File name: Pandora166s1_PhiladelphiaPA_20221015_L2Fit_fout2c5d20220925p1-8.txt File generation date: 20251125T110145.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c5p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 166 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora166_OF_v3d20210217.txt Instrument calibration file used: Pandora166s1_CF_v5d20220925.txt Level 1 file used: Pandora166s1_PhiladelphiaPA_20221015_L1_smca1c5d20220925p1-8.txt Full location name: Philadelphia, Pennsylvania; Philadelphia-Camden-Wilmington; North East Waste (NE Short location name: PhiladelphiaPA Country of location: United States Location latitude [deg]: 39.9919 Location longitude [deg]: -75.0811 Location altitude [m]: 6 Local noon date: 20221015 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: HCHO modification of session 4 "Field cal based on session3" First and last pixel inside fitting window: 223 365 Nominal wavelengths inside fitting window [nm]: 305.0654 305.2061 305.3468 305.4875 305.6282 305.7689 305.9096 306.0503 306.1910 306.3316 306.4722 306.6129 306.7535 306.8941 307.0347 307.1753 307.3158 307.4564 307.5969 307.7375 307.8780 308.0185 308.1590 308.2995 308.4400 308.5805 308.7209 308.8614 309.0018 309.1422 309.2827 309.4231 309.5635 309.7038 309.8442 309.9846 310.1249 310.2652 310.4056 310.5459 310.6862 310.8265 310.9668 311.1070 311.2473 311.3875 311.5278 311.6680 311.8082 311.9484 312.0886 312.2288 312.3690 312.5091 312.6493 312.7894 312.9295 313.0696 313.2097 313.3498 313.4899 313.6300 313.7700 313.9101 314.0501 314.1901 314.3301 314.4701 314.6101 314.7501 314.8901 315.0300 315.1700 315.3099 315.4498 315.5897 315.7296 315.8695 316.0094 316.1493 316.2891 316.4290 316.5688 316.7086 316.8484 316.9882 317.1280 317.2678 317.4076 317.5473 317.6871 317.8268 317.9665 318.1062 318.2459 318.3856 318.5253 318.6650 318.8046 318.9443 319.0839 319.2235 319.3631 319.5027 319.6423 319.7819 319.9215 320.0610 320.2006 320.3401 320.4796 320.6191 320.7586 320.8981 321.0376 321.1770 321.3165 321.4559 321.5954 321.7348 321.8742 322.0136 322.1530 322.2923 322.4317 322.5711 322.7104 322.8497 322.9891 323.1284 323.2677 323.4069 323.5462 323.6855 323.8247 323.9640 324.1032 324.2424 324.3816 324.5208 324.6600 324.7992 324.9383 --------------------------------------------------------------------------------------- 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 20221015T121738.9Z 8323.512256 271 1 20.99 2 78.57 111.67 40.19 265.39 0.00 1 0.00 1 0 33 3.927e-01 1.397e-02 3.687e-01 1.123e-02 6.192925e-01 6.108725e-03 6.760458e-03 -6.000000e+00 2.277435e-01 226.11 -2.00 3.49 -2.00 321.14 0.00e+00 3.967114e-03 2.330020e-03 5.894805e-04 -6.000000e+00 1.036570e-02 285.02 -2.00 20.00 -2.00 320.81 0.00e+00 4.876 0.002 302.00 328.00 3 2.9911e+00 1.8274e-02 5.8317e-02 -6.0000e+00 5.6774e-01 3.8369e-02 2.5054e-02 3.2708e-02 -6.0000e+00 6.2120e-01 -4.7795e-02 2.9487e-02 1.8091e-02 -6.0000e+00 3.6182e-01 1.4351e-02 1.4779e-02 6.0060e-03 -6.0000e+00 1.5196e-01 1.0666e-04 -2.4200e-04 3.4546e-04 7.1472e-05 -6.0000e+00 1.1264e-02 3.8570e-03 8.8326e-05 12 9 9 12 9 1 90.71 19.94 0.40 0.00386 0.00204 7 4 1 5 0 2602.370 26.51 20.00 19.94 17.15 16.6 933.20 900000 -236912 -62771 -13307 900000 900000 115703 900000 -118748 -66074 900000 61909 900000 900000 24734 34760 98363 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-637 1112 1080 -1804 264 563 -1113 -1315 985 685 1543 -1887 436 -2067 -2942 -97 -329 -1205 -45 -967 678 1394 -786 371 742 459 143 2742 701 2479 64 -229 -306 -49 406 -2971 -2005 -356 -1542 -1605 1129 2812 -498 270 1997 -1945 34 -1120 1559 -1772 56 919 -317 860 761 1945 -804 -998 1571 545 -650 324 -2531 795 275 -176 -1595 -1368 -236 3899 -668 1689 -1809 -331 SS 20221015T122238.8Z 8323.515727 274 1 41.00 2 77.68 112.55 41.12 266.25 0.00 1 0.00 1 0 25 2.006e-01 5.655e-03 6.328e-02 1.997e-03 5.758589e-01 1.034557e-03 6.393427e-03 -6.000000e+00 1.143609e-01 226.10 -2.00 3.49 -2.00 320.78 0.00e+00 2.780289e-03 3.607760e-04 4.512460e-04 -6.000000e+00 4.634801e-03 285.02 -2.00 20.00 -2.00 320.45 0.00e+00 4.552 0.002 302.00 328.00 3 9.1143e-01 3.0193e-03 5.4220e-02 -6.0000e+00 2.8517e-01 4.9886e-02 3.8759e-03 2.9951e-02 -6.0000e+00 3.1117e-01 -4.6027e-02 4.2413e-03 1.6129e-02 -6.0000e+00 1.8317e-01 8.1375e-03 2.1859e-03 5.2048e-03 -6.0000e+00 7.6461e-02 1.2149e-03 -3.9128e-04 5.9039e-05 5.9156e-05 -6.0000e+00 5.5173e-03 3.2516e-03 1.5426e-05 12 1 1 12 9 1 18.71 19.93 0.23 0.00325 0.00031 135 33 1 5 0 300.150 26.51 20.00 19.93 17.42 16.7 935.79 -86931 -81246 -47354 -70271 -74769 -43685 -58900 -61621 -62963 -46248 -52763 -62507 -40049 -45863 -8823 -1271 -10926 -6451 -12998 4002 -22956 5695 -14805 -10784 -11164 -13782 3819 -10145 2614 -6037 -6183 -1767 180 152 -7943 2327 -7290 -290 -4803 -477 -2762 -1581 3317 523 2241 35 -57 1627 241 2894 1617 3295 1868 2571 1571 2204 -406 -418 -391 -2056 1564 1327 2975 2271 747 2146 -591 574 618 983 387 950 979 -2 347 -1156 -237 -1596 -503 -382 -713 -924 -2103 -1213 -1210 -181 -77 633 926 310 694 -142 -69 297 67 -39 321 1055 355 -75 -431 -647 -321 -63 -1304 -1568 -889 -1031 -111 262 371 254 70 121 -39 578 205 168 17 -275 -393 50 625 201 578 -231 300 1215 231 359 -124 -177 -370 3 -222 -450 119 388 84 -158 -23 -251 36 -893 -920 -411 -746 -768 -325 -553 -676 -791 -532 -682 -923 -591 -915 -152 -24 -257 -160 -373 103 -732 149 -459 -349 -391 -524 124 -369 83 -223 -269 -87 10 9 -493 130 -494 -20 -429 -49 -325 -197 415 69 296 5 -8 232 36 451 282 630 396 587 383 555 -101 -111 -101 -536 407 381 885 759 265 730 -202 198 234 426 186 475 486 -1 151 -459 -93 -635 -204 -182 -397 -585 -1473 -894 -953 -151 -67 567 827 268 559 -108 -49 217 54 -36 320 1187 437 -93 -502 -684 -332 -65 -1382 -1766 -1048 -1297 -150 392 573 412 114 189 -61 854 304 261 27 -448 -641 78 1005 313 861 -333 415 1719 368 600 -228 -344 -753 6 -479 -1027 277 919 200 -363 -50 -548 77 SS 20221015T122832.4Z 8323.519819 277 1 48.94 2 76.65 113.60 42.22 267.24 0.00 1 0.00 1 0 22 1.252e-01 5.286e-03 3.842e-02 1.234e-03 5.386420e-01 6.368547e-04 6.022026e-03 -6.000000e+00 7.139669e-02 226.10 -2.00 3.49 -2.00 320.57 0.00e+00 2.027826e-03 2.095184e-04 3.856465e-04 -6.000000e+00 2.893515e-03 285.02 -2.00 20.00 -2.00 320.24 0.00e+00 4.222 0.001 302.00 328.00 3 5.0035e-01 1.8309e-03 5.0377e-02 -6.0000e+00 1.7803e-01 2.7048e-02 2.2942e-03 2.7860e-02 -6.0000e+00 1.9426e-01 -1.4710e-02 2.4303e-03 1.4879e-02 -6.0000e+00 1.1435e-01 -5.0098e-03 1.2681e-03 4.7632e-03 -6.0000e+00 4.7737e-02 2.6164e-03 -3.1870e-04 3.6500e-05 5.3691e-05 -6.0000e+00 3.4444e-03 2.9743e-03 1.1232e-05 10 0 0 10 0 0 50.59 19.94 0.17 0.00297 0.00058 320 64 1 5 0 152.890 26.51 20.01 19.94 18.06 16.7 941.01 -31685 -29590 12820 -73410 -2323 -51488 -45706 -43342 -47870 -18444 -47629 -22096 -23172 -16138 -7288 -10241 3708 -9921 7571 -7926 5521 -8958 -2718 3858 -8485 1745 -13022 2149 -10464 1975 -1645 -4839 5781 -2524 1110 -5781 613 -3454 -715 200 -2746 859 -947 1701 -662 500 -509 -487 994 -151 3053 476 2046 1380 766 899 -1450 -62 -572 576 158 1165 2193 2115 1133 -380 732 -351 1557 1204 634 1238 -5 932 -1036 -304 -1084 -1461 -416 -1242 -688 -1235 -1650 -1965 -740 -432 -3 606 633 1112 327 777 -70 229 236 -67 788 932 551 -220 -284 -798 -469 150 -1328 -1090 -1249 -658 -67 295 352 102 359 -75 169 372 396 237 -27 -240 -618 189 365 339 371 -179 240 972 438 16 -101 -331 -183 -15 -220 -237 -159 464 -73 -78 -20 -192 185 -258 -274 90 -1016 -17 -562 -512 -542 -658 -220 -741 -321 -390 -319 -163 -260 91 -307 213 -275 172 -326 -97 141 -354 74 -612 90 -456 86 -81 -287 352 -178 73 -404 44 -309 -72 24 -377 122 -144 258 -104 80 -83 -81 169 -27 590 105 484 355 209 255 -433 -18 -165 163 46 371 778 787 443 -146 270 -133 634 564 329 668 -3 477 -497 -138 -459 -618 -191 -636 -406 -830 -1214 -1536 -611 -380 -3 543 567 1009 279 613 -53 174 197 -64 810 1085 697 -280 -340 -871 -471 151 -1460 -1267 -1531 -853 -93 430 560 170 595 -119 251 554 589 350 -42 -397 -1030 303 566 507 559 -261 335 1382 692 27 -185 -640 -350 -30 -474 -539 -371 1094 -166 -180 -44 -397 371 SS 20221015T123928.2Z 8323.527409 280 1 48.55 2 74.74 115.58 44.26 269.02 0.00 1 0.00 1 0 25 6.551e-02 5.358e-03 1.693e-02 8.377e-04 4.807614e-01 4.273873e-04 5.496547e-03 -6.000000e+00 3.735113e-02 226.10 -2.00 3.49 -2.00 320.10 0.00e+00 1.610133e-03 1.237310e-04 2.752720e-04 -6.000000e+00 1.513713e-03 285.02 -2.00 20.00 -2.00 319.78 0.00e+00 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