File name: Pandora32s1_GreenbeltMD_20240524_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240525T051155.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c12p1-8 Local principal investigator: Thomas Hanisco Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 32 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora32_OF_v1d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20240524_L1_smca1c12d20221109p1-8.txt Full location name: Goddard Space Flight Center Short location name: GreenbeltMD Country of location: USA Location latitude [deg]: 38.9926 Location longitude [deg]: -76.8396 Location altitude [m]: 90 Local noon date: 20240524 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: Based on session 11 with new SO2 and HCHO field cal First and last pixel inside fitting window: 259 401 Nominal wavelengths inside fitting window [nm]: 305.0059 305.1469 305.2878 305.4288 305.5697 305.7106 305.8515 305.9924 306.1333 306.2742 306.4150 306.5559 306.6967 306.8375 306.9783 307.1191 307.2599 307.4007 307.5415 307.6822 307.8230 307.9637 308.1044 308.2451 308.3858 308.5265 308.6672 308.8079 308.9485 309.0892 309.2298 309.3704 309.5110 309.6516 309.7922 309.9328 310.0733 310.2139 310.3544 310.4950 310.6355 310.7760 310.9165 311.0570 311.1974 311.3379 311.4784 311.6188 311.7592 311.8996 312.0400 312.1804 312.3208 312.4612 312.6015 312.7419 312.8822 313.0226 313.1629 313.3032 313.4435 313.5837 313.7240 313.8643 314.0045 314.1447 314.2849 314.4252 314.5654 314.7055 314.8457 314.9859 315.1260 315.2662 315.4063 315.5464 315.6865 315.8266 315.9667 316.1068 316.2468 316.3869 316.5269 316.6669 316.8070 316.9470 317.0869 317.2269 317.3669 317.5069 317.6468 317.7867 317.9266 318.0666 318.2065 318.3463 318.4862 318.6261 318.7659 318.9058 319.0456 319.1854 319.3252 319.4650 319.6048 319.7446 319.8843 320.0241 320.1638 320.3035 320.4432 320.5829 320.7226 320.8623 321.0020 321.1416 321.2813 321.4209 321.5605 321.7001 321.8397 321.9793 322.1189 322.2584 322.3980 322.5375 322.6770 322.8165 322.9560 323.0955 323.2350 323.3745 323.5139 323.6534 323.7928 323.9322 324.0716 324.2110 324.3504 324.4898 324.6291 324.7685 324.9078 --------------------------------------------------------------------------------------- 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 20240524T114050.5Z 8910.486696 232 1 33.63 2 70.13 78.72 106.16 247.41 0.00 1 0.00 1 0 17 6.144e-02 5.599e-03 1.294e-02 1.257e-03 4.564588e-01 6.443901e-04 5.259231e-03 -6.000000e+00 3.561043e-02 231.68 -2.00 3.47 -2.00 319.01 0.00e+00 1.294170e-03 1.535643e-04 3.069762e-04 -6.000000e+00 1.563252e-03 285.35 -2.00 20.00 -2.00 318.25 0.00e+00 2.910 0.000 302.00 328.00 3 2.6548e+00 1.7907e-03 3.7579e-02 -6.0000e+00 8.9266e-02 -8.7750e-03 2.0711e-03 2.3712e-02 -6.0000e+00 9.6468e-02 -1.6086e-02 1.5208e-03 1.1666e-02 -6.0000e+00 5.7387e-02 2.0768e-03 8.0261e-04 3.4577e-03 -6.0000e+00 2.4354e-02 1.1773e-03 -3.7070e-04 3.4849e-05 3.4793e-05 -6.0000e+00 1.6378e-03 6.3154e-03 -4.0912e-05 12 1 1 12 1 1 92.42 22.08 0.35 0.00632 0.00353 70 24 1 5 0 473.620 26.51 20.01 22.08 26.01 4.5 1017.32 -25696 -15087 -14051 -12101 -25449 -23255 -19280 -22503 -19163 -17175 -20773 -19632 -9052 -7203 -6562 -5031 -2128 -1543 -303 1488 -250 -1753 88 -1468 -2243 -879 -1999 -2061 -3016 -3001 -2032 -1144 2452 -2173 -2992 -3350 -3711 -929 -1584 -143 -26 268 -481 545 500 780 1021 73 207 -419 636 1281 1805 2043 1297 1487 829 -109 437 302 1234 1194 1881 2044 889 139 -38 173 125 832 674 324 238 49 -165 -342 -1033 -1176 -1627 -769 -1401 -1144 -1754 -1772 -1028 -697 -3 163 548 621 365 652 87 287 205 248 273 489 252 -238 -346 -798 -639 -170 -882 -1003 -680 -492 61 412 392 297 388 171 -2 154 127 113 63 -24 -248 148 328 338 414 330 73 643 387 139 32 -93 -190 32 32 -3 13 188 143 -166 -116 -271 -599 -690 -431 -431 -362 -796 -667 -553 -756 -714 -687 -808 -790 -380 -364 -401 -356 -162 -126 -26 134 -24 -170 9 -155 -259 -106 -251 -251 -354 -352 -259 -166 391 -361 -490 -576 -677 -176 -369 -40 -8 84 -158 182 169 265 349 25 72 -152 244 538 821 925 625 742 430 -58 225 152 627 652 1134 1270 588 90 -23 103 79 599 510 261 194 39 -121 -243 -667 -728 -1062 -570 -1135 -983 -1662 -1779 -1029 -746 -4 181 610 673 392 644 85 273 207 266 316 605 342 -315 -456 -1012 -743 -195 -1097 -1268 -899 -684 86 600 622 472 615 271 -4 223 181 167 95 -39 -388 236 506 504 618 473 104 915 568 216 52 -158 -333 56 60 -6 25 360 277 -328 -218 -504 -1077 SS 20240524T114608.6Z 8910.490377 235 1 48.60 2 69.12 79.48 107.08 248.10 0.00 1 0.00 1 0 17 4.496e-02 5.414e-03 5.157e-03 6.001e-04 4.381254e-01 3.084406e-04 5.078461e-03 -6.000000e+00 2.605981e-02 231.68 -2.00 3.47 -2.00 318.72 0.00e+00 9.950765e-04 6.698750e-05 2.983262e-04 -6.000000e+00 1.143828e-03 285.35 -2.00 20.00 -2.00 317.96 0.00e+00 2.778 0.000 302.00 328.00 3 1.7429e+00 8.4827e-04 3.5968e-02 -6.0000e+00 6.5325e-02 -6.8048e-03 9.7146e-04 2.2756e-02 -6.0000e+00 7.0591e-02 -1.5559e-02 6.8437e-04 1.1163e-02 -6.0000e+00 4.1993e-02 2.1168e-03 3.6051e-04 3.2189e-03 -6.0000e+00 1.7824e-02 3.3965e-03 -2.8265e-04 1.6676e-05 3.2477e-05 -6.0000e+00 1.1982e-03 5.4195e-03 -2.6174e-05 10 0 0 10 0 0 98.41 22.09 0.29 0.00542 0.00330 286 67 1 5 0 169.920 26.51 20.00 22.09 26.21 4.5 1019.14 -16248 -12131 -12050 -11402 -17447 -20725 -17907 -15239 -10057 -11819 -12143 -13497 -7199 -6473 -3053 -1674 -1038 863 727 103 270 -411 370 -40 -143 -1420 -1169 -2140 -2359 -1519 -885 240 1244 -772 -3029 -3084 -2925 -1557 -530 -338 -398 -458 -287 151 486 456 47 45 -334 -341 873 1021 1142 1402 1089 1188 1070 400 233 316 1043 1558 2089 1809 1067 234 136 -91 464 896 286 416 66 90 -124 -643 -734 -1334 -1308 -1008 -1297 -1189 -1729 -1692 -794 -557 -184 187 340 622 457 643 -49 216 250 192 326 483 245 -306 -382 -823 -677 -109 -773 -1090 -638 -574 -52 463 327 352 256 254 92 246 273 208 18 -29 -287 154 311 277 335 356 98 849 396 55 62 -114 -129 22 12 -64 -22 205 9 -219 -100 -274 -476 -518 -437 -426 -398 -649 -746 -651 -611 -439 -522 -554 -650 -375 -407 -224 -142 -97 85 76 11 31 -48 44 -5 -20 -210 -177 -317 -332 -211 -133 37 217 -149 -584 -569 -569 -348 -143 -101 -135 -167 -110 59 190 181 19 18 -135 -141 354 455 552 724 595 628 584 221 126 168 560 892 1320 1185 740 158 92 -60 305 669 226 349 56 74 -95 -474 -490 -912 -876 -769 -1078 -1053 -1685 -1653 -818 -614 -203 214 392 698 507 656 -49 209 258 210 384 611 324 -415 -491 -1011 -801 -128 -933 -1412 -823 -780 -74 690 506 572 413 390 137 344 393 297 28 -44 -455 240 488 420 484 514 136 1157 586 86 100 -186 -217 38 22 -118 -41 395 18 -417 -181 -493 -827 SS 20240524T115627.7Z 8910.497543 238 1 2.28 2 67.14 80.96 108.88 249.43 0.00 1 0.00 1 0 17 7.953e-02 1.079e-02 6.456e-02 8.722e-03 4.000074e-01 4.458782e-03 4.621314e-03 -6.000000e+00 4.609401e-02 231.68 -2.00 3.47 -2.00 318.41 0.00e+00 7.265084e-04 8.892021e-04 1.830482e-04 -6.000000e+00 2.023408e-03 285.35 -2.00 20.00 -2.00 317.65 0.00e+00 2.554 0.000 302.00 328.00 3 3.5771e+00 1.2154e-02 3.2935e-02 -6.0000e+00 1.1555e-01 -8.0814e-03 1.3845e-02 2.0717e-02 -6.0000e+00 1.2487e-01 -2.5636e-03 9.3583e-03 1.0114e-02 -6.0000e+00 7.4280e-02 -1.2925e-03 4.8918e-03 2.8922e-03 -6.0000e+00 3.1525e-02 7.0412e-04 8.1958e-05 2.4388e-04 2.9005e-05 -6.0000e+00 2.1199e-03 5.4512e-03 -6.0641e-05 12 9 9 12 1 1 999.00 22.13 0.39 0.00545 0.00607 1 10 1 5 0 1140.650 26.51 20.01 22.13 27.44 4.6 1027.17 -45979 -7876 -5326 -26985 26434 12760 32295 -45712 -3911 -16413 -3703 -4198 -9878 1441 -6920 -2538 9659 -6629 14594 -6 15017 -2733 12134 3077 604 6397 -3128 3198 -5591 925 -117 1173 9441 -5503 1977 -5131 -8028 -2053 -2375 3124 -926 -948 -2188 95 -1753 -556 1871 -1196 -1090 -1005 1404 3348 1855 2104 2022 1881 -326 -427 1064 508 913 943 1019 1732 427 1013 -1454 -1591 -685 797 1199 1190 1596 221 -265 -228 -1436 -2017 -1969 -2027 -1213 -781 -4226 -1438 898 -1413 1316 802 502 438 -221 1959 -67 792 -1804 -924 955 588 532 -1012 350 -1298 -669 632 -1159 -477 -174 -426 -629 1720 340 -999 841 629 288 -336 -379 960 261 684 -563 -463 739 -903 268 1051 -175 -336 558 543 960 -101 -627 -205 -361 -118 450 351 -225 -517 401 -501 -263 -2525 -350 -247 -1513 826 426 933 -3076 -203 -1037 -213 -250 -703 110 -671 -270 1003 -847 1635 -1 1819 -390 1535 448 96 1024 -555 521 -939 145 -20 220 1827 -1290 425 -1127 -1902 -527 -722 1055 -357 -386 -931 41 -763 -241 799 -520 -476 -445 641 1617 962 1146 1144 1092 -197 -259 631 299 542 590 685 1237 317 729 -1015 -1094 -487 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