File name: Pandora159s1_Wakkerstroom_20211225_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20251121T035252.0Z 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_20211225_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: 20211225 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 20211225T041039.4Z 8029.174067 195 1 15.22 2 77.16 109.91 46.18 327.98 0.00 1 0.00 1 0 25 1.428e-01 7.377e-03 7.851e-02 2.546e-03 5.134065e-01 1.304702e-03 5.210966e-03 -6.000000e+00 8.114769e-02 227.80 -2.00 3.06 -2.00 320.17 0.00e+00 3.272961e-03 4.490100e-04 8.859808e-04 -6.000000e+00 3.580201e-03 281.63 -2.00 20.00 -2.00 319.54 0.00e+00 4.386 0.000 302.00 328.00 3 1.8539e+00 3.8678e-03 4.3010e-02 -6.0000e+00 2.0174e-01 5.2491e-02 4.7596e-03 2.5310e-02 -6.0000e+00 2.1919e-01 -2.0117e-02 4.2632e-03 1.1877e-02 -6.0000e+00 1.3048e-01 -1.8470e-03 2.1874e-03 5.2688e-03 -6.0000e+00 5.5395e-02 1.2516e-03 -8.6705e-04 7.1901e-05 4.2978e-05 -6.0000e+00 3.8184e-03 -3.7470e-03 12 9 1 12 1 1 99.99 19.08 0.35 -0.00375 -0.01026 73 54 2 8 0 197.840 15.00 19.08 20.09 21.38 21.38 19.1 890.59 -67437 658 -64999 16441 -68364 73740 -46159 -34510 -9426 -25472 -27491 -12677 28543 -25606 2539 -13686 19764 -14050 11753 -3405 6227 -2565 -3807 -5803 -2354 1025 -12830 7234 -16611 15981 -10724 6195 -3269 3651 -2060 -1591 -2209 -2489 398 -1343 1496 -4133 1146 -4319 4521 -2842 2960 577 -207 122 1534 1378 671 2634 -393 1272 -756 658 -657 3017 479 1798 368 1048 -150 1460 1868 854 2598 -596 1062 -1499 28 -929 624 -261 962 494 862 311 -535 -361 -2593 -1135 -1441 -455 -915 19 -351 -75 661 903 1174 1393 1788 472 1139 262 -151 -779 47 -367 942 581 -1148 -1062 -995 -479 -443 21 -699 -32 -144 310 476 1244 991 173 -85 -957 -864 -275 381 -491 848 -71 1263 1588 562 91 301 55 -65 294 -464 -266 1 113 -676 -61 -124 -34 330 -1031 6 -1199 136 -1174 316 -663 -510 -122 -409 -466 -208 380 -718 66 -486 566 -598 422 -148 257 -115 -180 -297 -125 55 -806 365 -1027 772 -757 432 -282 311 -178 -135 -207 -278 52 -209 253 -791 218 -878 864 -596 593 120 -45 28 369 367 193 800 -129 426 -265 227 -224 978 165 669 154 476 -72 666 815 380 1227 -330 636 -950 17 -558 344 -132 448 229 429 180 -356 -267 -2082 -948 -1273 -426 -895 19 -351 -73 601 766 946 1126 1560 465 1242 318 -198 -1022 58 -418 1001 621 -1332 -1289 -1266 -636 -620 31 -1139 -54 -237 496 716 1782 1439 261 -135 -1586 -1435 -446 598 -759 1251 -102 1738 2228 862 150 532 101 -123 576 -960 -571 2 249 -1494 -133 -258 -69 646 SS 20211225T041603.6Z 8029.177819 197 1 50.55 2 76.04 109.38 46.80 326.41 0.00 1 0.00 1 0 25 5.216e-02 6.171e-03 2.041e-02 9.305e-04 4.763095e-01 4.770906e-04 4.872219e-03 -6.000000e+00 2.963632e-02 227.80 -2.00 3.06 -2.00 320.04 0.00e+00 2.933573e-03 1.559829e-04 7.692417e-04 -6.000000e+00 1.307538e-03 281.63 -2.00 20.00 -2.00 319.40 0.00e+00 4.054 0.000 302.00 328.00 3 1.2021e+00 1.4002e-03 3.9768e-02 -6.0000e+00 7.3680e-02 3.9807e-02 1.6980e-03 2.3339e-02 -6.0000e+00 8.0051e-02 -1.4157e-02 1.4583e-03 1.0979e-02 -6.0000e+00 4.7652e-02 -3.9392e-03 7.5384e-04 4.7288e-03 -6.0000e+00 2.0231e-02 3.2699e-03 -7.9783e-04 2.6748e-05 4.0533e-05 -6.0000e+00 1.3945e-03 -3.7898e-03 11 1 0 11 8 0 97.09 19.08 0.20 -0.00379 -0.00979 360 77 2 8 0 136.600 15.00 19.08 20.55 21.38 21.38 19.2 893.85 -5926 -30642 -1640 -21031 -15758 -22638 -16928 -17643 -15093 -10594 -12478 -1179 -11635 -2170 -5705 -1394 -6099 3473 -4209 427 -3402 -646 1311 -1364 -1175 -4704 -2512 -4465 763 -568 1096 -710 1120 -4178 -1340 -406 -1899 -360 -1840 -1424 -3555 -1441 -2525 -1006 -771 -746 -272 326 -71 1163 1368 1210 1812 834 944 392 464 38 540 592 1746 1451 1286 1062 -182 1360 863 1316 1478 881 -35 -109 -338 110 -301 516 715 772 1286 -317 -510 -1229 -1869 -1099 -965 -904 -441 -573 -90 -70 625 967 1044 2012 1249 951 627 363 -737 -398 -308 -83 908 739 -1154 -998 -620 -835 -43 -196 -312 -403 -74 223 459 1151 829 561 39 -747 -921 -273 -222 -151 512 321 1086 1649 341 184 138 4 137 276 -333 -441 34 56 -458 -116 8 -201 258 -64 -488 -21 -311 -201 -301 -228 -272 -255 -183 -225 -21 -276 -58 -194 -53 -267 150 -210 21 -182 -34 69 -79 -73 -319 -168 -294 46 -36 78 -60 105 -437 -130 -38 -200 -44 -280 -255 -725 -307 -568 -228 -176 -174 -64 77 -17 288 368 359 531 264 313 135 163 13 185 219 660 551 548 499 -89 627 381 581 711 489 -22 -70 -216 67 -169 258 327 379 626 -182 -339 -924 -1534 -944 -883 -885 -453 -608 -95 -71 585 832 841 1605 1096 951 715 432 -958 -513 -371 -98 979 812 -1397 -1180 -765 -1093 -60 -300 -519 -698 -126 359 684 1614 1165 826 62 -1252 -1556 -446 -351 -229 739 444 1542 2374 506 302 245 8 263 515 -667 -933 73 124 -1012 -247 17 -388 516 SS 20211225T042137.4Z 8029.181683 200 1 13.09 2 74.87 108.85 47.47 324.84 0.00 1 0.00 1 0 25 3.317e-02 6.653e-03 1.915e-02 1.451e-03 4.445863e-01 7.311683e-04 4.578043e-03 -6.000000e+00 1.884471e-02 227.80 -2.00 3.06 -2.00 319.32 0.00e+00 1.962022e-03 1.916728e-04 3.784791e-04 -6.000000e+00 8.314022e-04 281.63 -2.00 20.00 -2.00 318.63 0.00e+00 3.760 0.000 302.00 328.00 3 1.4954e+00 2.0514e-03 3.6655e-02 -6.0000e+00 4.6851e-02 3.6976e-02 2.3978e-03 2.0678e-02 -6.0000e+00 5.0901e-02 -1.5414e-02 1.8661e-03 1.0020e-02 -6.0000e+00 3.0300e-02 -7.8268e-04 9.8584e-04 3.5142e-03 -6.0000e+00 1.2865e-02 3.1971e-03 -6.9590e-04 4.1052e-05 3.3632e-05 -6.0000e+00 8.8671e-04 -4.0427e-03 12 9 1 12 1 1 99.97 19.08 0.28 -0.00404 -0.00927 77 66 2 8 0 159.400 14.99 19.08 21.03 21.38 21.38 19.2 895.43 -20404 -2641 -10510 -2470 -14902 -8427 -8762 -5140 -2557 -13361 -3825 -8842 2841 -8878 3562 -4948 -311 -412 -68 -1089 -91 -1922 -275 -1067 -2897 487 -4811 220 -1398 4366 -940 2649 172 -2504 -1721 309 -1777 -1149 -14 -1848 -1881 -1691 -759 -1977 -175 -364 -700 -613 -284 993 624 1243 1003 1245 426 1382 -448 359 -163 1036 1660 1407 1273 1031 -149 647 761 929 2174 439 117 -426 -9 -360 -140 798 233 745 913 -82 -524 -1195 -2343 -945 -1216 -848 -498 -481 -274 -302 865 480 1162 1823 1602 789 944 219 -745 -545 -281 -83 764 711 -1271 -816 -816 -614 -172 -3 -479 -348 -118 293 524 1251 627 440 243 -808 -872 -314 -257 -90 798 336 1045 1506 464 271 116 143 -48 319 -245 -365 11 69 -705 -216 -89 -31 219 -459 -57 -257 -53 -332 -187 -191 -123 -67 -416 -111 -291 99 -428 183 -318 -21 -30 -5 -89 -8 -162 -23 -99 -293 50 -523 22 -136 412 -105 328 25 -385 -250 43 -278 -212 -3 -453 -512 -489 -226 -608 -53 -113 -218 -192 -89 321 219 477 416 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