File name: Pandora55s1_QueensNY_20210703_L2Fit_fout2c11d20210101p1-8.txt File generation date: 20260625T191108.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c11p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora55_OF_v4d20190723.txt Instrument calibration file used: Pandora55s1_CF_v11d20210101.txt Level 1 file used: Pandora55s1_QueensNY_20210703_L1_smca1c11d20210101p1-8.txt Full location name: Queens College NYSDEC (USEPA AQS ID 36-081-0124) Short location name: QueensNY Country of location: USA Location latitude [deg]: 40.7361 Location longitude [deg]: -73.8215 Location altitude [m]: 25 Local noon date: 20210703 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: 261 404 Nominal wavelengths inside fitting window [nm]: 305.0145 305.1546 305.2946 305.4346 305.5746 305.7145 305.8545 305.9945 306.1344 306.2744 306.4143 306.5542 306.6941 306.8340 306.9739 307.1138 307.2536 307.3935 307.5333 307.6732 307.8130 307.9528 308.0926 308.2324 308.3722 308.5120 308.6517 308.7915 308.9312 309.0710 309.2107 309.3504 309.4901 309.6298 309.7695 309.9091 310.0488 310.1884 310.3281 310.4677 310.6073 310.7469 310.8865 311.0261 311.1657 311.3053 311.4448 311.5844 311.7239 311.8634 312.0029 312.1424 312.2819 312.4214 312.5609 312.7003 312.8398 312.9792 313.1187 313.2581 313.3975 313.5369 313.6763 313.8156 313.9550 314.0944 314.2337 314.3730 314.5124 314.6517 314.7910 314.9303 315.0695 315.2088 315.3481 315.4873 315.6265 315.7658 315.9050 316.0442 316.1834 316.3226 316.4617 316.6009 316.7401 316.8792 317.0183 317.1574 317.2966 317.4357 317.5747 317.7138 317.8529 317.9919 318.1310 318.2700 318.4090 318.5481 318.6871 318.8260 318.9650 319.1040 319.2429 319.3819 319.5208 319.6598 319.7987 319.9376 320.0765 320.2153 320.3542 320.4931 320.6319 320.7708 320.9096 321.0484 321.1872 321.3260 321.4648 321.6036 321.7423 321.8811 322.0198 322.1586 322.2973 322.4360 322.5747 322.7134 322.8520 322.9907 323.1294 323.2680 323.4066 323.5453 323.6839 323.8225 323.9611 324.0996 324.2382 324.3768 324.5153 324.6538 324.7924 324.9309 --------------------------------------------------------------------------------------- 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 100-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-387: 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 20210703T185509.7Z 7854.788307 479 1 50.22 2 30.11 242.48 92.01 283.72 0.00 1 0.00 1 0 17 9.562e-03 6.773e-03 1.549e-03 1.001e-03 1.923591e-01 5.368677e-04 2.308513e-03 -6.000000e+00 5.777560e-03 232.89 -2.00 3.51 -2.00 315.18 0.00e+00 -1.313418e-04 4.829784e-05 3.745164e-05 -6.000000e+00 2.570560e-04 288.45 -2.00 20.00 -2.00 314.47 0.00e+00 1.155 0.000 302.00 328.00 3 4.5220e+00 1.3921e-03 1.5447e-02 -6.0000e+00 1.4493e-02 2.2840e-02 1.5407e-03 1.0005e-02 -6.0000e+00 1.5630e-02 1.1170e-04 8.7811e-04 4.8542e-03 -6.0000e+00 9.3135e-03 -1.7199e-03 3.8196e-04 1.3210e-03 -6.0000e+00 3.8926e-03 1.4499e-03 8.8150e-05 3.0603e-05 1.9022e-05 -6.0000e+00 2.8579e-04 4.7065e-03 1.0800e-04 11 8 0 10 0 0 99.99 22.87 0.22 0.00471 0.00537 45 9 1 5 0 1115.780 25.68 20.00 22.87 23.63 29.3 1068.46 -923 -1080 -820 -5150 -1594 1404 -101 2841 1047 -541 -426 621 290 -1536 1606 -762 -1149 502 1438 656 450 1148 1507 186 699 -296 135 -1036 -180 1185 1079 1861 1064 -1943 -489 1807 -164 -264 985 -554 -1234 -553 -1357 -1279 -990 -487 -1369 -553 -635 704 414 14 383 1097 868 636 1283 340 884 801 1478 1496 963 158 -626 -699 237 -69 1550 524 -11 -543 -419 -556 -377 -139 121 1004 1097 361 -295 -619 -1368 -1052 -1162 -1179 -823 -435 -478 -478 -206 130 238 1480 1308 1128 569 682 -349 -563 -348 -413 103 959 -37 -643 -182 -555 -225 337 -13 -493 -148 -282 -228 404 617 775 655 -12 -707 -361 -151 96 188 251 274 1218 981 226 498 73 310 204 258 -182 22 178 -272 -589 -201 -344 -382 -136 -268 -337 -261 -1639 -460 374 -27 808 328 -180 -143 206 101 -586 650 -335 -523 231 668 314 219 558 733 93 361 -159 72 -545 -90 564 514 912 548 -1046 -258 911 -85 -149 614 -386 -928 -432 -1088 -1037 -800 -392 -1094 -432 -486 529 314 11 310 912 738 549 1120 299 773 696 1287 1334 898 153 -622 -683 219 -61 1357 483 -11 -560 -439 -580 -384 -135 111 866 926 315 -274 -613 -1432 -1137 -1297 -1366 -989 -538 -598 -597 -251 151 262 1543 1344 1195 636 805 -434 -718 -440 -503 121 1096 -44 -787 -230 -721 -299 457 -18 -704 -212 -394 -306 516 761 953 824 -16 -964 -500 -209 130 249 324 344 1481 1191 283 642 97 415 276 356 -259 33 264 -410 -892 -301 -509 -555 -196 SS 20210703T190611.1Z 7854.795961 486 1 10.32 2 31.99 245.79 93.95 285.52 0.00 1 0.00 1 0 17 9.471e-03 6.723e-03 2.895e-03 1.950e-03 1.950637e-01 1.047966e-03 2.342698e-03 -6.000000e+00 5.722763e-03 232.89 -2.00 3.51 -2.00 314.99 0.00e+00 -1.315557e-04 9.094848e-05 2.133328e-05 -6.000000e+00 2.545997e-04 288.45 -2.00 20.00 -2.00 314.31 0.00e+00 1.178 0.000 302.00 328.00 3 4.1486e+00 2.7120e-03 1.5713e-02 -6.0000e+00 1.4356e-02 2.6343e-02 2.9985e-03 1.0146e-02 -6.0000e+00 1.5481e-02 -1.8130e-03 1.7096e-03 4.9238e-03 -6.0000e+00 9.2250e-03 -3.3198e-04 7.3963e-04 1.3420e-03 -6.0000e+00 3.8560e-03 2.0465e-03 -8.7381e-06 5.9433e-05 1.9463e-05 -6.0000e+00 2.8305e-04 4.0576e-03 1.0492e-04 12 9 1 12 1 1 99.52 22.88 0.18 0.00406 0.00399 7 8 1 5 0 1267.350 25.68 20.00 22.88 23.99 29.5 1070.28 -1386 -2314 -968 -4594 -768 1182 2484 2683 534 -1443 -143 1330 949 -683 1502 -761 -1668 843 2 257 276 1381 1092 980 678 -858 360 -1349 424 988 960 1621 1511 -1232 -240 1676 -468 116 781 -444 -1319 -424 -1501 -1276 -773 -428 -1023 -492 -413 326 108 -58 532 744 987 86 983 276 848 855 1301 1449 1055 63 -964 -435 379 961 1279 803 35 -217 -450 -646 86 -419 4 732 1016 180 -135 -662 -1459 -1071 -1253 -862 -562 -414 -613 -444 -508 43 245 937 1361 965 536 477 -349 -683 -386 -249 17 887 319 -738 -72 -423 -298 -202 -70 -548 -227 -47 -259 346 740 1229 634 132 -549 -489 -28 -15 410 281 664 988 973 371 564 306 168 158 387 -137 -166 12 -598 -421 -564 -435 -326 187 -433 -779 -329 -1561 -237 340 713 823 179 -514 -51 469 349 -274 640 -350 -797 404 1 129 140 699 554 508 364 -477 200 -739 220 494 479 830 808 -686 -131 882 -254 67 500 -316 -1009 -336 -1220 -1046 -632 -349 -827 -390 -321 249 83 -46 436 627 850 75 867 246 749 750 1143 1303 988 61 -964 -426 352 855 1132 746 34 -223 -473 -676 88 -411 3 639 869 159 -127 -659 -1531 -1157 -1397 -994 -672 -508 -763 -551 -616 50 269 982 1404 1025 598 562 -431 -867 -486 -303 20 1013 373 -901 -91 -545 -393 -273 -97 -775 -322 -65 -345 440 909 1502 793 172 -742 -671 -38 -20 540 361 827 1198 1177 461 724 402 224 212 529 -194 -241 17 -891 -629 -839 -637 -468 266 SS 20210703T191429.8Z 7854.801734 492 1 50.23 2 33.43 248.11 95.40 286.89 0.00 1 0.00 1 0 17 1.475e-02 7.879e-03 2.873e-03 1.661e-03 2.015643e-01 8.869410e-04 2.393326e-03 -6.000000e+00 8.914077e-03 232.89 -2.00 3.51 -2.00 315.60 0.00e+00 -3.411116e-04 8.698879e-05 3.031286e-05 -6.000000e+00 3.965640e-04 288.45 -2.00 20.00 -2.00 314.86 0.00e+00 1.198 0.000 302.00 328.00 3 5.3616e+00 2.3096e-03 1.6071e-02 -6.0000e+00 2.2361e-02 3.2471e-02 2.5621e-03 1.0455e-02 -6.0000e+00 2.4114e-02 4.3520e-03 1.4612e-03 5.0630e-03 -6.0000e+00 1.4369e-02 -3.1715e-03 6.4593e-04 1.3862e-03 -6.0000e+00 6.0063e-03 5.8656e-04 1.9138e-04 5.0894e-05 1.8961e-05 -6.0000e+00 4.4087e-04 4.4903e-03 1.2787e-04 11 8 0 10 0 0 99.98 22.90 0.34 0.00449 0.00593 26 5 1 5 0 1931.250 25.79 19.99 22.90 24.37 29.5 1073.10 -1249 -817 3631 -6988 -1343 2223 -1070 6901 919 -917 -2149 917 -1947 -5305 2902 119 -3176 -250 3074 1267 858 740 1085 -482 479 -1025 2532 -1339 -410 748 372 1542 1078 -3824 -940 3623 -757 -908 1872 -11 -1698 -17 -2061 -1213 -455 923 -1722 94 -295 964 -129 -322 -16 929 1961 812 1873 832 1357 686 1150 1791 895 -134 -157 -1361 170 -524 1993 62 -708 -432 -34 -446 -10 -445 -13 836 524 38 -774 80 -1323 -1018 -1457 -1085 -706 -287 -762 -206 115 73 202 284 648 1408 258 559 13 -410 -289 -480 65 1086 -57 -729 -333 -455 -155 923 204 -592 130 -77 -490 161 387 603 164 -63 -763 -438 441 857 38 214 266 1026 413 -185 376 204 523 84 492 -66 422 188 -296 -452 -348 -470 -350 -385 -302 -213 934 -1905 -324 488 -244 1590 245 -260 -623 259 -592 -1808 1016 46 -1307 -103 1261 539 373 324 475 -220 225 -503 1217 -643 -186 324 161 687 507 -1922 -456 1649 -362 -475 1083 -7 -1224 -13 -1598 -946 -352 708 -1328 70 -216 692 -94 -244 -13 749 1612 684 1589 714 1153 581 977 1556 817 -129 -153 -1318 155 -457 1702 56 -693 -442 -35 -463 -10 -431 -12 706 434 32 -715 79 -1380 -1099 -1633 -1263 -854 -358 -965 -259 141 86 222 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