File name: Pandora257s1_AustinTX_20240729_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20240730T064443.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Paul Walter Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 257 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora257_OF_v3d20221216.txt Instrument calibration file used: Pandora257s1_CF_v2d20230110.txt Level 1 file used: Pandora257s1_AustinTX_20240729_L1_smca1c2d20230110p1-8.txt Full location name: St. Edward's University Short location name: AustinTX Country of location: United States Location latitude [deg]: 30.2285 Location longitude [deg]: -97.7544 Location altitude [m]: 205 Local noon date: 20240729 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: OOB session based on clearance session 1 First and last pixel inside fitting window: 228 370 Nominal wavelengths inside fitting window [nm]: 305.0779 305.2183 305.3587 305.4991 305.6395 305.7799 305.9203 306.0607 306.2010 306.3413 306.4817 306.6220 306.7623 306.9026 307.0429 307.1832 307.3234 307.4637 307.6039 307.7442 307.8844 308.0246 308.1648 308.3050 308.4452 308.5854 308.7255 308.8657 309.0058 309.1459 309.2860 309.4261 309.5662 309.7063 309.8464 309.9865 310.1265 310.2665 310.4066 310.5466 310.6866 310.8266 310.9666 311.1065 311.2465 311.3865 311.5264 311.6663 311.8062 311.9461 312.0860 312.2259 312.3658 312.5057 312.6455 312.7854 312.9252 313.0650 313.2048 313.3446 313.4844 313.6242 313.7639 313.9037 314.0434 314.1832 314.3229 314.4626 314.6023 314.7420 314.8816 315.0213 315.1610 315.3006 315.4402 315.5799 315.7195 315.8591 315.9986 316.1382 316.2778 316.4173 316.5569 316.6964 316.8359 316.9754 317.1149 317.2544 317.3939 317.5334 317.6728 317.8123 317.9517 318.0911 318.2305 318.3699 318.5093 318.6487 318.7880 318.9274 319.0667 319.2061 319.3454 319.4847 319.6240 319.7633 319.9025 320.0418 320.1810 320.3203 320.4595 320.5987 320.7379 320.8771 321.0163 321.1555 321.2946 321.4338 321.5729 321.7121 321.8512 321.9903 322.1294 322.2685 322.4075 322.5466 322.6856 322.8247 322.9637 323.1027 323.2417 323.3807 323.5197 323.6587 323.7976 323.9366 324.0755 324.2144 324.3533 324.4922 324.6311 324.7700 324.9089 --------------------------------------------------------------------------------------- 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 20240729T123546.7Z 8976.524846 227 1 8.63 2 81.15 73.63 14.02 120.80 0.00 1 0.00 1 0 25 7.114e-01 5.748e-02 3.722e-01 3.387e-02 6.012549e-01 2.187523e-02 7.080787e-03 -6.000000e+00 4.688081e-01 229.86 -2.00 3.25 -2.00 321.40 0.00e+00 2.967872e-02 1.057941e-02 8.563533e-03 -6.000000e+00 3.124873e-02 293.31 -2.00 20.00 -2.00 320.70 0.00e+00 6.141 0.003 302.00 328.00 3 3.4837e+00 7.6384e-02 9.0747e-02 -6.0000e+00 1.1622e+00 8.0792e-01 9.6642e-02 9.4696e-02 -6.0000e+00 1.2653e+00 -1.0393e+00 6.8237e-02 1.4968e-02 -6.0000e+00 7.5082e-01 4.3608e-01 3.3046e-02 2.2661e-02 -6.0000e+00 3.1666e-01 1.8005e-05 -2.4991e-02 1.2273e-03 1.7083e-04 -6.0000e+00 2.6997e-02 8.6001e-02 -4.1140e-03 12 9 9 12 9 1 99.99 28.37 1.34 0.08600 -0.10179 3 2 1 5 0 2156.970 36.25 20.00 28.37 31.37 0.0 977.26 900000 88185 900000 900000 -41741 -90676 117962 900000 900000 210185 900000 165364 -74658 900000 900000 312174 210367 900000 900000 900000 900000 87730 900000 900000 900000 -68639 -28696 900000 217062 300591 3022 218980 30227 900000 -38041 900000 -47753 17538 74654 900000 86884 900000 900000 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727 5528 -14049 -3204 4426 -908 4526 -11221 921 3741 -1178 -5000 507 6108 1232 -16010 -3991 -2283 1807 2472 6528 7522 -3226 -3363 -2411 3007 -3350 721 -1613 1164 -10992 -1233 7826 1962 7656 4278 960 -1364 7353 -2551 673 -2797 -2577 654 -6152 5103 -5141 641 14714 2591 -7711 6982 -3124 1911 -6525 -4359 -2045 7968 -2777 -1901 -904 -2291 -2836 10156 4200 -4717 -1527 900000 SS 20240729T124623.4Z 8976.532215 232 1 2.32 2 78.94 74.86 12.13 127.41 0.00 1 0.00 1 0 17 3.935e-01 1.777e-02 2.952e-01 1.136e-02 5.991046e-01 6.525960e-03 6.848099e-03 -6.000000e+00 2.528123e-01 229.86 -2.00 3.25 -2.00 320.44 0.00e+00 -7.866165e-05 2.708351e-03 4.063286e-03 -6.000000e+00 1.281621e-02 293.31 -2.00 20.00 -2.00 319.66 0.00e+00 5.026 0.002 302.00 328.00 3 2.3337e+00 2.0775e-02 6.0479e-02 -6.0000e+00 6.2869e-01 7.7010e-02 2.6359e-02 4.0357e-02 -6.0000e+00 6.7999e-01 -1.1269e-01 2.2089e-02 1.5163e-02 -6.0000e+00 4.0619e-01 3.8459e-02 1.0938e-02 5.2253e-03 -6.0000e+00 1.6926e-01 2.0607e-04 -6.0895e-04 3.8058e-04 6.7725e-05 -6.0000e+00 1.4340e-02 2.9769e-02 -3.5740e-04 12 9 9 12 1 1 98.09 28.36 0.45 0.02977 0.02519 3 9 1 5 0 578.310 36.25 20.00 28.36 31.70 0.0 979.73 900000 -75158 -31205 900000 -137303 -133643 -162903 -187771 -107820 -142442 900000 -30543 76423 -13472 26312 49113 22620 900000 26088 159045 900000 -24892 77492 64468 8311 -6207 35274 19966 30396 -8965 6211 -41309 -23585 15176 -2726 98868 -20751 2103 21937 -210 -4398 6438 25965 -1510 2960 1954 -8613 -7564 -3532 4592 931 17562 -1213 13924 4232 6350 1807 7321 -4325 -7815 4717 300 20694 818 -2410 1038 9560 7581 6779 2368 3939 4399 97 -364 -5285 -2713 -1560 -1548 -1026 -6653 -3280 -474 -5124 -1761 -930 -1718 -2413 -1160 3120 1337 -2753 -109 -1538 1555 155 1774 157 -286 -645 -1360 -658 -258 -989 1231 454 -1117 -925 -88 395 877 136 1451 -162 843 173 444 737 1276 -208 485 -59 -20 136 1543 -407 -489 1151 -1022 641 799 -1149 -550 -1388 48 -434 86 -195 732 340 -647 -190 92 443 900000 -832 -345 900000 -2349 -2286 -4098 -6802 -1953 -4013 900000 -369 846 -224 349 598 401 900000 520 1760 900000 -937 1115 1142 276 -247 937 619 875 -417 282 -3429 -1801 823 -181 2517 -1975 189 1918 -26 -643 905 3132 -246 469 318 -1592 -1432 -676 874 202 3557 -294 3124 1107 1693 514 1974 -1301 -2461 1376 100 6163 320 -1006 420 3588 3051 3015 1220 2156 2272 51 -202 -2856 -1321 -720 -735 -536 -3866 -2112 -333 -4126 -1360 -761 -1502 -2219 -1076 2752 1158 -2348 -93 -1307 1330 137 1746 166 -337 -807 -1712 -783 -285 -1047 1282 499 -1321 -1162 -110 536 1297 205 2252 -256 1280 254 671 1117 1992 -323 773 -94 -32 207 2373 -614 -714 1640 -1549 977 1340 -2010 -1021 -2748 93 -902 187 -414 1560 722 -1421 -397 184 866 SS 20240729T132902.8Z 8976.561838 260 1 0.36 2 69.96 79.68 7.65 180.23 0.00 1 0.00 1 0 17 3.880e-02 9.232e-03 3.125e-02 8.384e-03 3.526602e-01 4.621934e-03 3.836768e-03 -6.000000e+00 2.482751e-02 229.86 -2.00 3.25 -2.00 317.55 0.00e+00 7.458890e-04 7.676492e-04 2.564903e-04 -6.000000e+00 1.166391e-03 293.32 -2.00 20.00 -2.00 316.62 0.00e+00 2.887 0.000 302.00 328.00 3 2.0557e+00 1.2335e-02 3.2832e-02 -6.0000e+00 6.1647e-02 -8.7418e-03 1.3908e-02 1.6909e-02 -6.0000e+00 6.6487e-02 -6.5696e-04 8.2399e-03 8.1701e-03 -6.0000e+00 3.9823e-02 -3.4609e-03 3.9809e-03 2.2688e-03 -6.0000e+00 1.6556e-02 2.6824e-03 2.1490e-04 2.9350e-04 3.2869e-05 -6.0000e+00 1.4026e-03 2.7077e-02 -7.6721e-05 12 9 1 12 1 1 999.00 28.39 0.21 0.02708 0.02869 1 30 1 5 0 177.830 36.25 20.00 28.39 32.52 0.0 985.88 -9629 -620 3514 -29863 1025 -10522 -9206 -11104 -7393 -1502 -404 12559 -6667 -7348 4169 -1507 -2641 6626 -4951 5510 -3783 -252 5319 5664 3899 3298 -1835 -3957 -6053 4627 -1414 -263 -1487 1277 -2275 2714 -2265 297 331 -296 178 -115 41 -1730 690 542 -2074 4059 334 1284 279 124 296 1516 1434 701 1384 -566 -1103 923 2002 -20 1841 1858 554 -149 182 -474 -131 -535 1084 -228 -759 -551 43 679 -18 -1245 -1555 296 -1663 571 -2788 -1703 -1518 486 -522 746 183 359 -642 154 -369 187 1185 983 200 -304 360 -405 -431 -572 -932 -410 -789 -721 -105 -974 -561 702 540 94 -232 284 -4 705 -32 912 621 543 -211 -439 987 933 -95 679 -24 177 944 1194 500 -1495 183 -137 -162 -71 136 -367 38 -348 49 -76 -745 -780 -49 299 -3130 84 -972 -896 -1098 -764 -155 -44 1316 -966 -1240 713 -276 -527 1278 -1123 1168 -902 -59 1232 1378 1012 881 -473 -1103 -1703 1204 -387 -77 -470 402 -747 881 -795 118 143 -138 90 -62 22 -935 367 289 -1130 2209 180 710 165 74 189 1010 942 477 948 -396 -772 641 1435 -15 1442 1451 440 -115 143 -363 -107 -458 983 -208 -693 -503 36 551 -15 -1002 -1268 251 -1540 546 -2858 -1843 -1681 539 -613 887 218 412 -724 167 -382 192 1277 1124 237 -382 472 -532 -541 -700 -1103 -490 -998 -930 -138 -1316 -803 1024 804 142 -346 414 -6 984 -45 1267 884 808 -312 -647 1440 1353 -133 935 -32 242 1313 1718 767 -2374 287 -219 -273 -122 233 -645 66 -601 84 -129 -1258 SS 20240729T134529.0Z 8976.573253 266 1 2.50 2 66.46 81.52 8.42 206.47 0.00 1 0.00 1 0 17 1.293e-02 5.920e-03 4.997e-03 1.927e-03 3.116712e-01 1.068418e-03 3.396725e-03 -6.000000e+00 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