File name: Pandora64s1_NewHavenCT_20240908_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240909T045757.1Z 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_20240908_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: 20240908 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 20240908T111538.6Z 9017.469197 62 1 47.90 2 81.47 90.29 138.33 71.96 0.00 1 0.00 1 0 25 3.583e-01 3.100e-02 1.287e-01 5.131e-03 7.637372e-01 2.956146e-03 1.110602e-02 -6.000000e+00 2.180459e-01 229.76 -2.00 3.52 -2.00 321.48 0.00e+00 2.882097e-02 1.529832e-03 8.830778e-03 -6.000000e+00 9.770889e-03 288.15 -2.00 20.00 -2.00 320.92 0.00e+00 6.343 0.005 302.00 328.00 3 1.5942e+00 1.0629e-02 7.9577e-02 -6.0000e+00 5.4311e-01 7.8874e-01 1.3218e-02 4.4490e-02 -6.0000e+00 5.8599e-01 -1.0196e+00 1.0389e-02 3.1093e-02 -6.0000e+00 3.4965e-01 4.2801e-01 5.0624e-03 1.9715e-02 -6.0000e+00 1.4864e-01 7.5042e-05 -2.7004e-03 1.4428e-04 4.6369e-04 -6.0000e+00 1.0662e-02 2.2835e-03 -7.1465e-05 12 9 8 11 8 0 99.54 21.37 0.10 0.00228 -0.01801 44 11 1 5 0 1088.460 25.90 20.00 21.37 18.80 39.5 988.99 -26683 -32585 -7934 4743 -220759 -40124 -71173 -35156 -28212 -54482 -114656 -10574 -57256 4146 35459 38412 37371 63531 48896 86879 28163 128337 102455 58612 9086 10971 -18745 37652 10178 -22261 15094 57538 38043 50038 39337 41759 47533 32307 31464 42015 31613 49604 33691 14216 39788 43846 43700 39985 44625 13890 41854 33489 46287 27625 28833 18529 21103 6094 18304 13059 15714 18170 24187 21977 29854 11785 15922 14463 10074 10661 7169 5360 3043 793 -129 -2860 4957 -567 -1921 909 184 -2045 -3490 -4816 -1998 -3218 -1079 -2355 157 28 -3472 -2187 -6591 -5799 -4654 -2508 -3158 -594 716 -883 -198 -2408 -5320 -1959 -2674 -4230 -3298 -831 -1761 -840 262 -644 -703 -159 -362 -896 283 1210 1096 2646 1925 2278 2811 3074 3254 2421 -973 1939 1710 1350 1178 566 -548 79 155 -330 -983 -366 609 -511 -837 -2447 -534 -764 -149 70 -22321 -703 -1536 -495 -376 -852 -3334 -145 -1629 87 699 877 958 1371 1254 1623 837 1370 1333 1095 244 281 -639 791 290 -1065 632 1853 1689 1971 1587 1645 1888 1657 1830 2417 2009 2947 2350 1251 2834 3148 3292 3318 3730 1700 4286 4041 5217 3935 4047 2699 3111 952 2629 2033 2442 3136 4497 4679 6049 2817 3739 3586 2912 3420 2367 1811 999 259 -38 -800 1276 -167 -681 355 84 -1076 -1996 -2941 -1202 -2054 -701 -1569 101 18 -2174 -1298 -4087 -3702 -3422 -2129 -2992 -626 788 -964 -199 -2338 -4981 -1837 -2695 -4320 -3611 -971 -2334 -1190 405 -1045 -1139 -249 -546 -1342 434 1931 1765 4434 3152 3557 4239 4441 4560 3339 -1386 2961 2872 2549 2345 1207 -1254 185 385 -846 -2563 -957 1545 -1234 -1908 -5579 SS 20240908T113459.7Z 9017.482636 73 1 27.42 2 77.84 93.51 135.01 76.13 0.00 1 0.00 1 0 25 2.536e-01 8.150e-03 2.864e-02 1.066e-03 6.028813e-01 5.908593e-04 7.013961e-03 -6.000000e+00 1.543323e-01 229.76 -2.00 3.52 -2.00 320.31 0.00e+00 1.678820e-03 2.255294e-04 1.103827e-03 -6.000000e+00 6.915368e-03 288.15 -2.00 20.00 -2.00 319.62 0.00e+00 4.604 0.002 302.00 328.00 3 4.1226e-01 1.7968e-03 5.6156e-02 -6.0000e+00 3.8441e-01 3.2401e-02 2.2568e-03 3.2419e-02 -6.0000e+00 4.1475e-01 -2.1958e-02 2.0155e-03 1.6414e-02 -6.0000e+00 2.4747e-01 -8.0114e-04 1.0141e-03 4.9420e-03 -6.0000e+00 1.0522e-01 1.8309e-03 -5.9426e-04 3.1516e-05 6.4944e-05 -6.0000e+00 7.5463e-03 1.7406e-03 -7.4428e-05 12 9 1 12 1 1 98.98 21.37 0.18 0.00174 -0.00272 244 104 1 5 0 111.910 25.90 19.99 21.37 19.05 39.6 990.12 -92563 -91075 -76268 -91655 -124549 -93712 -81529 -73864 -62732 -60308 -63051 -46235 -44342 -28383 -21513 -15710 -14143 -11421 -16182 -6919 -14267 -5950 -14449 -8217 -11367 -4889 -13673 -9462 -13279 -10128 -6679 -2858 140 -244 -8700 -2633 -2858 519 420 3107 827 2188 2039 1018 1650 2203 913 1863 86 474 2294 -3228 2342 2543 1240 1953 1682 1042 562 526 728 2219 2554 3462 1348 -900 95 -1386 1189 1757 845 737 96 145 -378 -1769 -1023 -2863 -904 -681 -1230 -616 -1781 -2091 -394 -322 557 538 1404 621 390 175 -663 -211 685 35 -144 1265 744 -380 -523 -1916 -2103 274 276 -1518 -464 -866 -84 495 947 286 219 41 -239 -365 340 -31 780 364 -245 -341 677 185 950 419 -1390 526 891 286 244 -692 -835 -478 428 -111 -461 564 441 -128 144 -558 -962 -1042 -793 -1048 -1904 -1111 -958 -922 -789 -803 -931 -697 -830 -567 -492 -394 -387 -337 -486 -222 -456 -197 -516 -301 -460 -195 -597 -387 -581 -484 -367 -173 9 -17 -628 -192 -241 51 50 386 115 321 314 161 265 361 155 327 16 97 515 -844 631 739 352 574 506 312 166 158 232 777 997 1463 584 -389 42 -646 613 940 486 433 55 78 -201 -872 -489 -1465 -485 -425 -882 -460 -1440 -1805 -360 -291 519 506 1291 581 342 147 -553 -187 641 37 -166 1599 978 -488 -626 -2121 -2385 302 324 -1893 -613 -1163 -124 754 1543 478 360 64 -358 -536 512 -49 1289 612 -406 -546 1046 275 1431 614 -2057 787 1483 499 459 -1312 -1671 -968 915 -235 -999 1224 939 -274 292 -1143 SS 20240908T114032.5Z 9017.486487 76 1 48.34 2 76.80 94.45 134.05 77.26 0.00 1 0.00 1 0 25 1.627e-01 7.492e-03 1.476e-02 5.970e-04 5.653711e-01 3.279153e-04 6.565208e-03 -6.000000e+00 9.904269e-02 229.76 -2.00 3.52 -2.00 320.05 0.00e+00 1.204824e-03 1.147099e-04 7.905946e-04 -6.000000e+00 4.437896e-03 288.15 -2.00 20.00 -2.00 319.34 0.00e+00 4.267 0.001 302.00 328.00 3 2.0839e-01 9.7929e-04 5.2180e-02 -6.0000e+00 2.4670e-01 1.9613e-02 1.2038e-03 3.0179e-02 -6.0000e+00 2.6617e-01 -4.4427e-03 1.0309e-03 1.5136e-02 -6.0000e+00 1.5882e-01 -8.3886e-03 5.2553e-04 4.4639e-03 -6.0000e+00 6.7522e-02 3.2205e-03 -5.2013e-04 1.7929e-05 5.4590e-05 -6.0000e+00 4.8429e-03 2.0567e-03 -6.2553e-05 11 8 0 10 0 0 -1.24 21.38 0.16 0.00206 -0.00185 704 169 1 5 0 68.660 25.90 20.00 21.38 19.43 39.5 992.71 -62286 -48199 -57801 -53748 -93333 -47355 -59599 -35605 -43921 -30727 -45220 -25794 -27350 -12453 -15706 -5114 -12200 -3277 -8797 -1577 -6928 -2197 -7044 -1685 -7618 -1797 -7101 -6906 -8913 -5328 -1922 -436 -63 -949 -6810 -4186 -3085 -653 240 816 356 -101 1197 -331 659 772 579 697 -169 -189 1900 -1913 1560 1422 871 1146 1596 523 477 196 1026 1868 2229 2691 1196 -1196 -94 -1502 999 1718 780 814 111 258 -331 -1677 -1227 -2539 -566 -522 -1061 -684 -1790 -1969 -442 -391 384 464 1237 712 521 297 -749 -45 550 203 -99 1251 773 -263 -549 -1978 -2093 202 263 -1349 -374 -741 -94 466 882 357 217 86 -302 -258 311 -162 686 368 -294 -327 625 54 868 558 -1323 419 823 255 349 -683 -810 -470 469 -150 -402 603 434 -171 200 -670 -703 -525 -727 -610 -1510 -510 -812 -437 -660 -436 -795 -446 -600 -291 -420 -142 -399 -108 -327 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