File name: Pandora25s1_HoustonTX_20240522_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20240928T011931.1Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 Local principal investigator: Jimmy Flynn Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 25 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora25_OF_v7d20190903.txt Instrument calibration file used: Pandora25s1_CF_v6d20220503.txt Level 1 file used: Pandora25s1_HoustonTX_20240522_L1_smca1c6d20220503p1-8.txt Full location name: University Of Houston Short location name: HoustonTX Country of location: United States Location latitude [deg]: 29.7200 Location longitude [deg]: -95.3400 Location altitude [m]: 19 Local noon date: 20240522 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are latency correction, matrix method stray light correction (replaced by simple method) Data caveats: Update session 4 for SO2 First and last pixel inside fitting window: 281 423 Nominal wavelengths inside fitting window [nm]: 305.1116 305.2524 305.3931 305.5338 305.6745 305.8152 305.9558 306.0965 306.2371 306.3777 306.5183 306.6589 306.7995 306.9401 307.0806 307.2212 307.3617 307.5022 307.6427 307.7832 307.9236 308.0641 308.2045 308.3449 308.4853 308.6257 308.7661 308.9065 309.0468 309.1872 309.3275 309.4678 309.6081 309.7484 309.8886 310.0289 310.1691 310.3093 310.4495 310.5897 310.7299 310.8701 311.0102 311.1504 311.2905 311.4306 311.5707 311.7108 311.8509 311.9909 312.1310 312.2710 312.4110 312.5510 312.6910 312.8310 312.9709 313.1109 313.2508 313.3907 313.5306 313.6705 313.8104 313.9503 314.0901 314.2300 314.3698 314.5096 314.6494 314.7892 314.9290 315.0687 315.2085 315.3482 315.4879 315.6276 315.7673 315.9070 316.0466 316.1863 316.3259 316.4656 316.6052 316.7448 316.8843 317.0239 317.1635 317.3030 317.4425 317.5821 317.7216 317.8611 318.0005 318.1400 318.2794 318.4189 318.5583 318.6977 318.8371 318.9765 319.1159 319.2552 319.3946 319.5339 319.6732 319.8125 319.9518 320.0911 320.2304 320.3696 320.5089 320.6481 320.7873 320.9265 321.0657 321.2049 321.3441 321.4832 321.6223 321.7615 321.9006 322.0397 322.1788 322.3178 322.4569 322.5960 322.7350 322.8740 323.0130 323.1520 323.2910 323.4300 323.5689 323.7079 323.8468 323.9857 324.1246 324.2635 324.4024 324.5413 324.6801 324.8190 324.9578 --------------------------------------------------------------------------------------- Column 1: Two letter code of measurement routine Column 2: UT date and time for center-time of measurement, yyyymmddThhmmssZ (ISO 8601) Column 3: Fractional days since 1-Jan-2000 midnight for center-time of measurement Column 4: Routine count (1 for the first routine of the day, 2 for the second, etc.) Column 5: Repetition count (1 for the first set in the routine, 2 for the second, etc.) Column 6: Total duration of measurement set in seconds Column 7: Data processing type index Column 8: Solar zenith angle for center-time of measurement in degree Column 9: Solar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 10: Lunar zenith angle for center-time of measurement in degree Column 11: Lunar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 12: Pointing zenith angle in degree, absolute or relative (see next column), 999=tracker not used Column 13: Zenith pointing mode: zenith angle is... 0=absolute, 1=relative to sun, 2=relative to moon Column 14: Pointing azimuth in degree, increases clockwise, absolute (0=north) or relative (see next column), 999=tracker not used Column 15: Azimuth pointing mode: like zenith angle mode but also fixed scattering angles relative to sun (3) or moon (4) Column 16: Fitting result index: 0=no error or warning, 1, 2=warning, >2=error Column 17: Number of function evaluations used, 0=linear fitting or fitting not successful or no fitting done Column 18: rms of unweighted fitting residuals, -9=fitting not successful Column 19: Normalized rms of fitting residuals weighted with independent uncertainty, -9=fitting not successful or no uncertainty used Column 20: Expected rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 21: Expected normalized weighted rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 22: Ozone slant column amount [moles per square meter], -9e99=fitting not successful Column 23: Independent uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 24: Structured uncertainty of ozone slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 25: Common uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 26: rms-based uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 27: Ozone effective temperature [K] Column 28: Independent uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 29: Structured uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 30: Common uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 31: Effective ozone fitting wavelength [nm], -9=fitting not successful Column 32: Diffuse correction applied before fitting at effective fitting wavelength for ozone [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 33: Sulfur dioxide slant column amount [moles per square meter], -9e99=fitting not successful Column 34: Independent uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 35: Structured uncertainty of sulfur dioxide slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 36: Common uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 37: rms-based uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 38: Sulfur dioxide effective temperature [K] Column 39: Independent uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 40: Structured uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 41: Common uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 42: Effective sulfur dioxide fitting wavelength [nm], -9=fitting not successful Column 43: Diffuse correction applied before fitting at effective fitting wavelength for sulfur dioxide [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 44: Molecular scattering air mass factor used for molecular scattering subtraction before the fitting Column 45: Estimated uncertainty of molecular scattering air mass factor, -9=molecular scattering was not subtracted before the fitting Column 46: Lower limit used for wavelength scaling [nm] Column 47: Upper limit used for wavelength scaling [nm] Column 48: Order of smoothing polynomial Column 49: Smoothing polynomial coefficient, order 0 Column 50: Independent uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 51: Structured uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 52: Common uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 53: rms-based uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 54: Smoothing polynomial coefficient, order 1 Column 55: Independent uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 56: Structured uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 57: Common uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 58: rms-based uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 59: Smoothing polynomial coefficient, order 2 Column 60: Independent uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 61: Structured uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 62: Common uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 63: rms-based uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 64: Smoothing polynomial coefficient, order 3 Column 65: Independent uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 66: Structured uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 67: Common uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 68: rms-based uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 69: Mean value of measured data inside fitting window [same units as measurements] Column 70: Wavelength change polynomial coefficient, order 0 Column 71: Independent uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 72: Structured uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 73: Common uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 74: rms-based uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 75: L1 based wavelength change coefficient, order 0, -9=no L1 wavelength change determination Column 76: L1 based wavelength change coefficient, order 1, -9=no L1 wavelength change determination Column 77: L2Fit data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 78: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ1 limit, 0=L1 data quality above 0, 1=Spectral fitting was not successful, 2=Wavelength shift too large, 3=Normalized rms of fitting residuals weighted with independent uncertainty too large Column 79: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 80: L1 data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 81: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ1 limit, 0=Saturated data, 1=Too few dark counts measurements, 2=No temperature given or effective temperature too different from the reference temperature, 3=Dark count too high, 4=Unsuccessful dark background fitting, 5=The dark count differs significantly from the dark map for too many pixels, 6=Absolute value of estimated average residual stray light level too high, 7=Although attempted, no wavelength change could be retrieved, 8=Absolute value of retrieved wavelength shift too large, 9=Retrieved wavelength shift differs too much from the shift predicted by the effective temperature Column 82: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 83: Atmospheric variability [%], 999=no atmospheric variability was determined Column 84: Wavelength effective temperature [°C], 999=no effective temperature given Column 85: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 86: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 87: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 88: Number of bright count cycles Column 89: Number of dark count cycles Column 90: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 91: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 92: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 93: Integration time [ms] Column 94: Temperature at electronics board [°C], 999=no temperature signal Column 95: Spectrometer control temperature [°C], 999=no temperature signal Column 96: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 97: Temperature in head sensor [°C], 999=no temperature signal Column 98: Humidity in head sensor [%], -9=no humidity signal Column 99: Pressure in head sensor [hPa], -9=no pressure signal Columns 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: Normalized slant column residuals weighted with independent instrumental uncertainty for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting, 0=no independent instrumental uncertainty was given --------------------------------------------------------------------------------------- SS 20240522T133843.1Z 8908.568555 243 1 10.65 2 62.99 80.64 129.02 266.21 0.00 1 0.00 1 0 17 5.604e-02 9.736e-03 1.387e-02 4.298e-03 2.823435e-01 2.206288e-03 3.149642e-03 -6.000000e+00 3.252903e-02 231.00 -2.00 3.24 -2.00 317.23 0.00e+00 -1.151368e-03 3.155277e-04 7.800747e-05 -6.000000e+00 1.464778e-03 290.75 -2.00 20.00 -2.00 316.35 0.00e+00 2.190 0.000 302.00 328.00 3 4.9253e+00 5.8519e-03 2.5838e-02 -6.0000e+00 8.1235e-02 -2.4111e-03 6.5735e-03 1.3836e-02 -6.0000e+00 8.7782e-02 1.4599e-02 3.9343e-03 6.6682e-03 -6.0000e+00 5.2408e-02 -9.8361e-03 1.9415e-03 2.1159e-03 -6.0000e+00 2.2378e-02 3.0796e-04 -1.7142e-03 1.2331e-04 2.2791e-05 -6.0000e+00 1.5251e-03 -3.6069e-02 -9.1869e-05 12 9 9 12 9 1 97.61 24.47 0.19 -0.03607 -0.04895 3 4 1 5 0 2660.750 26.94 19.99 24.47 35.49 32.2 1100.00 6451 154 -7158 -647 -10765 -4579 19150 729 11605 -4284 -3138 935 -7723 -6274 -754 56352 2057 -60 -1221 -1687 2790 -2811 -5600 4430 -1866 -1130 -2280 1011 -496 -966 6101 422 -98 -1009 -3049 1501 -6167 3511 -940 -1405 11 -263 -626 628 285 -660 -1066 -1694 816 553 787 -965 81 2413 336 322 609 142 492 205 1316 898 -127 1393 6 15 -1 -1390 302 -186 130 699 228 35 858 840 -411 -485 -436 -714 -416 -850 -802 -1280 -1216 -319 -227 -565 121 937 -28 496 193 374 249 1116 528 1201 877 -1004 174 -1440 212 -810 385 -980 -900 -539 237 -65 129 389 -87 -78 126 86 -313 -46 233 45 -646 -403 649 295 598 632 -5 231 717 200 -303 -9 -117 152 4 -114 12 593 20 -110 -93 -48 -840 633 17 -887 -71 -1176 -459 1653 84 1352 -609 -440 130 -1295 -1176 -152 7420 460 -14 -303 -435 705 -744 -1561 1201 -563 -352 -718 294 -138 -266 1667 130 -32 -347 -1015 474 -2233 1341 -433 -734 6 -152 -372 372 169 -394 -631 -991 463 317 469 -617 54 1640 238 232 446 105 356 148 960 690 -105 1188 5 12 -1 -1079 242 -163 121 670 220 33 771 704 -324 -369 -340 -604 -382 -839 -829 -1372 -1360 -371 -273 -698 150 1129 -33 542 200 377 259 1232 627 1515 1158 -1338 222 -1768 248 -963 477 -1273 -1203 -741 333 -95 196 598 -132 -115 175 116 -416 -62 328 66 -973 -605 953 425 834 858 -6 303 970 284 -447 -14 -178 236 6 -189 20 1014 35 -189 -156 -78 -1362 SS 20240522T134306.5Z 8908.571603 246 1 49.52 2 62.05 81.10 129.93 266.68 0.00 1 0.00 1 0 17 1.540e-02 5.515e-03 5.073e-03 1.476e-03 2.769919e-01 7.559229e-04 3.067185e-03 -6.000000e+00 8.947982e-03 231.00 -2.00 3.24 -2.00 317.52 0.00e+00 3.789670e-05 1.164354e-04 6.271543e-05 -6.000000e+00 4.026925e-04 290.75 -2.00 20.00 -2.00 316.63 0.00e+00 2.122 0.000 302.00 328.00 3 4.4872e+00 2.0164e-03 2.5116e-02 -6.0000e+00 2.2346e-02 5.3944e-03 2.2713e-03 1.3447e-02 -6.0000e+00 2.4137e-02 5.4008e-03 1.3707e-03 6.5061e-03 -6.0000e+00 1.4411e-02 -6.4646e-03 6.8186e-04 1.7849e-03 -6.0000e+00 6.1596e-03 5.1111e-04 -3.0915e-04 4.2970e-05 2.0341e-05 -6.0000e+00 4.1874e-04 -3.7635e-02 1.4976e-04 10 0 0 10 0 0 99.98 24.46 0.23 -0.03764 -0.03996 114 24 1 5 0 434.290 26.94 19.99 24.46 35.72 32.2 1100.00 -6960 1741 -5015 3096 -4665 -4763 4157 -1566 4390 -154 -2640 -424 -4127 -1993 -1700 7363 808 897 525 343 -539 -908 -1869 -463 -1174 -207 -499 253 -263 -632 1982 1609 1234 581 -2705 -835 -917 1678 -139 -1210 -893 -630 -689 -83 430 -36 -866 -990 483 -1235 749 -94 446 1154 922 1153 1151 -77 491 396 353 632 1317 1188 415 -81 -484 -681 289 327 405 448 209 65 813 642 -812 -1030 -101 -541 -958 -1034 -1794 -1224 -1068 -825 -156 244 88 811 393 630 203 110 56 383 444 638 491 -210 -194 -1023 -715 -342 -1 -671 -406 -882 -37 330 187 470 193 132 -222 -6 -78 -115 -147 17 -398 -172 291 287 213 557 15 809 539 293 393 -42 1 428 97 -37 -4 270 66 -220 -321 -610 -398 -714 180 -564 306 -446 -440 376 -167 492 -19 -330 -53 -601 -324 -312 1360 166 191 117 79 -128 -215 -457 -118 -317 -58 -139 67 -66 -156 505 444 368 179 -815 -243 -288 592 -58 -585 -465 -341 -383 -46 239 -20 -480 -540 257 -671 419 -56 279 749 616 785 796 -54 336 270 247 465 1031 980 346 -64 -363 -502 221 275 366 420 197 59 707 517 -611 -746 -75 -439 -856 -998 -1833 -1291 -1180 -958 -188 299 109 976 452 678 206 108 57 419 525 809 653 -281 -248 -1248 -834 -403 -2 -874 -546 -1226 -52 492 290 738 299 196 -313 -8 -104 -157 -210 25 -610 -262 435 419 301 760 20 1059 735 421 586 -64 1 677 160 -62 -6 476 117 -388 -554 -1031 -660 SS 20240522T134828.9Z 8908.575335 249 1 49.63 2 60.89 81.67 131.06 267.25 0.00 1 0.00 1 0 17 7.410e-03 4.716e-03 1.822e-03 6.953e-04 2.643707e-01 3.570670e-04 2.932699e-03 -6.000000e+00 4.306420e-03 231.00 -2.00 3.24 -2.00 316.87 0.00e+00 1.717437e-04 4.680006e-05 4.626952e-05 -6.000000e+00 1.938194e-04 290.75 -2.00 20.00 -2.00 316.01 0.00e+00 2.046 0.000 302.00 328.00 3 3.3445e+00 9.4172e-04 2.4122e-02 -6.0000e+00 1.0754e-02 -1.1380e-02 1.0543e-03 1.2789e-02 -6.0000e+00 1.1617e-02 1.7023e-03 6.1745e-04 6.1922e-03 -6.0000e+00 6.9358e-03 -3.1767e-03 2.9791e-04 1.7063e-03 -6.0000e+00 2.9643e-03 1.7782e-03 -3.1061e-04 1.9963e-05 1.9824e-05 -6.0000e+00 2.0156e-04 -3.7499e-02 1.3045e-04 10 0 0 10 0 0 100.00 24.45 0.18 -0.03750 -0.03983 172 36 1 5 0 288.470 26.94 20.00 24.45 36.12 32.2 1100.00 -1289 -1257 -92 -1320 -2140 -2212 -89 -275 1276 558 -2513 -441 -2279 -386 -695 -3 -116 703 54 995 1042 90 -190 204 256 293 574 -261 348 -287 1470 1146 1654 -32 -1670 -1236 -1866 -318 -846 -520 -885 -516 -534 -363 -228 -60 -762 -436 -603 -179 606 445 653 793 554 735 790 413 540 378 631 624 1220 1265 703 -162 -348 -757 118 616 106 458 28 241 388 246 -631 -808 -341 -558 -826 -930 -1467 -1429 -926 -660 -238 1 306 492 579 329 240 110 376 244 426 640 249 -112 -329 -695 -623 -110 -267 -707 -504 -574 -179 226 186 252 164 47 -192 97 169 111 81 108 -259 1 -1 91 220 514 137 723 612 491 337 37 -70 82 54 117 -142 137 15 -220 -216 -457 -444 -175 -187 -14 -187 -273 -271 -11 -40 202 94 -431 -76 -450 -80 -166 -1 -32 198 16 302 302 26 -57 64 85 101 197 -85 112 -92 459 389 606 -12 -611 -440 -729 -135 -409 -293 -520 -317 -337 -232 -145 -38 -478 -266 -362 -107 381 301 444 568 411 557 610 319 409 285 489 494 1043 1102 617 -139 -278 -590 96 542 99 445 28 227 357 214 -500 -637 -277 -486 -777 -926 -1510 -1544 -1021 -780 -284 2 380 590 670 364 253 112 398 273 508 814 327 -147 -424 -828 -725 -130 -329 -896 -667 -796 -251 324 283 378 248 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