 -1428 SS 20231229T195539.0Z 8763.830313 542 1 48.48 2 77.06 222.26 116.52 10.47 0.00 1 0.00 1 0 25 3.888e-01 1.156e-02 5.514e-02 1.796e-03 6.742278e-01 9.767814e-04 7.799383e-03 -6.000000e+00 2.309025e-01 223.17 -2.00 3.52 -2.00 320.55 0.00e+00 4.372923e-03 3.853594e-04 7.415320e-04 -6.000000e+00 1.008266e-02 276.02 -2.00 20.00 -2.00 320.07 0.00e+00 4.350 0.001 302.00 328.00 3 2.0965e+00 2.9534e-03 5.5660e-02 -6.0000e+00 5.6881e-01 9.2183e-02 3.8000e-03 3.5385e-02 -6.0000e+00 6.1777e-01 -9.2393e-02 3.7881e-03 1.9437e-02 -6.0000e+00 3.6781e-01 3.3514e-02 1.8916e-03 7.8106e-03 -6.0000e+00 1.5680e-01 3.9073e-04 -1.3337e-03 5.1229e-05 9.1605e-05 -6.0000e+00 1.1547e-02 -1.8508e-03 -8.8204e-05 12 8 8 10 0 0 99.98 21.35 0.17 -0.00185 -0.01187 117 28 1 5 0 414.360 25.90 20.00 21.35 17.79 37.7 991.69 -141329 -115619 -91844 -148859 -250695 -102516 -96882 -149591 -77286 -69097 -89124 -71001 -57522 -64432 -21309 -25731 -17446 -9419 -15514 1955 -26119 -2460 833 -9511 -13142 -6256 -10841 -13995 -6797 -15730 -1468 4013 4543 4407 -5220 -4204 -2470 -888 3593 2942 3828 3503 3354 -183 4636 5052 3490 4259 2735 558 5720 2537 7153 4680 3123 2163 1716 353 799 1100 938 2182 3069 4172 3348 -326 1134 332 1360 2150 334 1227 -30 406 -692 -2694 -875 -2773 -1363 -150 -958 -1549 -1718 -1931 -940 -994 118 621 1345 700 193 -59 -1271 -670 233 -252 -373 876 860 -247 -275 -1657 -2608 -146 87 -1855 -538 -649 -303 446 1141 430 380 108 -370 -498 332 -242 616 402 -50 -119 860 494 1213 813 -1236 432 1056 421 449 -576 -647 -459 436 -195 -534 377 479 -193 116 -854 -1597 -1141 -760 -2061 -8376 -969 -950 -2548 -785 -702 -1092 -893 -824 -1272 -343 -512 -358 -199 -373 42 -748 -56 20 -272 -414 -193 -354 -466 -220 -638 -63 189 245 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