File name: Pandora64s1_NewHavenCT_20230310_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240224T103532.7Z 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_20230310_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: 20230310 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 20230310T115439.1Z 8469.496286 249 1 49.03 2 82.90 101.85 82.79 251.47 0.00 1 0.00 1 0 17 4.950e-01 2.884e-02 2.386e-01 1.168e-02 1.044784e+00 6.961021e-03 1.154750e-02 -6.000000e+00 2.968769e-01 225.91 -2.00 3.52 -2.00 322.12 0.00e+00 1.084483e-03 3.540029e-03 2.198729e-03 -6.000000e+00 1.285810e-02 276.48 -2.00 20.00 -2.00 321.68 0.00e+00 7.446 0.008 302.00 328.00 3 1.4327e+00 2.4963e-02 9.4052e-02 -6.0000e+00 7.3571e-01 1.4834e+00 3.1035e-02 5.8471e-02 -6.0000e+00 7.9760e-01 -1.8559e+00 2.4576e-02 3.0589e-02 -6.0000e+00 4.7402e-01 7.3139e-01 1.2119e-02 9.5093e-03 -6.0000e+00 2.0093e-01 2.2494e-05 -2.6183e-03 3.0983e-04 1.5111e-04 -6.0000e+00 1.4708e-02 3.7552e-04 -9.1220e-05 12 8 8 10 0 0 95.89 21.42 0.19 0.00038 -0.01930 28 7 1 5 0 1750.600 25.90 20.00 21.42 6.70 35.5 944.84 -64262 9222 -41932 2576 88685 -50014 -55757 -128017 -22987 -44703 -94001 -60360 -87482 -71216 41299 1030 68540 -11966 16939 53022 34199 37505 397347 28795 43883 35692 1056 -32220 77373 -50763 50486 60682 65779 36356 14579 -36447 10733 5610 78679 26656 132383 47741 69418 41075 13562 21309 87887 7434 19150 76313 59035 12259 42907 28429 40951 27792 19869 963 37644 18092 8699 13854 39812 17301 55734 13259 7903 40739 29242 16136 16282 27106 12136 4236 -5233 -3508 27899 -1635 -7246 8776 -7344 -2832 211 1684 -3159 2909 6281 1155 -2764 4325 -5607 1087 -15389 -3843 -4251 30 -5912 -894 -1793 -520 -2168 -4077 -7679 -2227 -4124 -1842 -3901 5765 -3265 -2412 -224 -185 -719 -322 -120 -2076 882 723 1806 1613 340 4424 2852 -916 6095 394 -496 2303 2217 246 -41 -1318 -268 -652 886 395 323 142 1304 -676 -635 -3311 -3316 243 -1630 57 1010 -1460 -1707 -7720 -524 -1273 -4484 -2407 -5334 -4486 1059 44 1562 -630 651 1359 974 961 4526 841 1166 1003 37 -1445 1234 -3108 1457 1797 2048 1398 633 -2621 520 328 2749 1651 3217 2583 3015 2281 966 1396 3204 598 1459 3825 3699 1344 3727 3056 3994 3146 2405 125 3350 1881 1022 1716 4337 2504 6071 2088 1387 5859 5016 3525 3720 5540 2692 917 -1098 -656 4072 -332 -1864 2323 -2528 -1072 84 697 -1453 1307 2802 542 -1316 1812 -2445 437 -7577 -1907 -2521 20 -4718 -779 -1678 -470 -1838 -3287 -5904 -1661 -3328 -1519 -3382 5036 -3605 -3075 -317 -266 -1068 -472 -172 -3002 1279 1093 2807 2489 504 6252 3964 -1278 7761 524 -674 3456 3746 488 -88 -3087 -670 -1764 2521 1107 909 400 3689 -1807 -1565 -7787 SS 20230310T121547.1Z 8469.510962 257 1 16.77 2 79.04 105.48 86.54 254.92 0.00 1 0.00 1 0 25 4.522e-01 2.566e-02 2.673e-01 1.197e-02 7.557811e-01 6.705875e-03 8.861783e-03 -6.000000e+00 2.711044e-01 225.91 -2.00 3.52 -2.00 321.12 0.00e+00 1.008358e-02 2.862373e-03 2.086877e-03 -6.000000e+00 1.174742e-02 276.48 -2.00 20.00 -2.00 320.64 0.00e+00 5.071 0.002 302.00 328.00 3 3.3822e+00 2.1134e-02 6.4467e-02 -6.0000e+00 6.7183e-01 5.3688e-01 2.6607e-02 4.0072e-02 -6.0000e+00 7.2845e-01 -6.7567e-01 2.4081e-02 2.2850e-02 -6.0000e+00 4.3292e-01 2.8108e-01 1.1838e-02 1.0618e-02 -6.0000e+00 1.8344e-01 4.5125e-05 -3.2153e-03 3.3639e-04 1.6143e-04 -6.0000e+00 1.3435e-02 -3.2624e-04 -2.2098e-04 12 9 9 12 9 1 57.93 21.42 -0.07 -0.00033 -0.02449 4 4 1 5 0 3318.010 25.90 20.00 21.42 7.05 35.4 946.35 -63744 -18265 -99328 -111620 -191610 -119935 -100057 -144457 -93987 -87534 -98140 207465 -67640 -42395 -15532 -70326 -52792 -25985 -84806 -21904 70665 121228 31785 112504 -28142 9162 -91907 52144 10204 -54033 27080 -5236 -9116 36263 25651 77123 -4975 20552 8331 75548 24438 21809 20848 19623 13669 37937 24328 28925 7817 -7348 42635 17954 32704 24083 20464 4620 19317 3937 14668 -1344 4473 15807 12705 18287 21830 3150 11128 6171 2204 215 11504 855 2186 1204 6321 -8109 6324 -9029 -4101 -5063 -2153 -6099 -1698 -3765 -6749 -1930 2465 -1337 3499 2299 -1618 1971 -6627 -4656 -2243 -1300 -1211 147 171 1049 -884 -2406 -6037 -449 -1559 -703 -1916 2214 -1725 -1 745 -620 436 348 -1648 265 477 1254 1521 1395 -401 1460 2114 372 2235 2012 -2470 1171 1689 1095 -15 213 -1257 195 375 290 -835 967 29 -903 -750 -1385 -1006 -213 -2382 -2749 -8943 -2799 -2060 -4588 -2000 -1802 -2358 2421 -1798 -1127 -416 -3412 -2498 -1027 -5937 -880 1237 1415 764 1400 -1204 289 -7055 1103 322 -3351 965 -299 -582 1575 1164 2276 -330 1292 660 3673 2026 1955 1972 1904 1435 3215 2435 2913 1027 -1158 4791 2834 4800 3920 3546 957 3460 799 2593 -280 932 3292 3091 4684 5540 948 3181 1944 811 86 4366 365 880 476 2143 -2895 1926 -3419 -1645 -2433 -1159 -3870 -1109 -2530 -4989 -1426 1808 -1029 2526 1594 -1144 1291 -4506 -3368 -1826 -1221 -1252 170 208 1230 -982 -2436 -5938 -452 -1617 -753 -2235 2687 -2333 -1 1165 -1022 709 549 -2539 410 725 1971 2501 2316 -657 2243 3260 559 3204 2815 -3588 1800 2829 1981 -31 436 -2760 449 885 706 -2072 2377 70 -2081 -1683 -2952 SS 20230310T122052.8Z 8469.514500 260 1 49.12 2 78.12 106.37 87.45 255.74 0.00 1 0.00 1 0 25 4.696e-01 1.473e-02 1.113e-01 4.037e-03 7.165321e-01 2.248198e-03 8.364625e-03 -6.000000e+00 2.815741e-01 225.91 -2.00 3.52 -2.00 320.90 0.00e+00 4.798938e-03 9.501971e-04 2.402195e-03 -6.000000e+00 1.220140e-02 276.48 -2.00 20.00 -2.00 320.42 0.00e+00 4.708 0.002 302.00 328.00 3 3.0998e+00 7.0043e-03 6.0857e-02 -6.0000e+00 6.9778e-01 2.3488e-01 9.1256e-03 3.9433e-02 -6.0000e+00 7.5659e-01 -2.6945e-01 8.9773e-03 2.1932e-02 -6.0000e+00 4.4964e-01 1.0830e-01 4.4009e-03 7.7556e-03 -6.0000e+00 1.9052e-01 9.4060e-05 -1.9519e-03 1.1531e-04 1.1613e-04 -6.0000e+00 1.3955e-02 7.1298e-04 -1.9414e-04 12 8 8 10 0 0 99.86 21.42 0.05 0.00071 -0.01395 32 8 1 5 0 1534.760 25.90 19.98 21.42 7.16 35.5 946.76 -167625 -170256 -139096 -140842 -156935 -149417 -162336 -194850 -11000 -99368 -155816 -125503 -86050 -97818 -60478 -51027 -58309 -13102 -35535 -29183 -40197 34399 -576 1247 -43628 -15455 -48239 -7846 -18530 -24106 -24831 13787 926 2040 -5649 6049 -5948 1945 5473 19912 8576 11954 10411 10892 4639 8176 11507 5934 2978 -9204 13970 1859 8357 8656 5805 6792 4101 5080 5564 2015 3051 5002 6890 7472 7626 -476 3254 3435 3128 1518 3176 2402 2403 907 -1438 -4627 3260 -3798 -1950 -500 -773 -2632 -1130 -2980 -2114 -771 210 -695 1205 -73 -363 -202 -2399 -2177 -584 119 -714 664 742 -431 -724 -1880 -3325 -213 -363 -2098 -1456 576 -661 467 1268 289 93 -23 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