File name: Pandora38s1_BayonneNJ_20240606_L2Fit_fout2c5d20230101p1-8.txt File generation date: 20240607T050228.8Z 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: 38 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora38_OF_v4d20201028.txt Instrument calibration file used: Pandora38s1_CF_v5d20230101.txt Level 1 file used: Pandora38s1_BayonneNJ_20240606_L1_smca1c5d20230101p1-8.txt Full location name: Bayonne NJDEP (USEPA AQS ID 34-017-0006) Short location name: BayonneNJ Country of location: USA Location latitude [deg]: 40.6703 Location longitude [deg]: -74.1261 Location altitude [m]: 3 Local noon date: 20240606 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: None First and last pixel inside fitting window: 259 401 Nominal wavelengths inside fitting window [nm]: 305.1040 305.2447 305.3854 305.5261 305.6667 305.8074 305.9480 306.0886 306.2292 306.3698 306.5104 306.6510 306.7916 306.9321 307.0727 307.2132 307.3537 307.4942 307.6347 307.7752 307.9157 308.0561 308.1966 308.3370 308.4775 308.6179 308.7583 308.8987 309.0391 309.1794 309.3198 309.4601 309.6005 309.7408 309.8811 310.0214 310.1617 310.3020 310.4423 310.5825 310.7228 310.8630 311.0032 311.1434 311.2836 311.4238 311.5640 311.7042 311.8443 311.9844 312.1246 312.2647 312.4048 312.5449 312.6850 312.8250 312.9651 313.1052 313.2452 313.3852 313.5252 313.6652 313.8052 313.9452 314.0852 314.2251 314.3651 314.5050 314.6449 314.7848 314.9247 315.0646 315.2045 315.3443 315.4842 315.6240 315.7639 315.9037 316.0435 316.1833 316.3231 316.4628 316.6026 316.7423 316.8821 317.0218 317.1615 317.3012 317.4409 317.5806 317.7202 317.8599 317.9995 318.1391 318.2788 318.4184 318.5580 318.6975 318.8371 318.9767 319.1162 319.2558 319.3953 319.5348 319.6743 319.8138 319.9533 320.0927 320.2322 320.3716 320.5110 320.6505 320.7899 320.9293 321.0686 321.2080 321.3474 321.4867 321.6261 321.7654 321.9047 322.0440 322.1833 322.3226 322.4618 322.6011 322.7403 322.8795 323.0188 323.1580 323.2972 323.4363 323.5755 323.7147 323.8538 323.9930 324.1321 324.2712 324.4103 324.5494 324.6884 324.8275 324.9666 --------------------------------------------------------------------------------------- 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 20240606T115914.4Z 8923.499472 126 1 47.77 2 63.62 81.81 61.32 78.19 0.00 1 0.00 1 0 17 1.172e-02 4.690e-03 7.911e-03 1.311e-03 3.279820e-01 6.845597e-04 3.848494e-03 -6.000000e+00 7.004320e-03 232.46 -2.00 3.51 -2.00 318.61 0.00e+00 4.170743e-04 1.423194e-04 1.274558e-04 -6.000000e+00 3.096746e-04 286.08 -2.00 20.00 -2.00 317.79 0.00e+00 2.237 0.000 302.00 328.00 3 3.3920e+00 1.8808e-03 2.8462e-02 -6.0000e+00 1.7567e-02 3.1289e-02 2.1481e-03 1.7328e-02 -6.0000e+00 1.8998e-02 -2.6630e-03 1.4167e-03 8.3707e-03 -6.0000e+00 1.1300e-02 -3.7654e-03 7.2190e-04 2.2897e-03 -6.0000e+00 4.7091e-03 1.2371e-03 -1.7187e-04 4.1102e-05 2.7758e-05 -6.0000e+00 3.4636e-04 -2.0726e-04 -2.3753e-05 12 1 1 12 1 1 99.95 21.58 0.20 -0.00021 -0.00150 147 35 1 5 0 322.720 26.62 20.01 21.58 31.57 36.7 986.21 -4145 961 -4197 -4110 -3264 -3993 -811 -943 121 -3227 -1193 -2957 -3575 -1578 -1066 -126 -1060 1141 284 -35 1382 234 691 597 1015 -993 224 -1571 -435 -361 849 1894 -466 -872 -2638 -2210 -1628 -1152 -646 -1295 -609 -1125 -564 -328 -328 -446 -431 -580 -172 152 467 1075 1094 477 636 900 503 410 85 938 1265 1362 1778 817 455 -288 -207 270 745 708 335 379 255 76 214 -277 -253 -474 -557 -803 -764 -1498 -1505 -1398 -1099 -758 -285 -56 194 342 366 550 423 552 882 606 988 455 46 -433 -601 -400 -153 -253 -601 -790 -617 -368 38 238 128 -136 17 -43 144 312 543 260 254 -326 -100 -220 -42 414 365 326 722 559 381 293 -47 -199 24 -34 -30 -88 149 -84 -174 -85 -159 -68 -230 -204 49 -225 -226 -164 -201 -43 -56 8 -225 -83 -225 -315 -145 -111 -14 -129 143 37 -5 190 33 100 92 164 -169 37 -251 -73 -61 140 341 -92 -175 -570 -438 -357 -297 -198 -459 -233 -454 -233 -136 -137 -185 -177 -236 -69 63 206 507 549 254 350 506 287 233 48 523 733 853 1204 589 325 -195 -133 173 517 550 283 331 220 62 162 -191 -160 -296 -373 -609 -651 -1416 -1394 -1368 -1147 -841 -330 -66 228 383 380 523 410 533 909 637 1156 589 62 -579 -754 -463 -169 -291 -743 -1033 -845 -528 57 357 202 -217 26 -67 209 428 746 375 391 -530 -165 -357 -66 619 521 442 943 745 545 450 -77 -336 42 -57 -53 -162 283 -162 -336 -160 -286 -118 -395 SS 20240606T120331.6Z 8923.502449 129 1 48.82 2 62.81 82.45 60.54 78.76 0.00 1 0.00 1 0 17 1.090e-02 4.616e-03 6.526e-03 1.041e-03 3.197566e-01 5.451091e-04 3.737369e-03 -6.000000e+00 6.511681e-03 232.46 -2.00 3.51 -2.00 318.91 0.00e+00 2.729576e-04 1.204624e-04 1.096762e-04 -6.000000e+00 2.878590e-04 286.08 -2.00 20.00 -2.00 318.09 0.00e+00 2.177 0.000 302.00 328.00 3 2.5474e+00 1.5139e-03 2.7685e-02 -6.0000e+00 1.6331e-02 1.6758e-02 1.7357e-03 1.6829e-02 -6.0000e+00 1.7661e-02 7.6024e-03 1.1447e-03 8.1498e-03 -6.0000e+00 1.0505e-02 -8.4545e-03 5.8256e-04 2.2408e-03 -6.0000e+00 4.3782e-03 3.1057e-03 -1.3409e-04 3.3306e-05 2.7296e-05 -6.0000e+00 3.2197e-04 -4.2262e-04 -8.3991e-06 10 0 0 10 0 0 99.96 21.58 0.21 -0.00042 -0.00143 901 206 1 5 0 54.170 26.73 20.00 21.58 31.82 36.9 989.39 -3774 -3106 -2453 -3107 -5288 -2556 -3771 -2509 -1365 -652 -1865 -1302 -48 -1526 1134 -1428 37 -626 5 493 -182 773 -226 833 239 122 -174 -423 458 90 1148 1146 480 -771 -1316 -1339 -1401 -339 -702 -933 -1815 -952 -907 -343 -670 -324 -266 -1232 -74 -267 527 561 980 925 383 975 571 703 139 1042 1064 1531 1838 636 618 -398 65 367 915 595 283 251 34 68 -67 -39 -420 -8 -147 -299 -639 -1502 -1556 -1614 -915 -636 -383 -26 43 457 239 495 516 1087 855 734 930 491 210 -494 -547 -409 23 -259 -593 -619 -743 -446 -52 106 165 -67 12 -113 188 208 537 263 336 -407 -84 -221 -133 502 271 359 755 696 295 250 -9 -256 -15 -200 24 -164 234 -160 -101 106 -195 38 -257 -190 -168 -133 -158 -253 -118 -192 -142 -84 -42 -122 -91 -4 -143 118 -152 4 -74 1 62 -23 110 -31 130 36 21 -27 -68 70 14 192 211 96 -157 -258 -267 -311 -80 -199 -304 -649 -354 -346 -131 -258 -124 -100 -463 -27 -102 213 243 451 448 193 502 299 365 72 532 566 877 1139 420 403 -246 38 214 577 421 218 199 27 51 -47 -25 -244 -5 -89 -205 -494 -1290 -1428 -1567 -944 -698 -440 -30 50 507 246 467 454 946 797 761 1073 626 281 -652 -677 -466 25 -293 -724 -799 -1006 -633 -79 169 277 -114 20 -173 266 281 725 373 507 -651 -136 -352 -205 739 381 480 970 911 415 378 -14 -422 -26 -355 45 -322 471 -330 -207 212 -375 70 -470 SS 20240606T121213.3Z 8923.508487 135 1 5.38 2 61.18 83.76 58.97 79.93 0.00 1 0.00 1 0 17 2.862e-02 7.542e-03 1.758e-02 5.107e-03 3.041241e-01 2.676084e-03 3.574426e-03 -6.000000e+00 1.710581e-02 232.46 -2.00 3.51 -2.00 317.38 0.00e+00 4.800690e-04 3.964440e-04 1.117785e-04 -6.000000e+00 7.558726e-04 286.08 -2.00 20.00 -2.00 316.57 0.00e+00 2.064 0.000 302.00 328.00 3 4.4831e+00 7.1468e-03 2.6232e-02 -6.0000e+00 4.2903e-02 3.9173e-02 8.0243e-03 1.5917e-02 -6.0000e+00 4.6391e-02 -5.6991e-03 4.8078e-03 7.6719e-03 -6.0000e+00 2.7594e-02 -8.1130e-04 2.3364e-03 2.1394e-03 -6.0000e+00 1.1503e-02 5.0757e-04 3.3208e-05 1.5586e-04 2.5186e-05 -6.0000e+00 8.4544e-04 1.2035e-04 8.9509e-05 12 9 1 12 1 1 91.30 21.58 0.20 0.00012 0.00037 3 8 1 5 0 1342.550 26.73 20.00 21.58 32.35 36.8 990.76 -11107 16030 -2445 6768 -15242 7048 304 -3795 1872 -8964 5880 -4657 332 3413 953 1003 1726 -2331 440 3197 1083 -112 1606 1736 1199 -242 2683 -3488 1430 530 3790 645 -8008 -682 -4427 952 -4416 732 -102 -1027 -800 -2065 370 -1956 1188 -663 433 -358 13 841 185 2008 1149 2164 -10 836 960 387 467 39 1681 -18 1366 149 1065 -602 -1315 -622 351 1553 -129 1019 -507 20 1368 -451 -43 -1027 -857 -986 611 -1940 -1500 -1221 -1209 -391 -908 405 -101 405 172 413 880 751 367 201 1096 295 428 -349 -242 -464 168 -277 -307 -684 -1088 -433 406 172 238 -571 413 -856 230 -23 429 19 342 -24 -475 57 17 573 211 640 738 106 608 -248 384 -151 390 390 -49 92 -174 57 -458 174 -433 -505 -90 -1196 1419 -261 614 -1582 578 29 -420 214 -1188 680 -639 49 529 173 198 357 -526 101 737 259 -27 396 453 331 -70 738 -965 360 136 1014 195 -2638 -225 -1454 299 -1516 282 -47 -515 -434 -1189 214 -1164 686 -388 247 -202 8 478 113 1211 742 1454 -7 601 699 281 334 28 1239 -14 1114 123 904 -486 -1009 -474 287 1328 -122 981 -491 18 1211 -367 -34 -797 -669 -867 562 -1911 -1570 -1346 -1357 -464 -1087 490 -122 488 193 443 875 741 387 225 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