File name: Pandora206s1_BuffaloNY_20231006_L2Fit_fout2c1d20220512p1-8.txt File generation date: 20231007T192610.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Kang Sun Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 206 Spectrometer number: 1 Processing software version used: BlickP v1.8.49 Instrument operation file used: Pandora206_OF_v3d20211008.txt Instrument calibration file used: Pandora206s1_CF_v1d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20231006_L1_smca1c1d20220512p1-8.txt Full location name: University at Buffalo Short location name: BuffaloNY Country of location: Canada Location latitude [deg]: 43.0015 Location longitude [deg]: -78.7869 Location altitude [m]: 190 Local noon date: 20231006 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]: 305.0398 305.1808 305.3218 305.4628 305.6038 305.7447 305.8857 306.0266 306.1675 306.3084 306.4493 306.5902 306.7311 306.8720 307.0128 307.1537 307.2945 307.4353 307.5761 307.7169 307.8577 307.9985 308.1393 308.2800 308.4207 308.5615 308.7022 308.8429 308.9836 309.1243 309.2649 309.4056 309.5462 309.6869 309.8275 309.9681 310.1087 310.2493 310.3899 310.5305 310.6710 310.8116 310.9521 311.0926 311.2331 311.3736 311.5141 311.6546 311.7950 311.9355 312.0759 312.2164 312.3568 312.4972 312.6376 312.7779 312.9183 313.0587 313.1990 313.3394 313.4797 313.6200 313.7603 313.9006 314.0408 314.1811 314.3214 314.4616 314.6018 314.7421 314.8823 315.0225 315.1626 315.3028 315.4430 315.5831 315.7232 315.8634 316.0035 316.1436 316.2837 316.4238 316.5638 316.7039 316.8439 316.9839 317.1240 317.2640 317.4040 317.5439 317.6839 317.8239 317.9638 318.1038 318.2437 318.3836 318.5235 318.6634 318.8033 318.9431 319.0830 319.2228 319.3627 319.5025 319.6423 319.7821 319.9219 320.0616 320.2014 320.3412 320.4809 320.6206 320.7603 320.9000 321.0397 321.1794 321.3191 321.4587 321.5984 321.7380 321.8776 322.0172 322.1568 322.2964 322.4360 322.5755 322.7151 322.8546 322.9941 323.1336 323.2731 323.4126 323.5521 323.6916 323.8310 323.9705 324.1099 324.2493 324.3887 324.5281 324.6675 324.8069 324.9462 --------------------------------------------------------------------------------------- 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 20231006T134432.0Z 8679.572593 254 1 24.00 2 65.81 123.62 34.27 255.99 0.00 1 0.00 1 0 17 1.844e-01 4.252e-02 2.265e-01 2.714e-02 2.995446e-01 1.345357e-02 3.482727e-03 -6.000000e+00 1.035535e-01 226.61 -2.00 3.55 -2.00 318.63 0.00e+00 -1.188824e-03 2.864409e-03 2.319682e-04 -6.000000e+00 4.869234e-03 282.80 -2.00 20.00 -2.00 317.91 0.00e+00 2.423 0.000 302.00 328.00 3 7.6387e+00 3.6852e-02 2.8214e-02 -6.0000e+00 2.5651e-01 4.6774e-02 4.2419e-02 1.5420e-02 -6.0000e+00 2.7912e-01 9.8152e-02 2.9779e-02 7.7046e-03 -6.0000e+00 1.6595e-01 -5.3315e-02 1.5691e-02 2.3479e-03 -6.0000e+00 7.0922e-02 1.5829e-05 3.0042e-04 7.7337e-04 2.3276e-05 -6.0000e+00 4.7489e-03 6.5980e-03 1.2070e-04 12 8 8 10 0 0 -234.94 18.41 2.88 0.00660 0.00886 6 6 2 8 0 4000.000 14.99 18.41 23.91 21.79 21.79 19.2 975.72 -11418 66018 26069 13720 22730 900000 31587 -12388 84527 57167 900000 -24401 -35377 -4149 -13444 -22271 82741 9008 35388 -19381 25591 21032 22716 48289 -9656 3747 9725 40294 2800 56352 2081 -12450 4981 20947 58331 -7006 8505 4388 20892 -6382 7497 -4664 7514 -4496 8090 -11971 -4698 -28494 15247 -3174 -2357 2229 2049 7091 -412 14168 -8359 9750 -5570 -7704 -6227 7208 -2834 8958 -1647 1638 -2815 -6884 2481 -2718 7845 -4499 4467 -673 12918 -6732 5263 2666 966 -9348 -2794 6970 -4942 588 -2216 5287 737 3576 -2693 1380 -1723 6249 -1901 -1168 1574 2879 2902 -491 4024 1876 9726 -1271 -3172 -7643 4477 -7303 -782 -1221 521 -3433 1607 1666 -6882 339 -6112 3246 -4424 2431 -882 2393 -875 4759 1086 3575 6051 -390 -2859 -342 5780 -3016 4508 -4450 1830 -2126 -286 -177 697 1365 -552 1603 -879 -1333 -558 -531 1747 1013 579 771 900000 1019 -707 2236 2032 900000 -1937 -3574 -356 -1466 -3000 4242 982 3219 -3092 2772 2365 2592 4631 -1711 613 1528 4531 421 5050 336 -2446 935 3550 6522 -1408 1617 1012 4975 -2318 2627 -1933 2862 -1954 3081 -5595 -2012 -15146 5332 -1300 -1022 1001 977 3428 -224 7005 -5160 5175 -3260 -4546 -3714 4172 -1922 5839 -1203 1097 -1839 -4570 1588 -2040 6026 -3964 3712 -566 8812 -4993 3124 1539 593 -7250 -2289 5763 -4936 578 -2335 5726 851 4146 -3343 1580 -1929 5906 -1785 -1051 1465 2938 3297 -645 5387 2510 11258 -1507 -3558 -9239 5260 -10144 -1063 -1751 771 -5489 2598 2735 -11863 523 -9198 4158 -6101 3264 -1313 3680 -1413 7126 1647 5054 8139 -534 -3797 -445 7651 -4531 6642 -7400 2907 -3645 -513 -334 1331 2654 -1102 3026 -1634 -2395 -969 SS 20231006T151547.2Z 8679.635962 290 1 0.71 2 53.98 146.17 50.47 272.79 0.00 1 0.00 1 0 17 1.030e-02 6.214e-03 8.110e-03 3.832e-03 2.114961e-01 1.895391e-03 2.591317e-03 -6.000000e+00 5.751732e-03 226.60 -2.00 3.55 -2.00 316.36 0.00e+00 1.653175e-04 2.166053e-04 4.253281e-05 -6.000000e+00 2.548253e-04 282.80 -2.00 20.00 -2.00 315.65 0.00e+00 1.696 0.000 302.00 328.00 3 2.4173e+00 4.9215e-03 1.9841e-02 -6.0000e+00 1.4260e-02 -1.6223e-02 5.5213e-03 1.0927e-02 -6.0000e+00 1.5506e-02 6.1505e-04 3.2121e-03 5.3798e-03 -6.0000e+00 9.2457e-03 -5.5003e-04 1.5142e-03 1.5250e-03 -6.0000e+00 3.9531e-03 7.2407e-03 1.0166e-03 1.0465e-04 1.7103e-05 -6.0000e+00 2.6224e-04 1.7591e-03 1.1517e-04 12 1 1 12 1 1 88.46 18.40 0.35 0.00176 0.00940 4 129 2 8 0 139.990 15.00 18.40 23.95 21.79 21.79 19.6 979.23 -4148 1157 -608 -2647 -3890 -1306 -3439 -511 -1069 -1119 -718 -1989 -580 -2058 -52 742 303 193 -62 -1 266 1261 805 1574 1047 977 345 664 -289 1462 1886 1121 1818 184 -2887 -1690 -1593 -1514 -237 82 -920 -701 -494 -884 516 -843 -152 385 -487 -689 1042 1062 419 1391 22 1620 674 456 -6 79 682 1115 1505 2044 105 -344 -31 -883 -32 362 368 397 -7 370 -346 772 -313 -468 -96 -939 -1081 -976 -1483 -1734 -1073 -1040 -853 -222 85 385 558 113 172 133 209 -179 481 677 596 -206 -34 -756 -447 -256 -645 -315 -666 -684 -123 220 566 234 346 9 -201 109 188 490 248 334 -483 -159 311 186 844 293 240 887 805 448 644 -112 2 -268 -75 383 -85 173 -711 -224 -322 -585 -231 -743 215 -118 -543 -698 -215 -609 -98 -231 -257 -160 -445 -142 -526 -15 230 97 63 -21 0 96 441 286 589 411 399 143 256 -103 495 668 424 737 79 -1175 -651 -672 -734 -125 51 -631 -459 -333 -604 345 -571 -108 263 -327 -457 714 719 300 1039 17 1260 541 366 -4 62 544 950 1284 1854 96 -311 -26 -711 -27 321 359 404 -7 365 -322 684 -252 -353 -74 -828 -992 -989 -1610 -1830 -1210 -1263 -1022 -274 105 459 650 121 178 132 217 -206 568 832 779 -265 -44 -904 -499 -297 -827 -397 -880 -948 -177 315 851 355 503 13 -264 142 244 621 340 492 -692 -224 455 261 1109 393 304 1118 1087 604 910 -163 3 -410 -114 616 -140 277 -1159 -374 -520 -917 -352 SS 20231006T152110.9Z 8679.639710 292 1 46.46 2 53.45 147.70 51.43 273.62 0.00 1 0.00 1 0 17 8.364e-03 5.513e-03 7.186e-04 3.043e-04 2.074380e-01 1.501597e-04 2.549858e-03 -6.000000e+00 4.668878e-03 226.60 -2.00 3.55 -2.00 316.66 0.00e+00 3.751346e-04 1.843246e-05 3.954794e-05 -6.000000e+00 2.069684e-04 282.80 -2.00 20.00 -2.00 315.93 0.00e+00 1.675 0.000 302.00 328.00 3 1.5883e+00 3.9176e-04 1.9569e-02 -6.0000e+00 1.1575e-02 -2.3866e-02 4.3970e-04 1.0764e-02 -6.0000e+00 1.2590e-02 3.9643e-03 2.5763e-04 5.3041e-03 -6.0000e+00 7.5064e-03 -3.1206e-03 1.2372e-04 1.5211e-03 -6.0000e+00 3.2071e-03 1.7090e-02 2.4810e-04 8.4280e-06 1.6683e-05 -6.0000e+00 2.1306e-04 3.8158e-03 -5.1177e-06 10 0 0 10 0 0 99.99 18.40 0.27 0.00382 0.00568 1544 477 2 8 0 29.680 15.00 18.40 24.75 21.79 21.79 19.9 984.84 -1183 -997 -583 -2437 -3059 -2580 -1050 -236 657 -342 -1784 -1784 -877 -811 302 104 -159 160 629 1242 746 330 679 671 -11 668 208 -60 -806 401 1120 914 1686 4 -2151 -2051 -1816 -1315 -391 -142 -716 -816 -490 -719 -238 -364 -373 -255 -678 -179 683 739 765 1068 668 1005 855 597 442 483 886 1134 1418 1638 382 -208 -406 -784 240 389 389 251 220 454 222 -77 -319 -928 -370 -702 -1031 -951 -1973 -1573 -1111 -700 -331 -61 400 233 396 295 30 255 473 173 448 763 252 -153 -160 -705 -726 -76 -588 -783 -662 -586 -303 250 446 328 217 75 -137 91 16 224 157 188 -251 34 269 193 638 423 445 923 626 390 302 -17 -216 47 3 -49 -91 171 -82 -228 -206 -432 -584 -191 -176 -105 -421 -459 -363 -153 -38 117 -66 -338 -335 -181 -190 79 30 -47 49 198 401 247 108 224 234 -4 253 80 -22 -266 127 370 320 633 1 -801 -731 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