File name: Pandora206s1_BuffaloNY_20240709_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T084256.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: Kang Sun Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 206 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora206_OF_v3d20211008.txt Instrument calibration file used: Pandora206s1_CF_v4d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20240709_L1_smca1c4d20220512p1-8.txt Full location name: University at Buffalo Short location name: BuffaloNY Country of location: Canada Location latitude [deg]: 43.0015 Location longitude [deg]: -78.7869 Location altitude [m]: 190 Local noon date: 20240709 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: 223 365 Nominal wavelengths inside fitting window [nm]: 305.0744 305.2154 305.3564 305.4973 305.6383 305.7792 305.9201 306.0611 306.2020 306.3428 306.4837 306.6246 306.7654 306.9063 307.0471 307.1879 307.3287 307.4695 307.6103 307.7511 307.8918 308.0326 308.1733 308.3140 308.4548 308.5955 308.7362 308.8768 309.0175 309.1582 309.2988 309.4394 309.5801 309.7207 309.8613 310.0019 310.1424 310.2830 310.4236 310.5641 310.7046 310.8451 310.9857 311.1261 311.2666 311.4071 311.5476 311.6880 311.8285 311.9689 312.1093 312.2497 312.3901 312.5305 312.6708 312.8112 312.9515 313.0919 313.2322 313.3725 313.5128 313.6531 313.7934 313.9336 314.0739 314.2141 314.3543 314.4946 314.6348 314.7750 314.9151 315.0553 315.1955 315.3356 315.4758 315.6159 315.7560 315.8961 316.0362 316.1763 316.3163 316.4564 316.5964 316.7364 316.8765 317.0165 317.1565 317.2964 317.4364 317.5764 317.7163 317.8563 317.9962 318.1361 318.2760 318.4159 318.5558 318.6956 318.8355 318.9753 319.1152 319.2550 319.3948 319.5346 319.6744 319.8141 319.9539 320.0937 320.2334 320.3731 320.5128 320.6525 320.7922 320.9319 321.0716 321.2112 321.3509 321.4905 321.6301 321.7697 321.9093 322.0489 322.1885 322.3280 322.4676 322.6071 322.7467 322.8862 323.0257 323.1652 323.3046 323.4441 323.5836 323.7230 323.8624 324.0018 324.1413 324.2806 324.4200 324.5594 324.6988 324.8381 324.9774 --------------------------------------------------------------------------------------- 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: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Temperature at electronics board 1 [°C], 999=no temperature signal Column 98: Temperature at electronics board 2 [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: 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 20240709T121526.3Z 8956.510721 121 1 24.00 2 65.23 81.95 100.94 58.68 0.00 1 0.00 1 0 17 3.250e-01 3.180e-02 2.553e-01 2.607e-02 3.257798e-01 1.330627e-02 4.382983e-03 -6.000000e+00 1.857704e-01 232.96 -2.00 3.55 -2.00 318.84 0.00e+00 1.439078e-03 2.961883e-03 2.107978e-03 -6.000000e+00 8.594864e-03 286.82 -2.00 20.00 -2.00 318.02 0.00e+00 2.371 0.000 302.00 328.00 3 7.8333e+00 3.7045e-02 3.0764e-02 -6.0000e+00 4.6670e-01 7.4705e-02 4.2761e-02 2.2768e-02 -6.0000e+00 5.0510e-01 5.2835e-02 3.0417e-02 9.0104e-03 -6.0000e+00 3.0055e-01 -2.2527e-02 1.5943e-02 3.1308e-03 -6.0000e+00 1.2859e-01 1.2689e-05 -2.2867e-03 7.4675e-04 2.7067e-05 -6.0000e+00 8.4249e-03 -1.3027e-02 2.6684e-04 12 8 8 10 0 0 20.68 18.68 3.03 -0.01303 -0.03021 6 6 2 8 0 4000.000 15.00 18.68 31.91 21.69 21.98 23.4 1033.12 -40757 900000 900000 62414 900000 3295 106458 42571 21998 77916 172514 29565 -29606 25697 8741 -12020 269497 31925 6508 -1741 57764 19144 -9202 16190 -7716 558 22550 14441 5706 9102 6756 14416 3176 15639 13363 -4262 32797 3617 29195 -4634 -2327 -12370 4537 -8892 -2672 -1365 -3616 3100 -7182 1205 -1247 7454 -9932 -148 -211 -4031 -1817 4640 -2742 -855 -10547 6386 -5150 -1284 -1609 -3015 -628 -5755 6248 802 5096 -2770 3119 3571 7156 -559 5082 4445 -1852 -771 -5578 2614 -5012 388 88 8739 3363 1802 94 1663 -1824 1269 5797 -5194 2413 -4789 6605 -1902 1624 479 3784 -2223 1640 -4187 1043 -926 -512 2134 -4064 -875 711 2174 -5485 -10 -3422 3591 -3408 1924 -3843 -2065 2203 343 -471 -408 4925 -2091 383 -1143 4851 -969 3810 -828 1519 -1466 45 330 914 1489 -528 2155 -505 -2455 -1108 -2259 900000 900000 1586 900000 118 2705 1256 901 1980 4383 1236 -2492 1469 694 -1346 6847 2585 718 -218 4261 1991 -1293 1890 -1207 84 2793 1846 738 1164 933 2026 552 2570 2168 -761 4569 755 5702 -1519 -830 -5117 1650 -3770 -1063 -541 -1453 1144 -2914 452 -510 3036 -5110 -73 -109 -2211 -1000 2394 -1487 -449 -6263 3447 -3422 -893 -1144 -2013 -381 -3587 3626 564 3803 -2344 2496 2736 4926 -384 2974 2477 -1146 -538 -4486 2161 -4819 368 90 8777 3751 2112 113 1899 -1988 1266 5065 -4865 2221 -5111 7254 -2472 2191 644 4615 -2642 1785 -4917 1275 -1178 -676 2890 -6159 -1377 1177 3627 -9572 -16 -5018 4723 -4776 2660 -5837 -3291 3429 533 -743 -615 6644 -2891 489 -1476 6381 -1454 5783 -1363 2487 -2560 79 615 1732 2867 -1048 4020 -956 -4553 -1963 SS 20240709T130155.6Z 8956.543004 148 1 26.90 2 56.77 89.54 93.74 66.92 0.00 1 0.00 1 0 17 1.034e-02 5.436e-03 8.198e-03 2.419e-03 2.431858e-01 1.218381e-03 2.928019e-03 -6.000000e+00 5.902484e-03 232.96 -2.00 3.55 -2.00 317.68 0.00e+00 2.390091e-04 1.889182e-04 6.334567e-05 -6.000000e+00 2.601551e-04 286.82 -2.00 20.00 -2.00 316.83 0.00e+00 1.819 0.000 302.00 328.00 3 4.9631e+00 3.2734e-03 2.2144e-02 -6.0000e+00 1.4839e-02 -2.0526e-02 3.6899e-03 1.2969e-02 -6.0000e+00 1.6056e-02 6.4469e-03 2.2171e-03 6.2652e-03 -6.0000e+00 9.5450e-03 -6.1319e-03 1.0918e-03 1.7146e-03 -6.0000e+00 4.0357e-03 4.7207e-04 5.9025e-06 6.7818e-05 1.7894e-05 -6.0000e+00 2.6372e-04 -1.8384e-02 1.4163e-04 10 0 0 10 0 0 99.95 18.70 0.35 -0.01838 -0.01834 55 55 2 8 0 488.980 15.00 18.70 33.90 21.69 21.98 23.6 1046.21 -1269 -2437 2841 -3423 1069 -3191 2921 -150 37 2214 -1674 -3017 -1419 -888 -844 179 158 840 -34 1522 462 1086 -1048 -236 211 211 26 -964 182 -308 879 68 3216 -147 -1851 -3276 -1953 -1156 109 -249 -1121 -629 -901 -858 -489 -548 -768 -435 -591 -222 0 834 721 1275 707 1021 531 585 588 88 786 1145 1505 1674 136 -73 -528 -1400 729 461 398 558 191 729 688 371 -395 -602 -364 -221 -1209 -515 -1866 -1442 -1012 -439 -62 12 296 119 629 433 419 35 701 185 402 434 422 -313 -270 -896 -657 -369 -671 -858 -824 -280 -501 314 233 477 167 -70 -304 115 7 48 71 164 -278 54 90 83 767 337 598 798 592 229 110 28 -351 230 256 -17 -30 315 -63 -153 -238 -335 -596 -131 -279 318 -384 100 -295 270 -16 4 276 -212 -389 -203 -144 -156 36 33 181 -8 353 111 255 -256 -61 57 59 7 -258 44 -73 221 18 918 -45 -532 -922 -598 -406 46 -113 -559 -324 -481 -463 -261 -294 -404 -221 -294 -109 0 463 422 785 452 661 353 388 381 57 520 813 1157 1377 113 -55 -373 -966 520 378 359 526 181 662 583 282 -272 -431 -246 -169 -1049 -491 -1927 -1543 -1161 -494 -74 15 364 141 742 467 412 33 699 205 494 545 562 -411 -332 -1116 -764 -444 -819 -1104 -1108 -393 -738 489 383 791 266 -104 -414 145 10 63 102 251 -438 83 137 121 1042 440 802 1072 785 325 165 43 -549 371 440 -32 -52 554 -112 -265 -431 -586 -1023 SS 20240709T135352.2Z 8956.579076 184 1 26.57 2 47.31 98.98 85.14 75.60 0.00 1 0.00 1 0 17 8.764e-03 5.906e-03 4.907e-03 2.330e-03 1.985436e-01 1.177081e-03 2.397480e-03 -6.000000e+00 5.005235e-03 232.96 -2.00 3.55 -2.00 316.40 0.00e+00 2.358454e-04 1.351303e-04 4.161356e-05 -6.000000e+00 2.205971e-04 286.83 -2.00 20.00 -2.00 315.62 0.00e+00 1.472 0.000 302.00 328.00 3 5.6149e+00 3.1023e-03 1.7958e-02 -6.0000e+00 1.2583e-02 -8.9442e-03 3.4641e-03 1.0538e-02 -6.0000e+00 1.3615e-02 5.2527e-03 1.9954e-03 5.0817e-03 -6.0000e+00 8.0940e-03 -4.4017e-03 9.2355e-04 1.3820e-03 -6.0000e+00 3.4224e-03 3.6931e-04 -4.3651e-05 6.3707e-05 1.5416e-05 -6.0000e+00 2.2361e-04 -1.8692e-02 1.4770e-04 10 0 0 10 0 0 99.80 18.71 0.59 -0.01869 -0.01902 17 17 4 8 0 1562.870 15.00 18.71 35.58 21.69 21.98 23.8 1057.21 -1487 -322 94 -3160 -1944 -3295 -936 1227 245 106 232 30 -748 -240 1280 175 736 1590 187 78 1937 -225 -44 -435 -209 381 1057 -191 -843 109 1197 1055 1899 1162 -2783 -1654 -1621 -1135 -429 -497 -617 -1052 -585 -998 -367 -889 -847 -157 -1093 -387 698 728 821 1136 825 895 991 99 693 544 336 1465 1079 1634 177 79 -688 -592 461 38 397 288 679 644 234 35 -369 -841 -842 -555 -991 -796 -1949 -1507 -885 -356 -27 12 452 282 596 315 -18 214 267 141 458 718 277 -226 -21 -625 -1198 -309 -253 -999 -917 -415 -339 375 321 165 -91 190 -280 -59 -22 578 188 266 -338 -114 84 317 765 440 658 871 606 265 345 70 -295 -68 -101 53 -49 300 -65 6 -334 -522 -564 -287 -67 20 -647 -339 -550 -161 230 52 24 51 6 -181 -65 384 53 227 548 61 26 660 -77 -15 -160 -80 150 416 -71 -315 39 446 415 798 464 -1164 -657 -707 -516 -233 -318 -394 -698 -399 -687 -249 -606 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