File name: Pandora159s1_Wakkerstroom_20211123_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T034039.4Z 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_20211123_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: 20211123 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 20211123T042642.9Z 7997.185219 202 1 50.98 2 72.08 104.17 76.55 310.31 0.00 1 0.00 1 0 25 3.054e-02 6.357e-03 1.805e-02 1.550e-03 3.961909e-01 7.885837e-04 4.084980e-03 -6.000000e+00 1.736895e-02 228.16 -2.00 3.06 -2.00 319.59 0.00e+00 7.198064e-04 2.135218e-04 3.316911e-04 -6.000000e+00 7.610043e-04 280.22 -2.00 20.00 -2.00 318.93 0.00e+00 3.207 0.000 302.00 328.00 3 2.4128e+00 2.2313e-03 3.1729e-02 -6.0000e+00 4.3239e-02 3.5302e-02 2.6131e-03 1.8250e-02 -6.0000e+00 4.6982e-02 5.4753e-03 2.0078e-03 8.9434e-03 -6.0000e+00 2.7935e-02 -1.0936e-02 1.0521e-03 2.6760e-03 -6.0000e+00 1.1832e-02 2.0809e-03 -5.7322e-04 4.5630e-05 2.9195e-05 -6.0000e+00 8.1662e-04 -1.5548e-03 10 0 0 10 0 0 99.98 19.10 0.22 -0.00155 -0.00586 468 101 2 8 0 104.660 15.00 19.10 18.26 21.38 21.38 18.3 882.93 -8018 -1849 -16700 -6275 -10706 -4281 -19611 -1485 -6924 -6553 -5345 -3021 -2122 2006 3249 -5295 1629 -2636 730 -5086 2156 103 1888 -798 -382 -1330 -983 2105 -978 3791 -76 4117 -958 -556 -2775 2241 -1126 839 -206 -1662 -1582 -1451 -1095 -2643 456 -2195 -688 -1018 130 107 1310 801 1648 1017 341 1176 -407 356 -19 1345 1078 1827 1379 1025 -574 782 842 721 2445 150 98 -632 -51 -594 -105 182 1211 739 1882 52 -428 -871 -2095 -461 -1129 -751 -790 -456 -328 -43 441 653 1176 1658 1712 669 950 130 -545 -638 -42 -337 1120 474 -1105 -882 -629 -633 -103 4 -413 -254 -257 326 382 1382 623 779 27 -862 -790 -262 -38 -179 784 310 1283 1534 562 43 103 -68 107 328 -259 -322 -30 11 -538 -74 -51 -6 194 -193 -47 -513 -165 -267 -97 -558 -40 -224 -225 -184 -108 -88 97 183 -368 114 -205 58 -449 181 9 164 -77 -39 -145 -107 211 -96 362 -8 489 -133 -80 -388 293 -167 145 -44 -389 -409 -396 -309 -768 129 -642 -197 -316 40 34 409 274 601 397 140 493 -177 153 -8 553 459 838 703 569 -328 416 422 359 1299 93 67 -453 -36 -403 -66 110 661 393 1062 32 -299 -682 -1789 -407 -1072 -760 -845 -501 -359 -45 427 579 962 1335 1485 659 1051 163 -734 -852 -52 -380 1162 508 -1302 -1096 -816 -865 -150 7 -697 -441 -434 516 559 1887 855 1115 41 -1418 -1314 -423 -60 -269 1114 422 1647 1990 801 68 172 -119 190 611 -517 -676 -64 24 -1187 -158 -104 -11 365 SS 20211123T044345.4Z 7997.197053 208 1 50.11 2 68.40 102.52 79.39 307.89 0.00 1 0.00 1 0 25 4.207e-02 8.644e-03 2.862e-02 4.216e-03 3.305490e-01 2.115108e-03 3.452842e-03 -6.000000e+00 2.392279e-02 228.16 -2.00 3.06 -2.00 318.88 0.00e+00 5.526683e-04 4.620857e-04 1.077255e-04 -6.000000e+00 1.048175e-03 280.22 -2.00 20.00 -2.00 318.18 0.00e+00 2.692 0.000 302.00 328.00 3 4.8774e+00 5.8033e-03 2.6539e-02 -6.0000e+00 5.9554e-02 4.1377e-02 6.6595e-03 1.5059e-02 -6.0000e+00 6.4711e-02 3.1532e-03 4.6041e-03 7.4196e-03 -6.0000e+00 3.8476e-02 -7.3374e-03 2.4026e-03 2.1527e-03 -6.0000e+00 1.6296e-02 2.9076e-04 -5.2841e-04 1.2342e-04 2.3582e-05 -6.0000e+00 1.1248e-03 -1.2865e-03 11 8 0 10 0 0 99.95 19.09 0.58 -0.00129 -0.00526 33 7 1 8 0 1518.120 15.00 19.09 19.36 21.38 21.38 18.3 888.23 -14872 -8119 -6155 11078 -15058 9350 -31574 1760 -1815 -1160 -12114 -6683 4023 4740 -275 -7071 -416 -6517 -730 -1214 3789 -2834 9721 811 1518 -3159 1173 -1441 -1419 2245 364 4301 -2249 2117 -149 4181 -2168 2010 -2210 12 -1559 -1197 346 -1839 1093 -1080 382 -2101 1251 682 2536 -396 1813 585 1292 2290 -1818 876 -1069 1919 908 1631 1617 -184 -1055 1144 98 -4 2575 192 -170 -936 701 -1132 399 153 1500 1262 1142 752 -1104 -387 -2419 -1490 -1072 -64 -1264 222 -144 -408 693 378 1112 1697 2002 808 1152 514 -226 -1059 -569 -1040 1421 305 -650 -1151 -2324 -1135 -69 192 -448 268 0 -49 339 1385 874 665 127 -859 -419 -181 -109 99 1569 377 1378 1349 1058 -233 523 -114 -11 123 -130 -705 82 -15 -679 -161 48 -84 33 -735 -416 -318 460 -723 345 -1839 84 -101 -67 -782 -428 267 366 -26 -790 -46 -807 -90 -156 475 -377 1177 114 226 -513 183 -218 -203 311 56 698 -426 396 -27 711 -429 448 -619 4 -552 -444 131 -717 416 -421 145 -810 462 258 1003 -175 831 287 652 1174 -986 462 -562 975 480 922 997 -124 -722 718 58 -2 1581 137 -133 -762 561 -885 287 100 881 713 685 513 -861 -331 -2251 -1442 -1098 -70 -1453 258 -169 -463 726 366 994 1477 1855 836 1317 651 -306 -1431 -721 -1217 1539 342 -795 -1490 -3167 -1603 -101 300 -747 453 0 -76 488 1864 1183 937 192 -1378 -682 -290 -169 149 2229 518 1790 1766 1491 -357 840 -190 -18 216 -241 -1374 163 -31 -1384 -319 92 -155 60 SS 20211123T045013.2Z 7997.201542 211 1 9.90 2 66.99 101.91 80.50 307.01 0.00 1 0.00 1 0 25 1.305e-02 7.234e-03 1.075e-02 2.674e-03 3.190684e-01 1.339728e-03 3.362159e-03 -6.000000e+00 7.422890e-03 228.16 -2.00 3.06 -2.00 317.72 0.00e+00 9.858108e-04 2.153573e-04 1.479742e-04 -6.000000e+00 3.252296e-04 280.22 -2.00 20.00 -2.00 317.03 0.00e+00 2.539 0.000 302.00 328.00 3 3.5876e+00 3.5650e-03 2.5208e-02 -6.0000e+00 1.8479e-02 5.0563e-02 4.0238e-03 1.4527e-02 -6.0000e+00 2.0079e-02 -1.4141e-02 2.5098e-03 7.0962e-03 -6.0000e+00 1.1939e-02 9.9146e-04 1.2734e-03 2.1575e-03 -6.0000e+00 5.0564e-03 1.2106e-03 -5.8324e-04 7.5409e-05 2.2810e-05 -6.0000e+00 3.4900e-04 -1.4874e-03 12 9 1 12 1 1 99.70 19.09 0.30 -0.00149 -0.00587 10 12 1 8 0 864.970 15.00 19.09 19.60 21.38 21.38 18.3 889.66 -3656 -1302 -6852 -3694 -633 -3162 723 -4720 14 -1005 -183 351 -2442 -164 -573 -313 -1713 -1685 1332 1515 -513 -443 163 2662 730 653 -588 -1176 -2049 1516 1321 1531 2261 -906 -99 1954 -475 -581 561 -1650 -1516 -1044 -1349 -1293 -899 -680 -1487 333 150 1108 827 507 1052 454 855 1053 284 550 1856 992 1629 1222 584 775 -408 299 3 646 1714 346 -251 -467 -411 -261 -3 -139 698 846 1269 -15 -704 -1456 -2480 -1070 -1332 -802 -564 -812 -271 -389 332 621 1179 1959 1634 434 615 701 -663 -682 -356 -134 979 492 -1153 -331 -881 -723 -12 31 -78 -208 -162 -5 704 872 1052 492 186 -669 -983 -332 -311 -87 941 410 1131 1738 491 133 209 12 -72 206 -209 -409 -77 -1 -290 -296 -61 -230 -33 -295 -114 -645 -318 -48 -236 55 -426 1 -102 -18 37 -297 -23 -91 -55 -321 -330 265 312 -109 -94 35 594 175 162 -147 -281 -469 337 316 398 632 -268 -28 524 -141 -198 223 -760 -751 -538 -716 -693 -480 -363 -793 172 77 574 451 295 641 291 560 702 193 373 1224 654 1096 877 450 630 -336 233 2 469 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