File name: Pandora159s1_Wakkerstroom_20200310_L2Fit_fout2c6d20191220p1-8.txt File generation date: 20240926T152817.1Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 Local principal investigator: B. Scholes Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 159 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora159_OF_v4d20191004.txt Instrument calibration file used: Pandora159s1_CF_v6d20191220.txt Level 1 file used: Pandora159s1_Wakkerstroom_20200310_L1_smca1c6d20191220p1-8.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: 20200310 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: Update session 4 based on session2 for SO2 First and last pixel inside fitting window: 222 364 Nominal wavelengths inside fitting window [nm]: 305.0490 305.1898 305.3306 305.4713 305.6121 305.7529 305.8936 306.0343 306.1750 306.3157 306.4564 306.5971 306.7378 306.8785 307.0191 307.1597 307.3004 307.4410 307.5816 307.7222 307.8628 308.0033 308.1439 308.2845 308.4250 308.5655 308.7060 308.8465 308.9870 309.1275 309.2680 309.4084 309.5489 309.6893 309.8297 309.9701 310.1105 310.2509 310.3913 310.5317 310.6720 310.8124 310.9527 311.0930 311.2333 311.3736 311.5139 311.6542 311.7944 311.9347 312.0749 312.2152 312.3554 312.4956 312.6358 312.7760 312.9161 313.0563 313.1964 313.3366 313.4767 313.6168 313.7569 313.8970 314.0371 314.1771 314.3172 314.4572 314.5973 314.7373 314.8773 315.0173 315.1573 315.2973 315.4372 315.5772 315.7171 315.8570 315.9969 316.1369 316.2767 316.4166 316.5565 316.6964 316.8362 316.9760 317.1159 317.2557 317.3955 317.5352 317.6750 317.8148 317.9545 318.0943 318.2340 318.3737 318.5134 318.6531 318.7928 318.9325 319.0721 319.2118 319.3514 319.4910 319.6307 319.7703 319.9098 320.0494 320.1890 320.3285 320.4681 320.6076 320.7471 320.8866 321.0261 321.1656 321.3051 321.4445 321.5840 321.7234 321.8628 322.0023 322.1417 322.2810 322.4204 322.5598 322.6991 322.8385 322.9778 323.1171 323.2564 323.3957 323.5350 323.6743 323.8135 323.9528 324.0920 324.2312 324.3704 324.5096 324.6488 324.7880 324.9272 --------------------------------------------------------------------------------------- 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: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Azimuth motor temperature [°C], 999=no temperature signal Column 98: Zenith motor temperature [°C], 999=no temperature signal Column 99: Temperature at electronics board 1 [°C], 999=no temperature signal Column 100: Temperature at electronics board 2 [°C], 999=no temperature signal Column 101: Humidity in head sensor [%], -9=no humidity signal Column 102: Pressure in head sensor [hPa], -9=no pressure signal Columns 103-245: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 246-388: 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 20200310T043123.9Z 7374.188471 32 1 49.85 2 83.38 91.01 91.57 276.42 0.00 1 0.00 1 0 33 6.354e-01 1.118e-02 4.201e-01 8.374e-03 8.189257e-01 4.823527e-03 7.859456e-03 -6.000000e+00 3.622087e-01 227.40 -2.00 3.06 -2.00 322.11 0.00e+00 2.013049e-03 2.898660e-03 4.787840e-03 -6.000000e+00 1.649127e-02 282.19 -2.00 20.00 -2.00 321.64 0.00e+00 7.904 0.003 302.00 328.00 3 1.0466e+00 1.9459e-02 8.1089e-02 -6.0000e+00 9.0011e-01 2.5327e-01 3.0501e-02 5.9713e-02 -6.0000e+00 9.7928e-01 -3.7006e-01 3.2891e-02 2.6327e-02 -6.0000e+00 5.8409e-01 1.4494e-01 1.4706e-02 7.9298e-03 -6.0000e+00 2.5050e-01 1.4102e-04 -1.4963e-03 2.3959e-04 9.3083e-05 -6.0000e+00 1.7334e-02 1.2080e-02 0.0000e+00 12 8 8 10 0 0 95.29 20.43 0.55 0.01208 0.00084 89 19 4 8 0 553.830 15.13 20.43 12.55 31.30 30.80 22.50 22.50 10.3 896.22 900000 -185692 -67396 900000 -248157 -259488 -222942 10565 -196186 -77393 -180308 -185482 -223805 -179545 900000 900000 61758 -87381 -15503 -32295 900000 -19645 135400 20266 -23941 -17698 -100588 -26280 -106923 -60257 -89460 -43358 69699 4325 196295 -4794 8463 13129 -25670 28701 606 -8442 -13111 13127 -13875 -3307 7006 -5565 26785 15100 18617 23731 4352 8419 17582 13107 12622 4671 -373 -400 -1250 7186 8269 6250 901 397 3472 1967 3869 30 4195 2257 6960 3486 2735 1895 1109 -2275 5091 1184 -937 376 -430 3040 -387 442 -2210 955 1043 -597 2514 -691 283 -98 2599 141 -626 886 -1069 -1444 -135 234 1014 -1490 -2287 -2438 -552 -2007 -1427 91 -1227 -783 -455 -47 -462 1426 1238 972 -578 -371 -87 119 1640 7 128 628 1465 2605 793 -733 240 544 -192 512 -40 -661 326 -78 -254 -17 -86 -671 275 900000 -1515 -550 900000 -2025 -2310 -1819 86 -1601 -631 -1471 -1513 -3486 -2397 900000 900000 504 -1069 -126 -263 900000 -160 1105 165 -234 -173 -2298 -279 -2530 -983 -2409 -920 569 74 1602 -86 145 257 -922 726 23 -386 -663 525 -736 -162 320 -304 1136 788 1063 1472 332 681 1395 1147 1152 461 -37 -39 -125 730 963 858 142 63 536 324 700 7 980 564 1642 799 572 357 197 -432 1027 301 -291 134 -172 1260 -177 214 -1156 499 543 -305 1167 -312 123 -45 1330 88 -461 749 -1024 -1414 -123 189 730 -1085 -1800 -2044 -480 -1907 -1499 109 -1678 -1158 -688 -69 -657 1916 1674 1380 -883 -587 -136 176 2279 9 170 802 1793 3298 1176 -1280 465 1140 -431 1222 -103 -1817 907 -222 -721 -47 -219 -1584 614 SS 20200310T044454.1Z 7374.197848 35 1 52.13 2 80.38 89.46 94.41 274.88 0.00 1 0.00 1 0 25 2.674e-01 5.904e-03 1.457e-01 1.796e-03 6.282847e-01 9.573259e-04 6.179156e-03 -6.000000e+00 1.519158e-01 227.40 -2.00 3.06 -2.00 321.21 0.00e+00 4.580219e-03 4.582728e-04 1.733911e-03 -6.000000e+00 6.721386e-03 282.19 -2.00 20.00 -2.00 320.67 0.00e+00 5.715 0.001 302.00 328.00 3 6.2936e-01 3.2484e-03 5.6188e-02 -6.0000e+00 3.7726e-01 3.0547e-02 4.5275e-03 3.4851e-02 -6.0000e+00 4.0979e-01 -2.2975e-02 4.7084e-03 1.5620e-02 -6.0000e+00 2.4410e-01 -2.6304e-03 2.2477e-03 8.3394e-03 -6.0000e+00 1.0392e-01 1.3762e-03 -7.6697e-04 5.0792e-05 6.3080e-05 -6.0000e+00 7.1469e-03 1.1591e-02 0.0000e+00 10 0 0 10 0 0 11.92 19.50 0.24 0.01159 0.00583 341 73 2 8 0 144.780 15.02 19.50 14.34 37.10 39.30 21.79 21.69 9.7 902.86 14990 -140426 -21566 -112988 -23864 -101350 -110047 -98962 -64476 -56213 -105257 2970 -69443 20464 -56812 9309 -41627 6759 -2099 -4640 -8279 -11587 3734 -23569 -8992 -19909 -5399 -23843 8485 -10035 7745 -1788 3319 -10646 -10902 -3046 -6058 4968 -3414 -366 -5767 1356 -2932 1227 934 -651 2810 2569 1220 87 3280 1289 4474 -79 1791 -599 -42 -2204 99 1324 2483 1357 2456 2103 687 1820 640 1210 1739 1235 -168 -17 -187 181 -405 -188 -178 -321 1449 -365 383 -890 -1498 -1336 -956 -1035 -677 -643 -45 241 880 1031 959 1934 1119 858 696 635 -625 -308 -65 -161 952 638 -1198 -1132 -662 -1026 -9 -321 -199 -317 -112 242 323 1155 809 630 -154 -717 -945 -35 -179 69 351 155 858 1535 411 -108 171 -50 175 224 -268 -480 84 -10 -433 -126 158 5 325 26 -1140 -64 -756 -67 -604 -701 -646 -373 -325 -955 11 -641 111 -778 80 -683 76 -28 -69 -132 -192 55 -499 -179 -469 -113 -589 151 -233 180 -56 115 -458 -457 -116 -261 229 -211 -26 -498 118 -282 117 92 -67 287 273 138 11 432 195 662 -13 315 -112 -8 -434 18 242 464 283 579 562 198 508 176 340 536 442 -68 -7 -79 72 -148 -61 -54 -98 484 -147 180 -485 -902 -853 -649 -751 -516 -506 -35 182 616 670 595 1212 787 700 659 689 -752 -372 -74 -163 872 587 -1208 -1211 -741 -1230 -12 -466 -320 -499 -177 397 499 1687 1186 968 -253 -1243 -1636 -58 -286 107 517 220 1161 2125 645 -194 335 -95 352 478 -615 -1163 208 -24 -1095 -308 361 11 672 SS 20200310T045419.2Z 7374.204389 39 1 52.34 2 78.29 88.36 96.40 273.82 0.00 1 0.00 1 0 25 9.397e-02 5.796e-03 3.797e-02 9.865e-04 5.377381e-01 5.140689e-04 5.410994e-03 -6.000000e+00 5.338160e-02 227.40 -2.00 3.06 -2.00 320.61 0.00e+00 3.170887e-03 2.022588e-04 1.214825e-03 -6.000000e+00 2.361794e-03 282.19 -2.00 20.00 -2.00 320.01 0.00e+00 4.775 0.001 302.00 328.00 3 5.3651e-01 1.6017e-03 4.6617e-02 -6.0000e+00 1.3257e-01 1.2562e-02 2.0566e-03 2.7613e-02 -6.0000e+00 1.4399e-01 -7.5909e-03 1.9787e-03 1.2653e-02 -6.0000e+00 8.5775e-02 -6.7448e-03 9.8820e-04 5.8012e-03 -6.0000e+00 3.6517e-02 3.4477e-03 -6.6003e-04 2.8289e-05 4.6604e-05 -6.0000e+00 2.5113e-03 1.1505e-02 0.0000e+00 10 0 0 10 0 0 11.08 19.20 0.28 0.01151 0.00655 550 118 2 8 0 89.600 15.00 19.20 15.17 42.10 40.80 21.48 21.48 9.6 906.98 -12847 -39167 -23395 -32829 -27438 -28854 -45533 -20775 -36039 -17996 -36207 -16680 -26327 -1741 -10366 -4557 -9980 -4494 -2299 -4378 -148 -4274 -1779 -9339 -1819 -8703 -2353 -7765 1282 -2637 2467 1724 2789 -1239 -3336 1262 -4619 -608 -3009 -1280 -4270 -1251 -2060 -852 -917 -1237 348 -709 185 617 2063 345 1648 430 458 505 158 -453 -252 628 1133 1861 1137 1624 -161 1418 825 1243 1874 589 -37 -282 -515 -258 -96 419 806 615 1366 -174 -216 -814 -1796 -849 -931 -1047 -638 -531 -155 158 709 1072 837 2099 1212 755 708 549 -648 -425 -68 -115 922 582 -1072 -1128 -698 -753 -158 -86 -373 -298 -32 161 374 1168 839 474 -169 -831 -870 -205 -264 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