File name: Pandora159s1_Wakkerstroom_20230623_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20230626T100046.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Refilwe Kai Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 159 Spectrometer number: 1 Processing software version used: BlickP v1.8.49 Instrument operation file used: Pandora159_OF_v6d20191004.txt Instrument calibration file used: Pandora159s1_CF_v3d20201207.txt Level 1 file used: Pandora159s1_Wakkerstroom_20230623_L1_smca1c3d20201207p1-8.txt Full location name: Global Change Institute, University of Witwatersrand field site in Wakkerstroom Short location name: Wakkerstroom Country of location: South Africa Location latitude [deg]: -27.3493 Location longitude [deg]: 30.1438 Location altitude [m]: 1760 Local noon date: 20230623 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: 222 364 Nominal wavelengths inside fitting window [nm]: 305.0731 305.2139 305.3547 305.4955 305.6363 305.7770 305.9178 306.0585 306.1992 306.3399 306.4806 306.6213 306.7620 306.9026 307.0433 307.1839 307.3246 307.4652 307.6058 307.7464 307.8869 308.0275 308.1681 308.3086 308.4492 308.5897 308.7302 308.8707 309.0112 309.1517 309.2921 309.4326 309.5730 309.7135 309.8539 309.9943 310.1347 310.2751 310.4155 310.5558 310.6962 310.8365 310.9769 311.1172 311.2575 311.3978 311.5381 311.6784 311.8186 311.9589 312.0991 312.2393 312.3795 312.5198 312.6599 312.8001 312.9403 313.0805 313.2206 313.3607 313.5009 313.6410 313.7811 313.9212 314.0612 314.2013 314.3414 314.4814 314.6214 314.7615 314.9015 315.0415 315.1814 315.3214 315.4614 315.6013 315.7413 315.8812 316.0211 316.1610 316.3009 316.4408 316.5807 316.7205 316.8604 317.0002 317.1400 317.2798 317.4196 317.5594 317.6992 317.8389 317.9787 318.1184 318.2582 318.3979 318.5376 318.6773 318.8170 318.9566 319.0963 319.2359 319.3756 319.5152 319.6548 319.7944 319.9340 320.0736 320.2131 320.3527 320.4922 320.6318 320.7713 320.9108 321.0503 321.1898 321.3292 321.4687 321.6081 321.7476 321.8870 322.0264 322.1658 322.3052 322.4446 322.5839 322.7233 322.8626 323.0019 323.1413 323.2806 323.4199 323.5591 323.6984 323.8377 323.9769 324.1162 324.2554 324.3946 324.5338 324.6730 324.8121 324.9513 --------------------------------------------------------------------------------------- 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: 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 77: 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 78: 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 79: 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 80: 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 81: 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 82: Atmospheric variability [%], 999=no atmospheric variability was determined Column 83: Wavelength effective temperature [°C], 999=no effective temperature given Column 84: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 85: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 86: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 87: Number of bright count cycles Column 88: Number of dark count cycles Column 89: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 90: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 91: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 92: Integration time [ms] Column 93: Spectrometer control temperature [°C], 999=no temperature signal Column 94: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 95: Temperature in head sensor [°C], 999=no temperature signal Column 96: Temperature at electronics board 1 [°C], 999=no temperature signal Column 97: Temperature at electronics board 2 [°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 20230623T055838.2Z 8574.249053 56 1 49.54 2 77.54 55.06 125.12 88.04 0.00 1 0.00 1 0 25 1.069e-01 7.260e-03 5.359e-02 1.857e-03 4.932141e-01 9.511074e-04 5.128648e-03 -6.000000e+00 6.003835e-02 224.84 -2.00 3.06 -2.00 320.52 0.00e+00 1.801942e-02 3.574499e-04 3.838666e-03 -6.000000e+00 2.630218e-03 277.15 -2.00 20.00 -2.00 319.98 0.00e+00 4.511 0.001 302.00 328.00 3 1.9613e+00 2.8637e-03 5.3120e-02 -6.0000e+00 1.4847e-01 2.7395e-02 3.5792e-03 5.0703e-02 -6.0000e+00 1.6183e-01 -4.5676e-02 3.4750e-03 1.5796e-02 -6.0000e+00 9.6296e-02 1.7989e-02 1.7684e-03 2.2345e-02 -6.0000e+00 4.0940e-02 1.0334e-03 -1.2626e-03 5.3238e-05 1.1882e-04 -6.0000e+00 2.8573e-03 1.6164e-03 11 8 0 10 0 0 99.67 18.72 0.25 0.00162 -0.00787 128 28 4 8 0 386.920 15.00 18.72 12.17 21.17 21.06 24.8 826.82 -18375 -19200 5622 -51060 -35773 -51427 -32533 -56797 -7171 -28651 -38070 -23840 -19111 -12842 -11993 -5736 -2295 -3991 -6114 5208 -1929 8113 1801 -159 1711 -1402 277 -10561 -1823 -1457 23 295 721 -2571 2130 134 -79 -926 -996 407 -2420 -889 -2924 -1187 -1308 -400 -1203 1136 -165 1755 1647 799 3185 819 1089 1048 1248 -104 1185 1177 1030 449 299 294 -658 753 81 1273 974 458 -527 -115 -740 48 -436 455 607 29 596 -794 -1126 -1758 -2417 -1569 -1390 -1087 -297 -284 726 127 1338 1808 1768 2602 1803 1194 724 581 -575 116 -34 466 1261 649 -1116 -540 -715 -736 -350 -381 -474 -408 26 157 503 851 171 88 -641 -1280 -1200 -465 -604 -118 619 644 1329 1955 553 455 536 508 508 521 -282 -369 22 -232 -467 -196 -65 -256 303 -163 -205 51 -723 -434 -680 -354 -823 -66 -332 -490 -302 -305 -237 -284 -155 -68 -133 -227 182 -74 274 64 -6 61 -52 10 -438 -72 -64 1 18 51 -199 150 9 -6 -82 -104 48 -324 -125 -450 -189 -218 -69 -217 207 -31 344 351 189 793 222 303 295 352 -29 325 327 304 149 113 124 -292 317 33 512 427 231 -294 -67 -424 26 -217 202 249 12 272 -433 -714 -1157 -1730 -1171 -1103 -918 -263 -260 659 112 1086 1346 1345 1976 1522 1068 750 685 -744 149 -41 501 1239 650 -1228 -626 -874 -956 -489 -587 -797 -659 45 255 760 1219 248 134 -1049 -2220 -2089 -779 -979 -184 917 915 1797 2697 859 788 1002 919 952 1028 -596 -822 49 -540 -1091 -442 -140 -519 593 SS 20230623T060430.4Z 8574.253129 58 1 49.31 2 76.48 54.21 123.86 87.44 0.00 1 0.00 1 0 33 5.587e-02 7.228e-03 3.364e-02 1.439e-03 4.580773e-01 7.252854e-04 4.748386e-03 -6.000000e+00 3.136865e-02 224.84 -2.00 3.06 -2.00 320.23 0.00e+00 1.364122e-02 2.480153e-04 2.601655e-03 -6.000000e+00 1.374167e-03 277.15 -2.00 20.00 -2.00 319.67 0.00e+00 4.180 0.000 302.00 328.00 3 1.8183e+00 2.1207e-03 4.5041e-02 -6.0000e+00 7.7575e-02 1.5278e-02 2.5870e-03 3.8251e-02 -6.0000e+00 8.4547e-02 -2.6706e-02 2.3797e-03 1.2960e-02 -6.0000e+00 5.0310e-02 8.6381e-03 1.2344e-03 1.6072e-02 -6.0000e+00 2.1392e-02 1.6275e-03 -9.9856e-04 4.1621e-05 1.0343e-04 -6.0000e+00 1.4927e-03 6.7343e-04 12 9 1 12 1 1 99.97 18.72 0.28 0.00067 -0.00683 182 40 4 8 0 265.580 14.99 18.72 12.50 21.17 21.06 24.9 829.22 -26319 -11241 -1180 -20241 -12136 -19285 -8343 -21828 -10712 -21814 -1385 -28758 9032 -11019 -4356 -4240 -2402 2391 -2521 1525 -1957 2534 -5652 619 -6468 393 -5897 -1040 -4073 -1376 -1570 -1447 940 -3521 1560 -1128 -764 -2983 -452 -2443 -1897 -1485 -1344 77 -1677 26 -1023 494 -730 2546 883 2185 1045 1441 1122 1539 163 -120 1152 589 1698 459 1047 -7 -472 148 450 342 1696 138 -203 -263 -478 189 -235 736 -300 633 306 -819 -878 -1434 -2405 -1328 -1241 -1028 -207 -129 386 255 1432 1371 1742 2170 1612 900 1092 474 -582 -97 57 120 1099 906 -1121 -426 -1487 -620 -224 -247 -398 -439 -41 85 536 1013 599 46 -650 -1277 -1176 -591 -567 -197 669 478 1531 1948 666 569 372 330 257 549 -275 -434 44 -68 -535 -238 -32 -227 318 -339 -146 -15 -300 -150 -265 -104 -304 -156 -331 -19 -528 145 -284 -133 -154 -96 99 -119 73 -98 120 -288 30 -346 20 -324 -54 -220 -79 -106 -115 83 -342 137 -99 -73 -337 -59 -378 -321 -267 -256 15 -345 5 -222 108 -166 582 223 596 311 453 365 506 55 -40 374 193 582 177 452 -4 -217 70 203 155 823 71 -115 -155 -280 104 -131 365 -139 288 154 -486 -551 -1015 -1856 -1065 -1061 -938 -198 -128 379 242 1249 1101 1303 1617 1323 850 1177 583 -780 -129 71 134 1126 947 -1292 -517 -1915 -839 -325 -363 -635 -726 -67 130 821 1467 873 70 -993 -2070 -1917 -933 -937 -313 1007 691 2095 2715 1038 907 639 593 478 1069 -574 -955 100 -155 -1236 -531 -67 -457 620 SS 20230623T061051.7Z 8574.257542 61 1 51.13 2 75.34 53.28 122.49 86.79 0.00 1 0.00 1 0 25 3.833e-02 6.694e-03 1.631e-02 9.429e-04 4.273226e-01 4.739237e-04 4.482094e-03 -6.000000e+00 2.151732e-02 224.84 -2.00 3.06 -2.00 319.89 0.00e+00 9.959177e-03 1.453387e-04 1.754460e-03 -6.000000e+00 9.426379e-04 277.15 -2.00 20.00 -2.00 319.31 0.00e+00 3.875 0.000 302.00 328.00 3 1.3872e+00 1.3546e-03 3.9478e-02 -6.0000e+00 5.3212e-02 1.1846e-02 1.6140e-03 2.9489e-02 -6.0000e+00 5.7997e-02 -1.8686e-02 1.3791e-03 1.0909e-02 -6.0000e+00 3.4511e-02 3.6520e-03 7.2347e-04 1.1210e-02 -6.0000e+00 1.4673e-02 3.3283e-03 -9.6060e-04 2.7192e-05 7.3250e-05 -6.0000e+00 1.0240e-03 1.3551e-03 11 8 0 10 0 0 99.21 18.72 0.25 0.00136 -0.00586 324 70 2 8 0 152.140 14.99 18.72 12.99 21.17 21.06 25.1 832.27 6659 -18901 10584 -19482 1788 -17504 -6175 -10420 -12134 -4929 -9643 667 -11403 398 -4520 1366 -4861 3420 -2381 2776 -1585 2189 1614 -1426 -1682 -5266 -8 -4728 -233 -2665 2401 103 3243 -2895 130 731 -2540 -463 -929 -1210 -2626 -509 -1812 -222 -1063 -328 -814 191 37 1302 1594 879 1980 483 1045 664 710 -244 773 144 1078 662 711 420 -1052 696 98 1283 1351 373 -354 -12 -441 153 -197 605 622 528 774 -692 -655 -1506 -1961 -1393 -1052 -922 -371 -313 71 351 935 1132 1505 2359 1347 1148 778 480 -643 -190 -105 82 957 696 -1119 -766 -574 -751 0 -254 -376 -453 -27 176 504 1151 473 181 -368 -1018 -1203 -453 -578 -144 460 490 1260 1765 594 539 334 182 251 410 -184 -480 95 -119 -542 -200 -87 -125 304 95 -395 177 -418 29 -319 -104 -199 -255 -100 -206 14 -335 13 -193 64 -266 187 -148 172 -104 138 103 -96 -118 -392 -1 -347 -16 -203 199 10 346 -344 14 78 -303 -63 -151 -228 -551 -111 -420 -52 -259 -82 -207 49 10 345 455 275 659 172 383 249 270 -93 287 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