File name: Pandora30s1_Juelich_20201008_L2Fit_fout2c3d20191023p1-8.txt File generation date: 20251119T154849.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Tom Hanisco Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 30 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora30_OF_v4d20190910.txt Instrument calibration file used: Pandora30s1_CF_v3d20191023.txt Level 1 file used: Pandora30s1_Juelich_20201008_L1_smca1c3d20191023p1-8.txt Full location name: Juelich JULEY Short location name: Juelich Country of location: Germany Location latitude [deg]: 50.9080 Location longitude [deg]: 6.4130 Location altitude [m]: 94 Local noon date: 20201008 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: 219 360 Nominal wavelengths inside fitting window [nm]: 305.0309 305.1726 305.3142 305.4558 305.5975 305.7391 305.8807 306.0223 306.1639 306.3054 306.4470 306.5885 306.7301 306.8716 307.0131 307.1546 307.2961 307.4376 307.5790 307.7205 307.8619 308.0034 308.1448 308.2862 308.4276 308.5690 308.7104 308.8518 308.9931 309.1345 309.2758 309.4171 309.5585 309.6998 309.8411 309.9823 310.1236 310.2649 310.4061 310.5474 310.6886 310.8298 310.9710 311.1122 311.2534 311.3945 311.5357 311.6769 311.8180 311.9591 312.1002 312.2413 312.3824 312.5235 312.6646 312.8057 312.9467 313.0877 313.2288 313.3698 313.5108 313.6518 313.7928 313.9337 314.0747 314.2156 314.3566 314.4975 314.6384 314.7793 314.9202 315.0611 315.2020 315.3428 315.4837 315.6245 315.7653 315.9062 316.0470 316.1877 316.3285 316.4693 316.6101 316.7508 316.8915 317.0323 317.1730 317.3137 317.4544 317.5950 317.7357 317.8764 318.0170 318.1576 318.2983 318.4389 318.5795 318.7201 318.8606 319.0012 319.1418 319.2823 319.4228 319.5634 319.7039 319.8444 319.9849 320.1253 320.2658 320.4062 320.5467 320.6871 320.8275 320.9679 321.1083 321.2487 321.3891 321.5295 321.6698 321.8101 321.9505 322.0908 322.2311 322.3714 322.5117 322.6519 322.7922 322.9324 323.0727 323.2129 323.3531 323.4933 323.6335 323.7737 323.9138 324.0540 324.1941 324.3343 324.4744 324.6145 324.7546 324.8947 --------------------------------------------------------------------------------------- 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 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: 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 20201008T090354.7Z 7586.377716 337 1 1.41 2 64.28 141.34 62.42 273.50 0.00 1 0.00 1 0 17 9.091e-03 5.994e-03 4.726e-03 2.074e-03 2.504158e-01 1.044254e-03 3.308139e-03 -6.000000e+00 5.153557e-03 225.40 -2.00 3.80 -2.00 316.50 0.00e+00 6.137552e-04 1.211663e-04 5.443733e-05 -6.000000e+00 2.233740e-04 277.36 -2.00 20.00 -2.00 315.90 0.00e+00 2.290 0.000 302.00 328.00 3 1.6749e+00 2.7068e-03 2.6389e-02 -6.0000e+00 1.2764e-02 1.2383e-02 3.0252e-03 1.3849e-02 -6.0000e+00 1.3865e-02 4.2213e-03 1.7766e-03 6.8495e-03 -6.0000e+00 8.2481e-03 -4.2404e-03 8.5300e-04 1.9944e-03 -6.0000e+00 3.5445e-03 7.8555e-03 -5.1777e-04 5.8177e-05 2.2538e-05 -6.0000e+00 2.3975e-04 -4.3143e-03 0.0000e+00 12 1 1 12 1 1 42.41 21.56 0.22 -0.00431 -0.00820 13 130 1 5 0 88.220 26.73 20.00 21.56 23.05 34.3 1002.87 -441 -1631 -260 -2220 -1058 -3036 -2485 256 209 -840 -2457 -3370 -316 -432 1441 -36 617 356 1330 761 1124 767 -39 607 684 12 141 -680 -384 78 766 1387 1965 -397 -1731 -2364 -1954 -226 -374 503 -462 -369 -28 -691 -469 -190 -576 -673 -518 -632 417 584 857 979 457 1118 588 478 -338 188 639 1390 2046 1382 242 142 -673 -1153 573 271 225 295 81 288 -323 86 -1062 -1039 -617 -1089 -1113 -1166 -2014 -1383 -667 -85 342 479 720 669 665 88 -130 218 184 -140 626 562 24 -145 -702 -597 -648 -220 -1231 -957 -493 -118 176 700 878 362 489 56 -263 0 187 -285 204 -33 -261 126 417 535 339 -43 92 527 -5 100 -62 -190 59 194 -24 56 336 144 -120 -114 -506 -596 -70 -295 -48 -402 -168 -455 -382 43 40 -172 -506 -702 -65 -102 385 -11 194 107 413 246 372 253 -13 213 255 5 55 -253 -132 26 267 522 800 -171 -710 -940 -836 -103 -193 301 -287 -240 -18 -469 -317 -128 -383 -436 -328 -402 277 417 607 729 352 874 471 381 -266 146 513 1129 1798 1231 216 123 -541 -966 482 247 223 288 78 283 -295 73 -882 -830 -523 -994 -1081 -1183 -2184 -1491 -768 -99 420 602 897 796 763 97 -132 229 198 -160 754 714 32 -187 -880 -718 -758 -260 -1593 -1241 -667 -159 251 1016 1326 546 697 77 -348 0 241 -390 287 -50 -376 184 590 752 455 -58 118 699 -7 141 -90 -283 87 299 -37 92 560 235 -195 -187 -799 -948 SS 20201008T092156.9Z 7586.390242 348 1 5.79 2 62.59 145.99 65.16 276.76 0.00 1 0.00 1 0 25 9.051e-03 5.974e-03 2.094e-03 9.696e-04 2.353691e-01 4.885430e-04 3.117766e-03 -6.000000e+00 5.131192e-03 225.40 -2.00 3.80 -2.00 316.37 0.00e+00 5.796788e-04 5.498339e-05 5.102846e-05 -6.000000e+00 2.224057e-04 277.35 -2.00 20.00 -2.00 315.78 0.00e+00 2.161 0.000 302.00 328.00 3 1.8508e+00 1.2642e-03 2.4886e-02 -6.0000e+00 1.2709e-02 2.9908e-03 1.4114e-03 1.3039e-02 -6.0000e+00 1.3805e-02 5.5940e-03 8.2481e-04 6.4466e-03 -6.0000e+00 8.2123e-03 -4.7498e-03 3.9271e-04 1.8757e-03 -6.0000e+00 3.5291e-03 7.6767e-03 -4.1516e-04 2.7081e-05 2.1484e-05 -6.0000e+00 2.3871e-04 -4.2640e-03 0.0000e+00 12 1 1 12 1 1 99.86 21.56 0.18 -0.00426 -0.00738 70 145 1 5 0 79.100 26.73 20.00 21.56 23.60 34.4 1002.75 -317 -596 -1463 -1747 -3072 -2197 -2248 105 1712 -1692 -2361 -2219 -760 -9 122 523 -75 717 756 1026 1154 297 1263 891 640 416 313 -129 -130 -64 1220 1100 1610 -166 -2555 -2008 -1980 -500 -189 -321 -569 -583 -315 -615 -173 -22 -448 -382 -1082 -906 912 618 532 1154 667 1119 511 206 -50 467 1038 1449 1779 1573 129 -263 -572 -731 633 397 277 392 107 265 -256 -341 -860 -1402 -704 -1024 -1035 -1244 -1965 -1151 -619 -239 307 384 696 512 500 7 -207 148 -184 -61 479 842 252 -139 -460 -869 -466 -370 -991 -895 -573 -355 310 641 602 543 526 15 -134 -51 -145 -35 0 -223 107 275 429 382 403 -67 328 757 177 127 -88 -123 14 -55 15 -71 313 191 -120 -47 -426 -779 -55 -116 -297 -340 -537 -352 -371 19 344 -374 -520 -487 -166 -2 35 164 -25 243 246 344 396 102 433 322 246 167 125 -49 -46 -24 431 422 666 -72 -1065 -802 -854 -231 -105 -195 -379 -381 -211 -417 -117 -15 -297 -262 -729 -610 635 435 396 896 535 859 401 161 -38 378 814 1222 1535 1442 118 -235 -471 -591 546 369 265 389 106 265 -239 -301 -690 -1151 -575 -950 -1018 -1274 -2146 -1244 -715 -281 378 485 870 612 578 7 -210 148 -199 -69 574 1056 331 -178 -570 -1043 -542 -458 -1275 -1153 -770 -497 436 957 897 802 767 21 -174 -67 -193 -47 1 -327 158 396 597 530 532 -88 414 987 239 182 -126 -178 21 -82 23 -113 507 316 -197 -75 -682 -1211 SS 20201008T092613.2Z 7586.393209 350 1 4.48 2 62.22 147.11 65.80 277.53 0.00 1 0.00 1 0 25 8.947e-03 6.026e-03 2.109e-03 1.010e-03 2.336562e-01 5.102946e-04 3.099002e-03 -6.000000e+00 5.072187e-03 225.40 -2.00 3.80 -2.00 316.22 0.00e+00 3.903176e-04 5.552623e-05 6.187304e-05 -6.000000e+00 2.198465e-04 277.35 -2.00 20.00 -2.00 315.62 0.00e+00 2.135 0.000 302.00 328.00 3 1.7165e+00 1.3205e-03 2.4614e-02 -6.0000e+00 1.2563e-02 6.3812e-03 1.4742e-03 1.2923e-02 -6.0000e+00 1.3646e-02 3.6723e-03 8.5849e-04 6.3907e-03 -6.0000e+00 8.1178e-03 -3.4011e-03 4.0652e-04 1.8350e-03 -6.0000e+00 3.4886e-03 9.0234e-03 -4.4519e-04 2.8376e-05 2.1468e-05 -6.0000e+00 2.3596e-04 -4.3423e-03 0.0000e+00 12 1 1 12 1 1 98.68 21.56 0.17 -0.00434 -0.00769 54 147 1 5 0 77.690 26.73 20.00 21.56 23.70 34.3 1002.64 -90 -320 -966 -1737 -3501 -2649 -2269 336 50 -789 -2419 -1682 21 -255 646 31 175 771 948 1076 849 541 993 920 863 931 -320 -2 -647 -14 1369 1287 1730 -772 -2414 -2069 -2035 -526 -75 -383 -625 -674 -436 -488 -256 -74 -286 -575 -1113 -492 601 448 919 929 633 894 430 257 -82 502 805 1300 1752 1522 425 -474 -452 -853 699 368 490 362 194 449 11 -307 -969 -1393 -586 -1051 -1042 -1266 -1712 -1327 -540 -392 300 475 734 606 447 81 -435 117 -131 -266 470 705 221 -180 -350 -867 -521 -318 -1111 -938 -686 -370 388 721 688 569 517 -23 -182 -189 -26 -126 203 -74 25 178 345 383 499 -5 360 611 153 129 -141 -236 19 51 123 -119 314 181 -57 -84 -483 -733 -17 -61 -193 -335 -663 -459 -404 65 10 -171 -527 -363 5 -69 197 10 57 257 329 385 313 198 364 355 354 397 -138 -1 -245 -5 514 524 759 -333 -1067 -878 -932 -258 -41 -231 -414 -468 -310 -350 -183 -53 -200 -391 -742 -327 415 313 676 717 504 725 357 212 -67 404 667 1091 1591 1391 387 -421 -370 -724 596 339 491 358 191 446 10 -268 -817 -1129 -501 -965 -1016 -1290 -1855 -1432 -621 -461 369 598 917 723 515 89 -441 123 -141 -302 562 885 290 -229 -432 -1034 -603 -373 -1425 -1207 -921 -495 546 1032 1025 841 754 -31 -236 -244 -35 -168 280 -108 37 256 480 528 655 -7 451 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