File name: Pandora206s1_BuffaloNY_20250208_L2Fit_fout2c6d20240814p1-8.txt File generation date: 20250209T053638.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 Local principal investigator: Kang Sun Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 206 Spectrometer number: 1 Processing software version used: BlickP v1.8.70 Instrument operation file used: Pandora206_OF_v3d20211008.txt Instrument calibration file used: Pandora206s1_CF_v6d20240814.txt Level 1 file used: Pandora206s1_BuffaloNY_20250208_L1_smca1c6d20240814p1-8.txt Full location name: University at Buffalo Short location name: BuffaloNY Country of location: United States Location latitude [deg]: 43.0015 Location longitude [deg]: -78.7869 Location altitude [m]: 190 Local noon date: 20250208 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: None First and last pixel inside fitting window: 223 365 Nominal wavelengths inside fitting window [nm]: 305.0348 305.1758 305.3167 305.4577 305.5987 305.7396 305.8805 306.0215 306.1624 306.3033 306.4442 306.5850 306.7259 306.8668 307.0076 307.1484 307.2893 307.4301 307.5709 307.7117 307.8524 307.9932 308.1340 308.2747 308.4154 308.5561 308.6968 308.8375 308.9782 309.1189 309.2596 309.4002 309.5408 309.6815 309.8221 309.9627 310.1033 310.2438 310.3844 310.5250 310.6655 310.8060 310.9466 311.0871 311.2276 311.3681 311.5085 311.6490 311.7894 311.9299 312.0703 312.2107 312.3511 312.4915 312.6319 312.7723 312.9126 313.0530 313.1933 313.3336 313.4740 313.6143 313.7545 313.8948 314.0351 314.1753 314.3156 314.4558 314.5960 314.7362 314.8764 315.0166 315.1568 315.2970 315.4371 315.5772 315.7174 315.8575 315.9976 316.1377 316.2777 316.4178 316.5579 316.6979 316.8379 316.9780 317.1180 317.2580 317.3980 317.5379 317.6779 317.8178 317.9578 318.0977 318.2376 318.3775 318.5174 318.6573 318.7972 318.9370 319.0769 319.2167 319.3565 319.4963 319.6361 319.7759 319.9157 320.0554 320.1952 320.3349 320.4747 320.6144 320.7541 320.8938 321.0335 321.1731 321.3128 321.4524 321.5921 321.7317 321.8713 322.0109 322.1505 322.2900 322.4296 322.5692 322.7087 322.8482 322.9877 323.1272 323.2667 323.4062 323.5457 323.6851 323.8246 323.9640 324.1034 324.2428 324.3822 324.5216 324.6610 324.8003 324.9397 --------------------------------------------------------------------------------------- Column 1: Two letter code of measurement routine Column 2: UT date and time for center-time of measurement, yyyymmddThhmmssZ (ISO 8601) Column 3: Fractional days since 1-Jan-2000 midnight for center-time of measurement Column 4: Routine count (1 for the first routine of the day, 2 for the second, etc.) Column 5: Repetition count (1 for the first set in the routine, 2 for the second, etc.) Column 6: Total duration of measurement set in seconds Column 7: Data processing type index Column 8: Solar zenith angle for center-time of measurement in degree Column 9: Solar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 10: Lunar zenith angle for center-time of measurement in degree Column 11: Lunar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 12: Pointing zenith angle in degree, absolute or relative (see next column), 999=tracker not used Column 13: Zenith pointing mode: zenith angle is... 0=absolute, 1=relative to sun, 2=relative to moon Column 14: Pointing azimuth in degree, increases clockwise, absolute (0=north) or relative (see next column), 999=tracker not used Column 15: Azimuth pointing mode: like zenith angle mode but also fixed scattering angles relative to sun (3) or moon (4) Column 16: Fitting result index: 0=no error or warning, 1, 2=warning, >2=error Column 17: Number of function evaluations used, 0=linear fitting or fitting not successful or no fitting done Column 18: rms of unweighted fitting residuals, -9=fitting not successful Column 19: Normalized rms of fitting residuals weighted with independent uncertainty, -9=fitting not successful or no uncertainty used Column 20: Expected rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 21: Expected normalized weighted rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 22: Ozone slant column amount [moles per square meter], -9e99=fitting not successful Column 23: Independent uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 24: Structured uncertainty of ozone slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 25: Common uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 26: rms-based uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 27: Ozone effective temperature [K] Column 28: Independent uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 29: Structured uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 30: Common uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 31: Effective ozone fitting wavelength [nm], -9=fitting not successful Column 32: Diffuse correction applied before fitting at effective fitting wavelength for ozone [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 33: Sulfur dioxide slant column amount [moles per square meter], -9e99=fitting not successful Column 34: Independent uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 35: Structured uncertainty of sulfur dioxide slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 36: Common uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 37: rms-based uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 38: Sulfur dioxide effective temperature [K] Column 39: Independent uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 40: Structured uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 41: Common uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 42: Effective sulfur dioxide fitting wavelength [nm], -9=fitting not successful Column 43: Diffuse correction applied before fitting at effective fitting wavelength for sulfur dioxide [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 44: Molecular scattering air mass factor used for molecular scattering subtraction before the fitting Column 45: Estimated uncertainty of molecular scattering air mass factor, -9=molecular scattering was not subtracted before the fitting Column 46: Lower limit used for wavelength scaling [nm] Column 47: Upper limit used for wavelength scaling [nm] Column 48: Order of smoothing polynomial Column 49: Smoothing polynomial coefficient, order 0 Column 50: Independent uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 51: Structured uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 52: Common uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 53: rms-based uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 54: Smoothing polynomial coefficient, order 1 Column 55: Independent uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 56: Structured uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 57: Common uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 58: rms-based uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 59: Smoothing polynomial coefficient, order 2 Column 60: Independent uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 61: Structured uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 62: Common uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 63: rms-based uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 64: Smoothing polynomial coefficient, order 3 Column 65: Independent uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 66: Structured uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 67: Common uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 68: rms-based uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 69: Mean value of measured data inside fitting window [same units as measurements] Column 70: Wavelength change polynomial coefficient, order 0 Column 71: Independent uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 72: Structured uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 73: Common uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 74: rms-based uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 75: L1 based wavelength change coefficient, order 0, -9=no L1 wavelength change determination Column 76: L1 based wavelength change coefficient, order 1, -9=no L1 wavelength change determination Column 77: L2Fit data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 78: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ1 limit, 0=L1 data quality above 0, 1=Spectral fitting was not successful, 2=Wavelength shift too large, 3=Normalized rms of fitting residuals weighted with independent uncertainty too large Column 79: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 80: L1 data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 81: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ1 limit, 0=Saturated data, 1=Too few dark counts measurements, 2=No temperature given or effective temperature too different from the reference temperature, 3=Dark count too high, 4=Unsuccessful dark background fitting, 5=The dark count differs significantly from the dark map for too many pixels, 6=Absolute value of estimated average residual stray light level too high, 7=Although attempted, no wavelength change could be retrieved, 8=Absolute value of retrieved wavelength shift too large, 9=Retrieved wavelength shift differs too much from the shift predicted by the effective temperature Column 82: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 83: Atmospheric variability [%], 999=no atmospheric variability was determined Column 84: Wavelength effective temperature [°C], 999=no effective temperature given Column 85: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 86: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 87: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 88: Number of bright count cycles Column 89: Number of dark count cycles Column 90: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 91: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 92: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 93: Integration time [ms] Column 94: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Temperature at electronics board 1 [°C], 999=no temperature signal Column 98: Temperature at electronics board 2 [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: 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 20250208T151702.2Z 9170.636831 259 1 27.02 2 65.25 144.48 107.70 15.37 0.00 1 0.00 1 0 17 5.660e-02 7.110e-03 5.176e-02 5.485e-03 3.748311e-01 2.698432e-03 4.510660e-03 -6.000000e+00 3.136613e-02 224.41 -2.00 3.55 -2.00 318.80 0.00e+00 1.368573e-03 5.806683e-04 3.907335e-04 -6.000000e+00 1.341968e-03 272.39 -2.00 20.00 -2.00 318.27 0.00e+00 2.373 0.000 302.00 328.00 3 5.4684e+00 7.2960e-03 3.0207e-02 -6.0000e+00 7.7652e-02 1.8762e-02 8.3652e-03 1.9573e-02 -6.0000e+00 8.4688e-02 1.0025e-02 6.1948e-03 9.7129e-03 -6.0000e+00 5.0273e-02 -1.2897e-02 3.3228e-03 3.1292e-03 -6.0000e+00 2.1432e-02 1.3495e-04 -4.4190e-04 1.5135e-04 2.9747e-05 -6.0000e+00 1.4402e-03 -3.2562e-03 0.0000e+00 11 8 0 10 0 0 94.29 17.81 0.06 -0.00326 -0.00658 7 7 1 8 0 3859.650 15.00 17.81 4.13 21.38 21.27 23.5 946.89 -3575 19646 25624 -12510 15082 19895 3084 4155 -11816 9682 3409 35474 -3013 11701 -8031 8388 7160 5380 -1496 -2820 2266 1013 13323 -375 2188 -6014 4515 121 -14111 -2465 -458 -236 3520 -443 -3489 -3127 -5268 1212 532 -1030 -975 -2586 265 -859 -2454 -67 -4617 2127 605 499 962 1320 -510 -12 2924 31 1613 -1051 1684 -1202 1160 1996 656 1892 -146 -939 -2241 584 -1023 403 1095 828 -1 1086 420 -545 188 -210 -1546 -986 -907 -917 -1539 -820 -568 412 589 -519 815 938 457 205 1320 222 -367 931 235 319 -231 147 -416 -216 -683 969 -30 -1143 -592 -182 -1191 -105 280 270 -254 -258 489 291 -211 -360 124 -214 -445 88 547 51 -595 498 202 1042 -341 211 851 473 -161 -41 36 -32 -261 408 103 -483 172 -339 -252 -116 583 764 -533 444 525 102 152 -557 402 151 1210 -170 685 -680 699 651 528 -167 -334 263 118 1395 -48 292 -916 636 17 -2132 -330 -66 -38 608 -86 -658 -558 -1047 261 135 -320 -329 -937 97 -326 -946 -25 -1832 804 233 194 387 579 -243 -6 1511 16 861 -577 901 -651 627 1122 413 1256 -102 -636 -1443 359 -672 292 874 677 -1 877 317 -382 121 -130 -1018 -721 -735 -812 -1489 -800 -591 446 669 -602 964 1073 498 205 1239 203 -361 987 275 411 -316 199 -545 -265 -790 1113 -37 -1475 -793 -250 -1712 -161 451 439 -416 -398 723 403 -291 -518 185 -341 -708 140 841 78 -861 700 270 1416 -500 325 1364 776 -272 -72 66 -60 -494 784 201 -936 317 -614 -452 SS 20250208T162021.2Z 9170.680801 293 1 24.01 2 59.89 160.65 103.57 28.49 0.00 1 0.00 1 0 17 8.572e-02 1.383e-02 7.311e-02 1.028e-02 3.187867e-01 5.035828e-03 3.878228e-03 -6.000000e+00 4.748192e-02 224.42 -2.00 3.55 -2.00 318.48 0.00e+00 1.907030e-03 9.809339e-04 4.269576e-04 -6.000000e+00 2.031895e-03 272.39 -2.00 20.00 -2.00 317.94 0.00e+00 1.985 0.000 302.00 328.00 3 6.6224e+00 1.3521e-02 2.5509e-02 -6.0000e+00 1.1755e-01 3.3520e-02 1.5396e-02 1.6887e-02 -6.0000e+00 1.2822e-01 1.2722e-02 1.0701e-02 8.2295e-03 -6.0000e+00 7.6118e-02 -1.2559e-02 5.6769e-03 2.9036e-03 -6.0000e+00 3.2428e-02 6.5729e-05 -9.2517e-04 2.8788e-04 2.7678e-05 -6.0000e+00 2.1811e-03 6.5522e-04 0.0000e+00 12 8 8 10 0 0 84.57 17.81 2.02 0.00066 -0.00630 6 6 2 8 0 4000.000 15.00 17.81 5.74 21.38 21.27 23.6 957.55 7726 39283 15901 15371 42364 18366 12878 -6029 21401 -11373 27956 20343 -13288 7597 -958 -16940 20813 9348 31465 2395 10082 -31972 7594 3735 -1460 -2850 2065 -1508 1030 -5543 4664 -499 3608 -2764 177 -2390 -9573 5554 7381 -1876 7307 -1931 1929 -1355 -1013 -1051 -4675 982 3528 2419 -3 1142 -2191 523 4196 1634 -730 -1555 158 -4000 -924 -181 103 3390 -660 -2725 -1926 -42 -452 -901 2536 -855 1486 1583 1125 -294 251 -2676 -4204 -1374 -1461 575 -2042 727 -662 1045 375 33 1428 1132 816 1082 1225 -925 381 -808 1181 -766 870 323 681 -553 573 -3066 559 -31 -801 162 -632 -365 858 2244 -1504 -677 -1295 -82 -1178 -681 627 417 -140 -375 1160 -482 -992 -393 1538 395 -388 -425 1120 520 -26 -28 -1134 238 285 998 577 -141 -25 -978 -265 350 1474 797 751 1384 713 554 -347 1052 -839 1429 1135 -1152 631 -102 -2416 2167 1146 3256 345 1386 -6596 1066 580 -251 -518 365 -263 163 -921 785 -94 719 -629 37 -496 -2244 1286 2017 -672 2658 -808 808 -598 -445 -465 -2128 415 1440 1000 -2 550 -1156 286 2301 934 -424 -909 91 -2379 -545 -114 69 2385 -495 -1935 -1302 -27 -305 -677 2045 -749 1276 1306 869 -213 163 -1688 -2795 -1012 -1183 509 -2004 722 -690 1153 438 40 1728 1330 887 1106 1146 -847 364 -870 1351 -1003 1174 433 881 -665 646 -3629 678 -39 -1086 229 -920 -569 1373 3634 -2457 -1057 -1870 -112 -1612 -965 938 648 -223 -589 1756 -733 -1433 -539 2021 522 -541 -641 1766 832 -43 -47 -2007 439 537 1912 1122 -267 -45 -1777 -463 SS 20250208T164237.9Z 9170.696272 306 1 27.41 2 58.74 166.77 101.59 32.83 0.00 1 0.00 1 0 25 1.455e-02 5.576e-03 1.284e-02 3.050e-03 3.025941e-01 1.491201e-03 3.679723e-03 -6.000000e+00 8.063633e-03 224.42 -2.00 3.55 -2.00 317.82 0.00e+00 5.945457e-04 2.406599e-04 8.651296e-05 -6.000000e+00 3.450168e-04 272.39 -2.00 20.00 -2.00 317.27 0.00e+00 1.920 0.000 302.00 328.00 3 4.9987e+00 3.9453e-03 2.4323e-02 -6.0000e+00 1.9963e-02 6.4488e-03 4.4595e-03 1.5473e-02 -6.0000e+00 2.1773e-02 -8.5744e-03 2.8574e-03 7.7540e-03 -6.0000e+00 1.2925e-02 -1.2155e-03 1.4759e-03 2.2816e-03 -6.0000e+00 5.5089e-03 3.7456e-04 -4.9273e-04 8.4197e-05 2.3287e-05 -6.0000e+00 3.7029e-04 -2.0649e-03 0.0000e+00 10 0 0 10 0 0 99.87 17.81 0.47 -0.00206 -0.00577 13 13 2 8 0 2108.200 14.99 17.81 6.18 21.48 21.27 23.7 960.76 -3685 2564 -93 2082 -160 -7150 -3606 -1536 -4096 -283 -6091 241 -4357 353 -4798 1399 -829 1682 597 1190 2977 94 1652 536 -450 -153 2251 -438 -1794 -113 -1037 2202 1800 -331 -2368 -2689 -2085 -806 -1137 -363 -750 -851 -717 -227 -1 -793 -2247 472 113 -71 831 209 -121 1372 1368 1150 1368 310 709 -167 495 1418 1168 1986 607 -363 -662 -393 -75 261 393 491 -278 553 341 112 142 -504 -866 -631 -422 -488 -2139 -1397 -1128 -285 -278 157 474 463 550 127 300 484 511 38 11 661 309 -45 -398 -663 -470 155 -523 -1145 -1079 -622 -53 76 76 364 -100 231 -238 262 -82 168 878 104 -160 4 293 477 54 461 269 719 438 203 205 71 -99 -73 -56 -7 -155 161 62 -237 -212 -563 -96 -271 200 -8 173 -12 -532 -272 -126 -390 -28 -637 24 -509 46 -724 226 -144 298 112 231 583 19 327 115 -103 -36 532 -101 -404 -24 -244 519 467 -94 -640 -724 -578 -254 -432 -156 -361 -429 -374 -120 0 -421 -1196 239 57 -36 437 120 -71 837 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