File name: Pandora32s1_GreenbeltMD_20231218_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240223T220021.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c12p1-8 Local principal investigator: Thomas Hanisco Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 32 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora32_OF_v1d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20231218_L1_smca1c12d20221109p1-8.txt Full location name: Goddard Space Flight Center Short location name: GreenbeltMD Country of location: USA Location latitude [deg]: 38.9926 Location longitude [deg]: -76.8396 Location altitude [m]: 90 Local noon date: 20231218 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: Based on session 11 with new SO2 and HCHO field cal First and last pixel inside fitting window: 259 401 Nominal wavelengths inside fitting window [nm]: 305.0059 305.1469 305.2878 305.4288 305.5697 305.7106 305.8515 305.9924 306.1333 306.2742 306.4150 306.5559 306.6967 306.8375 306.9783 307.1191 307.2599 307.4007 307.5415 307.6822 307.8230 307.9637 308.1044 308.2451 308.3858 308.5265 308.6672 308.8079 308.9485 309.0892 309.2298 309.3704 309.5110 309.6516 309.7922 309.9328 310.0733 310.2139 310.3544 310.4950 310.6355 310.7760 310.9165 311.0570 311.1974 311.3379 311.4784 311.6188 311.7592 311.8996 312.0400 312.1804 312.3208 312.4612 312.6015 312.7419 312.8822 313.0226 313.1629 313.3032 313.4435 313.5837 313.7240 313.8643 314.0045 314.1447 314.2849 314.4252 314.5654 314.7055 314.8457 314.9859 315.1260 315.2662 315.4063 315.5464 315.6865 315.8266 315.9667 316.1068 316.2468 316.3869 316.5269 316.6669 316.8070 316.9470 317.0869 317.2269 317.3669 317.5069 317.6468 317.7867 317.9266 318.0666 318.2065 318.3463 318.4862 318.6261 318.7659 318.9058 319.0456 319.1854 319.3252 319.4650 319.6048 319.7446 319.8843 320.0241 320.1638 320.3035 320.4432 320.5829 320.7226 320.8623 321.0020 321.1416 321.2813 321.4209 321.5605 321.7001 321.8397 321.9793 322.1189 322.2584 322.3980 322.5375 322.6770 322.8165 322.9560 323.0955 323.2350 323.3745 323.5139 323.6534 323.7928 323.9322 324.0716 324.2110 324.3504 324.4898 324.6291 324.7685 324.9078 --------------------------------------------------------------------------------------- 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 20231218T143604.5Z 8752.608385 109 1 48.61 2 71.32 144.38 116.63 82.54 0.00 1 0.00 1 0 17 4.180e-02 5.498e-03 3.559e-03 4.319e-04 4.276918e-01 2.154279e-04 5.033174e-03 -6.000000e+00 2.349279e-02 223.18 -2.00 3.47 -2.00 318.64 0.00e+00 1.170089e-03 4.584564e-05 2.919572e-04 -6.000000e+00 1.031854e-03 278.13 -2.00 20.00 -2.00 318.03 0.00e+00 3.084 0.000 302.00 328.00 3 8.4233e-01 5.8075e-04 3.7172e-02 -6.0000e+00 5.7875e-02 3.1009e-02 6.6547e-04 2.1400e-02 -6.0000e+00 6.2985e-02 -1.9574e-02 4.7780e-04 1.0796e-02 -6.0000e+00 3.7560e-02 1.6195e-03 2.5533e-04 3.3179e-03 -6.0000e+00 1.6138e-02 6.3841e-03 -3.3527e-04 1.2005e-05 3.4848e-05 -6.0000e+00 1.1114e-03 -1.8578e-03 -1.7855e-05 10 0 0 10 0 0 99.72 21.30 0.30 -0.00186 -0.00438 687 161 1 5 0 70.750 25.90 20.00 21.30 14.55 3.7 938.26 -16617 -10886 -9512 -11512 -14400 -20094 -15959 -14031 -10314 -9612 -11852 -11378 -9102 -5746 -3070 -1120 -375 -444 872 112 684 -156 106 453 -703 -813 -1932 -2610 -2389 -2017 -157 322 1399 -535 -2598 -3022 -2976 -1119 -439 -128 -645 -259 -155 -131 449 369 75 76 -178 -150 899 1307 1023 1336 1028 1016 1083 227 380 171 933 1643 2062 2172 963 353 -42 -369 410 809 517 312 104 75 -38 -275 -794 -1415 -1414 -1013 -1228 -1276 -1733 -1769 -926 -722 -4 247 388 653 445 556 -254 38 216 78 301 543 373 -134 -268 -913 -802 -35 -690 -1068 -588 -413 -57 448 444 400 336 314 70 200 183 237 7 61 -196 263 328 276 349 211 -97 619 307 76 57 -230 -295 -1 37 -81 -27 231 86 -114 36 -324 -503 -544 -397 -370 -455 -535 -733 -574 -557 -452 -457 -594 -588 -526 -390 -246 -103 -38 -48 100 13 85 -20 14 56 -95 -117 -288 -381 -330 -275 -23 53 257 -109 -529 -588 -606 -258 -113 -40 -228 -98 -61 -53 182 151 31 31 -74 -59 374 594 506 706 536 548 602 128 210 93 507 947 1313 1431 677 243 -29 -249 270 604 408 262 89 62 -29 -204 -533 -968 -1005 -765 -1010 -1187 -1675 -1810 -945 -787 -5 280 443 725 490 563 -253 37 219 84 348 672 507 -178 -356 -1166 -936 -40 -852 -1350 -775 -572 -80 650 699 633 530 494 103 286 257 343 11 96 -316 415 500 407 514 298 -137 859 439 115 93 -380 -502 -1 67 -148 -51 446 167 -219 67 -587 -879 SS 20231218T144134.6Z 8752.612206 112 1 45.60 2 70.71 145.54 115.60 83.42 0.00 1 0.00 1 0 17 4.837e-02 6.146e-03 3.479e-02 3.336e-03 4.150786e-01 1.671081e-03 4.809819e-03 -6.000000e+00 2.722976e-02 223.18 -2.00 3.47 -2.00 319.17 0.00e+00 1.141716e-03 4.177140e-04 4.367963e-04 -6.000000e+00 1.196701e-03 278.13 -2.00 20.00 -2.00 318.57 0.00e+00 2.992 0.000 302.00 328.00 3 4.5075e+00 4.6052e-03 3.6041e-02 -6.0000e+00 6.7088e-02 3.3212e-02 5.3643e-03 2.0736e-02 -6.0000e+00 7.3015e-02 7.4281e-03 4.1469e-03 1.0679e-02 -6.0000e+00 4.3512e-02 -1.1822e-02 2.2090e-03 3.5496e-03 -6.0000e+00 1.8844e-02 1.8056e-04 1.2109e-03 9.5364e-05 3.6183e-05 -6.0000e+00 1.2965e-03 -4.4757e-03 2.6375e-04 12 1 1 12 1 1 100.00 21.31 0.38 -0.00448 0.00462 42 11 1 5 0 1060.270 25.90 20.01 21.31 14.77 3.7 939.90 900000 -23938 -817 -23895 -14723 -26682 -8782 11609 -6156 3192 -16683 -9292 1217 148 328 267 -5548 -1281 7111 10286 -5564 -1671 724 845 -2528 789 2695 -5716 2310 -993 -134 -1900 3690 588 -4653 -1463 -5737 -1383 -2836 -175 -759 -1808 -3565 1207 198 1529 246 3881 -1492 -1952 -950 1988 2203 1757 433 1029 1020 384 486 -83 750 1246 726 2112 199 -314 486 -42 1445 1244 -186 5 538 740 -478 -334 -1532 323 -1642 -940 -1062 -1300 -1912 -1749 -795 -313 226 778 112 871 502 660 297 -285 69 -649 -86 758 619 -32 -91 -953 -1352 -84 -531 -1048 -372 -531 158 580 346 478 159 128 147 204 -14 -55 416 60 61 -18 221 -78 29 787 -736 801 -31 128 64 -548 -561 67 576 -248 -87 -142 311 113 135 -212 -372 900000 -762 -23 -820 -430 -810 -233 284 -202 105 -676 -363 49 7 19 18 -429 -102 557 820 -533 -155 67 82 -273 88 302 -676 242 -106 -15 -247 512 91 -742 -216 -920 -244 -606 -43 -212 -548 -1144 380 63 488 80 1219 -495 -663 -338 748 890 758 198 483 492 187 233 -40 358 626 401 1254 126 -195 283 -24 850 816 -136 4 416 556 -343 -221 -937 186 -990 -629 -801 -1086 -1731 -1654 -783 -324 244 865 126 959 527 650 275 -258 65 -673 -98 936 821 -43 -119 -1167 -1553 -95 -636 -1329 -486 -722 223 867 549 786 261 204 222 293 -19 -80 628 96 98 -29 345 -119 43 1120 -1022 1093 -45 199 106 -935 -977 120 1070 -482 -173 -286 627 224 261 -398 -680 SS 20231218T145025.6Z 8752.618352 118 1 12.76 2 69.76 147.45 113.93 84.80 0.00 1 0.00 1 0 17 3.552e-02 6.796e-03 2.897e-02 4.073e-03 3.980418e-01 2.031155e-03 4.649616e-03 -6.000000e+00 1.998322e-02 223.18 -2.00 3.47 -2.00 318.45 0.00e+00 1.077142e-03 4.114836e-04 2.079442e-04 -6.000000e+00 8.787193e-04 278.12 -2.00 20.00 -2.00 317.84 0.00e+00 2.861 0.000 302.00 328.00 3 3.9987e+00 5.4503e-03 3.4462e-02 -6.0000e+00 4.9232e-02 3.8464e-02 6.2307e-03 1.9819e-02 -6.0000e+00 5.3593e-02 -4.8522e-03 4.3841e-03 1.0006e-02 -6.0000e+00 3.1938e-02 -6.2423e-03 2.3378e-03 3.1589e-03 -6.0000e+00 1.3824e-02 3.4841e-04 4.0685e-04 1.1410e-04 3.1858e-05 -6.0000e+00 9.5223e-04 -2.7662e-03 1.7897e-04 12 9 1 12 1 1 61.73 21.32 0.39 -0.00277 0.00029 5 5 1 5 0 2126.250 25.90 20.00 21.32 14.89 3.7 939.48 900000 -13746 -19788 -9527 4969 -9118 -111 4119 -10849 -9376 549 -12129 3192 2312 -2576 -40 -4368 4144 9576 11339 925 -3064 564 -3323 4075 -5442 822 -4820 -1536 -3984 -995 -379 5822 -350 -5767 -2719 -3564 -1872 -886 -571 -1097 -331 484 -17 814 2971 -577 -4 -106 -1168 1441 163 -469 897 -259 1416 524 273 -801 1754 1569 1240 1779 1335 1681 -451 -532 -432 509 2106 87 454 -487 87 1005 -1029 59 -1894 -989 -1430 -1700 -301 -2363 -1362 -1798 -568 143 370 382 611 915 896 -420 -114 185 -391 832 782 513 -199 -285 -635 -573 22 -608 -1105 -199 -333 21 479 237 179 129 323 24 180 138 231 482 -106 -430 311 405 349 327 -530 -65 233 -73 202 206 -390 -626 278 -84 62 -1 121 454 63 48 -435 -451 900000 -620 -1018 -444 186 -361 -4 165 -568 -528 29 -739 190 165 -228 -4 -498 464 1082 1319 123 -423 76 -490 602 -928 135 -816 -240 -629 -162 -69 1114 -76 -1293 -567 -778 -456 -253 -190 -409 -130 196 -7 339 1223 -245 -2 -45 -505 639 79 -242 482 -147 809 309 162 -473 999 905 753 1160 938 1223 -326 -365 -291 352 1574 72 389 -424 74 809 -784 41 -1294 -686 -1091 -1436 -274 -2318 -1376 -1898 -622 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