File name: Pandora159s1_Wakkerstroom_20201230_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T023525.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: B. Scholes Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 159 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora159_OF_v5d20191004.txt Instrument calibration file used: Pandora159s1_CF_v3d20201207.txt Level 1 file used: Pandora159s1_Wakkerstroom_20201230_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: 20201230 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 20201230T034030.3Z 7669.153129 140 1 48.62 2 84.03 113.00 97.48 294.63 0.00 1 0.00 1 0 33 7.297e-01 1.018e-01 5.297e-01 8.491e-02 8.053545e-01 4.874529e-02 8.456633e-03 -6.000000e+00 4.356472e-01 227.75 -2.00 3.06 -2.00 321.29 0.00e+00 1.615612e-02 1.571028e-02 4.485075e-03 -6.000000e+00 2.069025e-02 281.88 -2.00 20.00 -2.00 320.71 0.00e+00 8.607 0.004 302.00 328.00 3 3.0367e+00 1.4886e-01 8.8123e-02 -6.0000e+00 1.0840e+00 1.5539e+00 1.7075e-01 7.0478e-02 -6.0000e+00 1.1875e+00 -1.6889e+00 9.8651e-02 1.7783e-02 -6.0000e+00 7.0221e-01 6.8160e-01 5.3467e-02 1.9256e-02 -6.0000e+00 2.9310e-01 7.1260e-06 -5.3035e-03 2.3489e-03 2.1078e-04 -6.0000e+00 2.1537e-02 5.7348e-03 12 8 8 10 0 0 33.32 19.35 1.87 0.00573 -0.03412 12 3 4 8 0 4000.000 14.99 19.35 21.32 21.58 21.58 14.3 918.58 -22418 40303 900000 -24006 24278 900000 -22655 -61227 48101 29265 -50887 -54399 900000 900000 219699 900000 476 900000 -43412 83053 -31168 -34023 185902 900000 189145 5081 900000 900000 900000 4679 900000 -20853 900000 75911 900000 34168 900000 900000 52678 241347 97246 246825 -23587 69842 15401 201797 20672 105117 346739 281284 77604 32540 -5961 17368 35830 119672 900000 -35767 25788 -19494 28010 -23040 900000 17344 57132 -38919 65209 -5229 50008 -5467 -10908 85088 -33771 163600 1674 -49859 -21784 46561 -31607 9693 42772 20918 -5411 27276 23670 -29773 23959 6133 18554 -11108 41763 1025 24172 20271 12696 2693 3755 -16048 -14443 6197 2792 16403 20610 13654 -20791 2008 12867 6817 6180 1425 4032 -569 -6248 -4216 3301 -542 9275 3238 2399 3465 -3812 44 8040 -15690 7382 3626 -3387 11686 -12394 3405 1547 8395 -3467 5881 -3808 -4825 4732 -1800 2626 -1577 -1635 -2200 5428 -3775 4031 900000 -3863 2003 900000 -2148 -7893 3969 2415 -4808 -5538 900000 900000 18130 900000 67 900000 -9724 6854 -5589 -5615 15341 900000 15608 441 900000 900000 900000 386 900000 -2915 900000 6264 900000 2820 900000 900000 4347 19916 8025 20368 -4819 5763 2127 16653 2718 8674 28613 23212 6818 4828 -1355 3300 5812 9875 900000 -10794 4035 -4504 4128 -6001 900000 3899 9288 -15688 9410 -1508 9075 -1915 -4365 13831 -16761 13500 486 -21034 -6461 7236 -11743 2879 10907 7528 -2744 10653 10007 -22160 11074 3451 9202 -7090 14905 506 9166 8247 6271 1720 2800 -16809 -16513 5946 2610 12014 12895 8890 -20090 1655 10010 6059 6087 1673 5232 -835 -9937 -6477 4489 -738 11466 4447 3517 5227 -6096 64 10437 -24839 9028 4442 -4284 13208 -20143 5473 2832 15494 -7574 12436 -9427 -12695 11562 -4726 6559 -3934 -3793 -4742 10262 SS 20201230T035427.9Z 7669.162823 143 1 49.73 2 81.17 111.55 100.21 293.25 0.00 1 0.00 1 0 25 5.150e-01 1.619e-02 3.343e-01 9.652e-03 6.545820e-01 5.350586e-03 6.374557e-03 -6.000000e+00 2.961057e-01 227.75 -2.00 3.06 -2.00 321.57 0.00e+00 1.481769e-03 2.809870e-03 2.248188e-03 -6.000000e+00 1.408420e-02 281.89 -2.00 20.00 -2.00 321.03 0.00e+00 6.170 0.001 302.00 328.00 3 2.9410e+00 1.9245e-02 6.0080e-02 -6.0000e+00 7.3573e-01 3.9257e-02 2.7211e-02 3.6384e-02 -6.0000e+00 8.0147e-01 -1.3430e-01 2.8197e-02 1.6676e-02 -6.0000e+00 4.7509e-01 5.1988e-02 1.3189e-02 5.5707e-03 -6.0000e+00 2.0370e-01 9.8954e-05 -3.1559e-04 2.8663e-04 6.0800e-05 -6.0000e+00 1.4218e-02 5.3802e-03 12 8 8 10 0 0 -10.11 19.33 0.44 0.00538 0.00301 39 8 4 8 0 1274.810 14.99 19.33 22.41 21.58 21.58 14.4 925.72 900000 -134547 900000 -208059 900000 -241067 900000 -100823 294953 -181951 -141316 900000 -28955 900000 -44729 900000 -26374 112552 -94730 3704 -17372 23311 -66861 900000 4598 37977 -23393 -82259 -14650 -1092 102111 -24963 66073 -29631 11048 -21719 -38503 -15401 21919 54959 -7859 50624 -13729 28147 -667 41960 -5736 21095 -16745 7738 10684 4321 12530 4643 -4993 -7998 14051 -2786 15965 -5734 16344 -3892 12335 7087 2789 1298 5002 7192 -5086 6463 -2444 2573 -4859 8150 -442 8787 5365 9085 3542 -1576 3052 -1871 -2655 -2311 -976 -975 1802 363 1707 112 -452 -1652 2667 1338 -2011 -187 -770 1297 -2416 1124 -486 1118 -1093 2885 -1753 -116 -6736 -2005 266 -1357 623 -1255 836 -221 1011 238 2343 -116 87 -871 -855 685 -66 410 143 1084 1664 2976 522 755 738 154 674 -367 -284 -588 228 -920 445 -856 388 -520 383 900000 -1265 900000 -3040 900000 -4490 900000 -948 2772 -2991 -1666 900000 -272 900000 -481 900000 -319 1058 -2651 42 -250 228 -1662 900000 69 439 -495 -2976 -275 -20 960 -806 1023 -1216 297 -800 -1854 -713 873 1900 -556 2197 -1159 1630 -52 2219 -490 1444 -1735 681 1022 493 1452 631 -791 -1363 1998 -465 2163 -947 2267 -724 2231 1519 651 300 1106 1619 -1437 1890 -856 893 -1789 2504 -135 2214 1314 2195 1024 -567 1223 -896 -1402 -1293 -574 -612 1165 243 1129 72 -275 -957 1434 759 -1326 -140 -669 1257 -2626 1181 -485 989 -915 2362 -1624 -112 -7300 -2223 316 -1833 909 -1972 1287 -332 1424 324 3175 -168 134 -1405 -1369 1043 -98 586 199 1442 2128 3942 800 1294 1380 307 1400 -817 -671 -1468 578 -2391 1139 -2141 903 -1153 821 SS 20201230T040759.0Z 7669.172211 148 1 50.05 2 78.36 110.19 102.87 291.97 0.00 1 0.00 1 0 25 1.749e-01 6.647e-03 1.015e-01 2.537e-03 5.410173e-01 1.319768e-03 5.408483e-03 -6.000000e+00 9.924105e-02 227.75 -2.00 3.06 -2.00 320.82 0.00e+00 2.493801e-03 5.484154e-04 9.145743e-04 -6.000000e+00 4.385788e-03 281.89 -2.00 20.00 -2.00 320.21 0.00e+00 4.803 0.001 302.00 328.00 3 2.1685e+00 4.1990e-03 4.6633e-02 -6.0000e+00 2.4667e-01 -8.4048e-03 5.4331e-03 2.6864e-02 -6.0000e+00 2.6811e-01 -1.4016e-02 5.2083e-03 1.2748e-02 -6.0000e+00 1.5963e-01 -4.7028e-03 2.5800e-03 4.9744e-03 -6.0000e+00 6.7702e-02 6.7452e-04 -7.0393e-04 7.3641e-05 4.7899e-05 -6.0000e+00 4.6772e-03 4.7853e-03 11 9 0 11 8 0 -4.69 19.33 0.27 0.00479 -0.00050 133 29 4 8 0 370.700 15.00 19.33 23.88 21.58 21.58 14.5 932.95 -82049 -82745 29434 -71330 -16632 -58532 -41127 -64402 -40988 -42656 -17016 -28689 -53047 -2384 -28323 38679 -22402 11373 -17723 -6534 -18745 1032 -25449 -1497 -4334 -5842 4126 -14874 -1909 -4431 -5631 -6838 10981 -7235 -4084 -1890 -1245 -6110 4209 -2057 -3871 -708 -2929 1912 -3139 2187 -2140 1815 1382 2305 1585 1803 2606 636 2383 1355 276 -1230 1654 -845 1546 -789 2111 1783 831 1661 2117 1347 1767 1584 347 353 -874 932 -1090 774 -782 619 554 -348 -469 -836 -1814 -1493 -833 -1603 -55 -765 61 -108 808 746 1116 2154 1247 771 696 512 -811 -66 -603 143 1047 672 -1596 -822 -1215 -674 262 -321 -334 -545 -6 103 710 1175 833 479 13 -811 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