File name: Pandora159s1_Wakkerstroom_20220128_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T035335.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Refilwe Kai Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 159 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora159_OF_v6d20191004.txt Instrument calibration file used: Pandora159s1_CF_v3d20201207.txt Level 1 file used: Pandora159s1_Wakkerstroom_20220128_L1_smca1c3d20201207p1-8.txt Full location name: Global Change Institute, University of Witwatersrand field site in Wakkerstroom Short location name: Wakkerstroom Country of location: South Africa Location latitude [deg]: -27.3493 Location longitude [deg]: 30.1438 Location altitude [m]: 1760 Local noon date: 20220128 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: None First and last pixel inside fitting window: 222 364 Nominal wavelengths inside fitting window [nm]: 305.0731 305.2139 305.3547 305.4955 305.6363 305.7770 305.9178 306.0585 306.1992 306.3399 306.4806 306.6213 306.7620 306.9026 307.0433 307.1839 307.3246 307.4652 307.6058 307.7464 307.8869 308.0275 308.1681 308.3086 308.4492 308.5897 308.7302 308.8707 309.0112 309.1517 309.2921 309.4326 309.5730 309.7135 309.8539 309.9943 310.1347 310.2751 310.4155 310.5558 310.6962 310.8365 310.9769 311.1172 311.2575 311.3978 311.5381 311.6784 311.8186 311.9589 312.0991 312.2393 312.3795 312.5198 312.6599 312.8001 312.9403 313.0805 313.2206 313.3607 313.5009 313.6410 313.7811 313.9212 314.0612 314.2013 314.3414 314.4814 314.6214 314.7615 314.9015 315.0415 315.1814 315.3214 315.4614 315.6013 315.7413 315.8812 316.0211 316.1610 316.3009 316.4408 316.5807 316.7205 316.8604 317.0002 317.1400 317.2798 317.4196 317.5594 317.6992 317.8389 317.9787 318.1184 318.2582 318.3979 318.5376 318.6773 318.8170 318.9566 319.0963 319.2359 319.3756 319.5152 319.6548 319.7944 319.9340 320.0736 320.2131 320.3527 320.4922 320.6318 320.7713 320.9108 321.0503 321.1898 321.3292 321.4687 321.6081 321.7476 321.8870 322.0264 322.1658 322.3052 322.4446 322.5839 322.7233 322.8626 323.0019 323.1413 323.2806 323.4199 323.5591 323.6984 323.8377 323.9769 324.1162 324.2554 324.3946 324.5338 324.6730 324.8121 324.9513 --------------------------------------------------------------------------------------- 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: 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 77: 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 78: 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 79: 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 80: 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 81: 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 82: Atmospheric variability [%], 999=no atmospheric variability was determined Column 83: Wavelength effective temperature [°C], 999=no effective temperature given Column 84: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 85: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 86: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 87: Number of bright count cycles Column 88: Number of dark count cycles Column 89: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 90: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 91: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 92: Integration time [ms] Column 93: Spectrometer control temperature [°C], 999=no temperature signal Column 94: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 95: Temperature in head sensor [°C], 999=no temperature signal Column 96: Temperature at electronics board 1 [°C], 999=no temperature signal Column 97: Temperature at electronics board 2 [°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 20220128T044931.4Z 8063.201058 175 1 48.65 2 73.75 102.45 19.81 83.43 0.00 1 0.00 1 0 17 1.762e-01 1.384e-02 1.738e-01 1.083e-02 3.998391e-01 5.492517e-03 4.089083e-03 -6.000000e+00 1.001391e-01 227.66 -2.00 3.06 -2.00 319.59 0.00e+00 -8.902740e-05 1.510279e-03 1.609725e-04 -6.000000e+00 4.437493e-03 282.64 -2.00 20.00 -2.00 318.89 0.00e+00 3.516 0.000 302.00 328.00 3 5.4015e+00 1.5627e-02 3.3764e-02 -6.0000e+00 2.4879e-01 9.8979e-02 1.8348e-02 1.8163e-02 -6.0000e+00 2.7024e-01 -1.8065e-02 1.4033e-02 8.9614e-03 -6.0000e+00 1.6098e-01 -2.1866e-03 7.3576e-03 2.5527e-03 -6.0000e+00 6.8470e-02 8.0291e-05 -1.8793e-04 3.1834e-04 2.8398e-05 -6.0000e+00 4.7116e-03 -7.2686e-03 12 8 8 10 0 0 99.93 19.47 1.08 -0.00727 -0.00868 13 3 1 8 0 3741.490 14.99 19.47 22.27 21.69 21.69 19.8 898.55 6141 9701 -37166 94060 -17328 -6586 7659 149665 -29711 33069 -7927 3936 40092 20478 5365 -24467 -13968 -6436 -11031 391 -28241 -8825 25 -13934 10791 -4106 9149 13895 11365 20575 936 26865 -7207 11541 -8634 14744 8131 -2142 5256 -7054 -8139 -2495 -557 3239 9974 -8067 3176 -7041 -271 3135 8235 561 1320 960 -850 6025 665 2111 -467 5815 74 -142 4094 1436 1519 -1951 -1350 -964 4647 -512 -1139 -966 -53 -2513 2936 -1739 -510 3214 -527 1161 2073 -614 -2444 -1116 -848 26 -1571 -1817 1462 -3 1987 502 -946 -17 -282 752 3000 328 460 -1236 274 269 630 -265 -1046 -2228 -1446 -1547 -256 -163 -904 -45 -143 318 434 -68 531 461 1193 -47 -676 1295 256 -1528 273 1617 4440 649 1951 -560 -772 -402 480 273 -525 -687 460 648 -813 -527 -631 153 275 131 226 -1406 994 -470 -156 171 1581 -1221 789 -286 134 1121 822 293 -2005 -1113 -505 -958 32 -3103 -804 2 -1486 977 -448 883 1214 971 1633 99 2471 -1019 1420 -1228 1641 1057 -363 1003 -1778 -2296 -704 -160 907 2625 -2545 893 -2181 -79 909 2438 195 489 380 -357 2438 290 905 -201 2330 32 -67 2043 795 858 -1075 -699 -494 2435 -321 -789 -694 -38 -1748 1801 -1005 -266 1567 -285 706 1425 -482 -2096 -993 -803 26 -1684 -2010 1568 -3 1909 450 -799 -14 -253 745 3260 408 609 -1652 340 304 664 -288 -1236 -2818 -1898 -2129 -370 -255 -1519 -78 -240 504 636 -95 736 665 1824 -77 -1122 2070 400 -2348 395 2208 5655 864 2790 -892 -1309 -705 856 508 -1043 -1438 972 1393 -1778 -1121 -1286 296 518 SS 20220128T050100.2Z 8063.209030 177 1 51.78 2 71.26 101.29 17.34 81.25 0.00 1 0.00 1 0 25 1.431e-02 6.527e-03 2.475e-03 3.324e-04 3.510527e-01 1.666015e-04 3.663401e-03 -6.000000e+00 8.131020e-03 227.66 -2.00 3.06 -2.00 318.81 0.00e+00 8.178438e-04 3.661018e-05 2.168628e-04 -6.000000e+00 3.603289e-04 282.64 -2.00 20.00 -2.00 318.09 0.00e+00 3.075 0.000 302.00 328.00 3 2.9700e-01 4.5692e-04 2.9595e-02 -6.0000e+00 2.0201e-02 2.3498e-02 5.2529e-04 1.6074e-02 -6.0000e+00 2.1943e-02 -4.5464e-03 3.6691e-04 7.8493e-03 -6.0000e+00 1.3071e-02 -4.0290e-03 1.9288e-04 2.3651e-03 -6.0000e+00 5.5593e-03 2.0744e-02 -5.2830e-04 9.5730e-06 2.4055e-05 -6.0000e+00 3.8260e-04 -6.8596e-03 11 8 0 10 0 0 99.92 19.47 0.23 -0.00686 -0.01083 1482 319 2 8 0 32.910 14.99 19.47 22.99 21.69 21.69 20.0 904.56 -4985 -3565 -5269 -6289 -4414 -3123 -2593 -2293 -1710 -4288 -2858 -1669 -1417 -979 -165 -1898 -194 -833 -375 -42 -665 575 336 -104 -612 -773 -2139 -1240 -59 1644 1199 1795 890 -2061 -1139 -128 -952 19 -285 -1522 -1766 -1180 -1238 -1119 -228 -821 -516 -275 -413 869 1145 840 1026 897 568 1215 505 423 720 1044 1621 1437 1387 738 -545 471 622 902 1953 401 -56 -244 -345 -88 -302 537 710 1051 1365 -129 -595 -1085 -2066 -966 -1085 -1029 -589 -590 -320 -323 508 589 1074 1825 1471 716 776 261 -754 -666 -312 -191 839 731 -1122 -815 -656 -698 -165 -102 -318 -348 -112 146 411 1121 864 575 131 -701 -820 -274 -177 -112 722 381 1149 1723 572 295 166 12 103 379 -251 -365 -32 54 -529 -209 -91 -231 132 -200 -157 -245 -280 -174 -116 -102 -103 -86 -233 -154 -94 -91 -75 -15 -192 -21 -94 -44 -5 -84 72 43 -14 -90 -120 -335 -183 -8 224 178 296 164 -405 -210 -23 -186 4 -80 -504 -647 -454 -493 -451 -91 -332 -206 -109 -163 345 484 387 505 429 283 619 265 222 367 574 836 803 853 493 -374 300 370 526 1214 288 -44 -203 -287 -70 -223 352 422 654 897 -90 -475 -969 -2003 -973 -1079 -1096 -661 -682 -370 -359 564 598 1000 1652 1430 783 880 332 -1038 -909 -397 -220 974 804 -1363 -1046 -880 -984 -245 -151 -507 -569 -178 234 605 1541 1184 826 202 -1076 -1282 -451 -281 -172 1045 529 1501 2252 819 460 276 19 169 647 -458 -702 -63 108 -1074 -413 -172 -416 231 SS 20220128T050825.4Z 8063.214183 181 1 36.75 2 69.64 100.55 15.75 79.59 0.00 1 0.00 1 0 25 1.220e-02 6.853e-03 2.411e-03 4.445e-04 3.247479e-01 2.211090e-04 3.402415e-03 -6.000000e+00 6.933663e-03 227.66 -2.00 3.06 -2.00 318.29 0.00e+00 7.394827e-04 4.213896e-05 1.450614e-04 -6.000000e+00 3.072580e-04 282.64 -2.00 20.00 -2.00 317.55 0.00e+00 2.845 0.000 302.00 328.00 3 9.7429e-01 5.9578e-04 2.7359e-02 -6.0000e+00 1.7226e-02 2.2615e-02 6.7923e-04 1.4782e-02 -6.0000e+00 1.8711e-02 -3.6191e-03 4.4481e-04 7.2238e-03 -6.0000e+00 1.1146e-02 -2.5793e-03 2.3075e-04 2.1417e-03 -6.0000e+00 4.7408e-03 1.3111e-02 -4.4569e-04 1.2657e-05 2.2781e-05 -6.0000e+00 3.2624e-04 -7.1383e-03 12 9 1 12 1 1 99.96 19.47 0.26 -0.00714 -0.01049 518 157 2 8 0 67.090 15.00 19.47 24.00 21.69 21.69 20.3 909.95 -3282 -2915 -4234 -5384 -3028 -2360 -1542 -1078 -1391 -3317 -2113 -617 -825 -1658 -123 -1947 -625 -782 -170 -3 -656 491 917 -86 -318 -628 -1508 -606 273 2010 1294 2384 1241 -1922 -621 87 -719 83 -149 -1642 -1683 -1189 -1149 -1132 -131 -865 -565 -241 -495 688 956 715 1026 943 546 1260 402 372 718 1080 1577 1343 1191 676 -629 333 536 835 1824 305 -146 -437 -455 -95 -364 601 640 1142 1336 -88 -697 -1109 -2180 -977 -1135 -1009 -654 -603 -327 -318 538 473 1130 1983 1514 673 731 282 -807 -634 -302 -256 736 792 -1083 -764 -830 -711 -86 -47 -307 -347 -130 181 386 1120 827 622 206 -674 -802 -226 -152 -44 777 390 1087 1762 591 347 178 -36 120 429 -212 -369 -74 36 -581 -246 -135 -309 63 -187 -184 -278 -338 -167 -124 -85 -67 -98 -250 -158 -47 -73 -173 -15 -265 -89 -117 -27 0 -110 81 153 -15 -61 -126 -305 -115 48 349 244 494 286 -472 -142 19 -175 24 -51 -617 -696 -516 -514 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