File name: Pandora166s1_PhiladelphiaPA_20230710_L2Fit_fout2c5d20220925p1-8.txt File generation date: 20230711T122108.3Z Data description: Level 2 spectral fitting results file Data file version: fout2c5p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 166 Spectrometer number: 1 Processing software version used: BlickP v1.8.49 Instrument operation file used: Pandora166_OF_v5d20210217.txt Instrument calibration file used: Pandora166s1_CF_v5d20220925.txt Level 1 file used: Pandora166s1_PhiladelphiaPA_20230710_L1_smca1c5d20220925p1-8.txt Full location name: Philadelphia, Pennsylvania; Philadelphia-Camden-Wilmington; North East Waste (NE Short location name: PhiladelphiaPA Country of location: United States Location latitude [deg]: 39.9919 Location longitude [deg]: -75.0811 Location altitude [m]: 6 Local noon date: 20230710 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: HCHO modification of session 4 "Field cal based on session3" First and last pixel inside fitting window: 223 365 Nominal wavelengths inside fitting window [nm]: 305.0654 305.2061 305.3468 305.4875 305.6282 305.7689 305.9096 306.0503 306.1910 306.3316 306.4722 306.6129 306.7535 306.8941 307.0347 307.1753 307.3158 307.4564 307.5969 307.7375 307.8780 308.0185 308.1590 308.2995 308.4400 308.5805 308.7209 308.8614 309.0018 309.1422 309.2827 309.4231 309.5635 309.7038 309.8442 309.9846 310.1249 310.2652 310.4056 310.5459 310.6862 310.8265 310.9668 311.1070 311.2473 311.3875 311.5278 311.6680 311.8082 311.9484 312.0886 312.2288 312.3690 312.5091 312.6493 312.7894 312.9295 313.0696 313.2097 313.3498 313.4899 313.6300 313.7700 313.9101 314.0501 314.1901 314.3301 314.4701 314.6101 314.7501 314.8901 315.0300 315.1700 315.3099 315.4498 315.5897 315.7296 315.8695 316.0094 316.1493 316.2891 316.4290 316.5688 316.7086 316.8484 316.9882 317.1280 317.2678 317.4076 317.5473 317.6871 317.8268 317.9665 318.1062 318.2459 318.3856 318.5253 318.6650 318.8046 318.9443 319.0839 319.2235 319.3631 319.5027 319.6423 319.7819 319.9215 320.0610 320.2006 320.3401 320.4796 320.6191 320.7586 320.8981 321.0376 321.1770 321.3165 321.4559 321.5954 321.7348 321.8742 322.0136 322.1530 322.2923 322.4317 322.5711 322.7104 322.8497 322.9891 323.1284 323.2677 323.4069 323.5462 323.6855 323.8247 323.9640 324.1032 324.2424 324.3816 324.5208 324.6600 324.7992 324.9383 --------------------------------------------------------------------------------------- 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 20230710T110915.1Z 8591.464758 233 1 52.15 2 75.28 73.13 32.29 177.97 0.00 1 0.00 1 0 17 2.986e-01 1.135e-02 2.647e-01 8.348e-03 5.227078e-01 4.465463e-03 5.774608e-03 -6.000000e+00 1.748329e-01 232.84 -2.00 3.49 -2.00 320.66 0.00e+00 -1.296153e-03 1.460565e-03 3.816363e-04 -6.000000e+00 6.942602e-03 289.64 -2.00 20.00 -2.00 320.32 0.00e+00 3.855 0.001 302.00 328.00 3 3.9316e+00 1.3000e-02 4.7703e-02 -6.0000e+00 4.4299e-01 2.5835e-02 1.6202e-02 2.7909e-02 -6.0000e+00 4.8087e-01 1.1127e-03 1.6978e-02 1.4696e-02 -6.0000e+00 2.8159e-01 -9.4616e-03 8.8056e-03 4.6077e-03 -6.0000e+00 1.1700e-01 1.1900e-04 2.4316e-04 2.5747e-04 5.1983e-05 -6.0000e+00 8.3089e-03 -8.2317e-03 2.0306e-05 12 8 8 10 0 0 99.49 19.71 0.39 -0.00823 -0.00640 14 3 1 5 0 3724.710 26.41 20.00 19.71 28.55 21.3 1048.74 900000 -121887 102723 -10069 74791 17446 222370 -65826 80121 -21672 -50277 -14764 -79119 900000 -29147 58330 -3274 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-605 437 -3 224 -931 -119 -1409 -84 -1456 191 23 -1357 1402 -1094 1019 -24 -191 -235 245 1422 702 608 -1348 939 168 -1008 1614 -2464 -1222 -3184 -316 -809 49 192 -826 1056 -86 164 802 2172 1491 599 45 -1494 42 483 2011 354 848 1025 1335 1148 -894 334 -2678 -611 1084 -100 -1199 -1342 535 545 -1029 -1269 -160 2526 SS 20230710T112432.7Z 8591.475379 240 1 49.68 2 72.47 75.36 32.29 184.94 0.00 1 0.00 1 0 25 2.147e-01 1.188e-02 1.977e-01 8.088e-03 4.404026e-01 4.232556e-03 5.037403e-03 -6.000000e+00 1.254762e-01 232.84 -2.00 3.49 -2.00 320.17 0.00e+00 1.331003e-03 1.188555e-03 2.387503e-04 -6.000000e+00 4.960370e-03 289.65 -2.00 20.00 -2.00 319.83 0.00e+00 3.271 0.001 302.00 328.00 3 4.2847e+00 1.2014e-02 4.0367e-02 -6.0000e+00 3.1794e-01 3.9609e-02 1.4146e-02 2.3355e-02 -6.0000e+00 3.4515e-01 -1.6701e-02 1.2974e-02 1.1876e-02 -6.0000e+00 2.0211e-01 -1.1692e-03 6.8738e-03 3.5559e-03 -6.0000e+00 8.3236e-02 1.5967e-04 -1.6679e-03 2.4809e-04 4.1214e-05 -6.0000e+00 5.9158e-03 -5.1085e-03 -2.6268e-04 12 8 8 10 0 0 99.98 19.71 0.65 -0.00511 -0.01764 19 3 1 5 0 2614.650 26.41 20.00 19.71 29.23 21.4 1053.80 -11097 -30203 50236 -34009 22030 13965 -90973 153816 59776 90338 34003 22176 -56651 -19980 28322 -29069 22781 -2651 -3053 -126 -30601 18714 -2408 10692 4318 7278 12449 -7397 34176 -8452 29311 7141 36529 2702 19056 8172 1088 215 -11731 -2948 -2114 -2547 1404 -2979 -2679 -2704 5679 -6736 578 4011 -782 6920 -771 2515 2864 6045 -302 -172 497 -2390 5725 -4160 2959 365 650 158 1426 -854 2913 946 -2222 653 -959 2657 -878 -271 893 -4078 3381 -1219 -1696 -3259 -1835 154 -2140 38 -1857 1572 2144 1227 324 419 1737 -542 2618 608 945 986 459 -491 -1211 -83 -465 -261 -1122 -1850 -762 -2004 884 -377 470 -451 708 -1601 574 1364 -685 726 35 -386 -540 202 1556 160 442 -474 -33 1891 507 56 -171 201 69 591 -660 -412 -491 553 982 -544 -308 -749 224 -169 -617 519 -731 262 175 -3162 1213 663 808 523 407 -2492 -752 812 -1606 848 -134 -165 -7 -2299 893 -145 609 278 479 790 -545 1652 -624 1686 570 2470 265 1537 722 112 26 -1926 -524 -415 -533 296 -668 -604 -618 1200 -1613 130 907 -200 1797 -233 789 938 1979 -108 -61 173 -850 1943 -1683 1236 171 311 73 619 -378 1342 505 -1347 404 -602 1548 -492 -137 409 -1912 1573 -679 -1083 -2368 -1424 124 -1874 35 -1826 1549 2109 1182 295 353 1353 -426 2141 568 992 1158 583 -631 -1484 -92 -485 -274 -1278 -2248 -960 -2691 1230 -574 763 -764 1175 -2592 853 1911 -973 1055 54 -635 -904 330 2447 246 650 -676 -44 2556 751 91 -297 364 129 1148 -1372 -898 -1100 1252 2225 -1222 -662 -1553 449 SS 20230710T120824.5Z 8591.505839 267 1 5.46 2 64.24 81.76 34.20 204.14 0.00 1 0.00 1 0 17 1.414e-02 7.090e-03 6.542e-03 2.034e-03 3.162458e-01 1.045835e-03 3.732805e-03 -6.000000e+00 8.275982e-03 232.84 -2.00 3.49 -2.00 317.28 0.00e+00 4.505878e-04 1.343883e-04 6.757769e-05 -6.000000e+00 3.267840e-04 289.65 -2.00 20.00 -2.00 316.95 0.00e+00 2.286 0.000 302.00 328.00 3 2.1121e+00 2.7793e-03 2.8359e-02 -6.0000e+00 2.0971e-02 4.2240e-02 3.0925e-03 1.6435e-02 -6.0000e+00 2.2756e-02 -1.5738e-02 1.8812e-03 8.0168e-03 -6.0000e+00 1.3326e-02 2.8542e-03 9.2606e-04 2.2355e-03 -6.0000e+00 5.4944e-03 4.3012e-03 -2.2866e-04 5.8550e-05 2.5270e-05 -6.0000e+00 3.8944e-04 -8.3040e-03 -3.1917e-05 12 9 1 12 1 1 98.44 19.71 0.30 -0.00830 -0.01002 14 26 1 5 0 353.000 26.41 19.99 19.71 30.14 21.5 1060.65 -828 -4350 -598 -5233 -5297 -4919 -386 -2037 105 -4092 -5749 -2802 -854 -177 339 480 -116 2025 733 696 100 -230 2024 1527 -307 1223 463 -383 -537 804 1198 968 2802 -1282 -3140 -2971 -2273 -756 -950 -418 -949 -1212 -426 183 104 -296 -722 325 -530 -22 503 678 1100 1247 1265 890 71 311 -275 842 700 1668 1986 1888 44 -550 9 -502 917 1008 258 615 9 679 -217 63 -549 -767 -150 -856 -824 -1111 -2332 -1804 -1524 -1081 -329 341 443 430 296 482 233 507 452 127 737 1011 117 -271 -563 -1029 -436 194 -1017 -1340 -956 -1272 -284 514 60 45 328 86 358 302 690 651 444 194 -578 145 486 360 711 352 263 1374 987 169 193 -340 -59 79 -307 -282 -408 249 -63 -224 -167 -462 -291 -83 -499 -68 -592 -538 -477 -38 -229 13 -555 -796 -391 -132 -29 65 103 -26 473 182 168 25 -57 502 403 -88 358 137 -108 -143 209 332 296 918 -454 -1076 -992 -818 -293 -418 -215 -511 -690 -249 107 61 -175 -423 185 -301 -12 303 418 719 861 907 623 51 223 -194 584 500 1266 1563 1598 38 -452 7 -395 718 892 242 576 9 642 -193 53 -439 -585 -119 -732 -762 -1095 -2399 -1940 -1676 -1269 -390 415 540 508 339 524 244 511 481 144 892 1306 158 -364 -714 -1250 -513 231 -1273 -1721 -1280 -1729 -403 748 90 69 490 125 496 407 916 900 634 285 -878 217 702 519 1007 476 353 1815 1345 243 283 -519 -92 123 -493 -478 -692 428 -110 -381 -282 -750 -474 SS 20230710T121647.0Z 8591.511655 273 1 49.82 2 62.65 83.00 34.85 207.54 0.00 1 0.00 1 0 17 1.735e-01 1.634e-02 1.142e-01 1.462e-02 2.894617e-01 7.503500e-03 3.372864e-03 -6.000000e+00 1.016453e-01 232.84 -2.00 3.49 -2.00 318.55 0.00e+00 8.074014e-04 1.309978e-03 8.713839e-05 -6.000000e+00 4.007768e-03 289.65 -2.00 20.00 -2.00 318.20 0.00e+00 2.165 0.000 302.00 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