File name: Pandora272s1_Lauder_20260405_L2Fit_fout2c6d20241202p1-8.txt File generation date: 20260704T072204.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 Local principal investigator: Richard Querel Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 272 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora272_OF_v3d20240829.txt Instrument calibration file used: Pandora272s1_CF_v6d20241202.txt Level 1 file used: Pandora272s1_Lauder_20260405_L1_smca1c6d20241202p1-8.txt Full location name: Lauder Atmospheric Research Station Short location name: Lauder Country of location: New Zealand Location latitude [deg]: -45.0380 Location longitude [deg]: 169.6840 Location altitude [m]: 370 Local noon date: 20260405 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: 196 338 Nominal wavelengths inside fitting window [nm]: 305.0455 305.1861 305.3267 305.4672 305.6077 305.7483 305.8888 306.0293 306.1697 306.3102 306.4507 306.5911 306.7315 306.8720 307.0124 307.1528 307.2931 307.4335 307.5739 307.7142 307.8545 307.9949 308.1352 308.2755 308.4158 308.5560 308.6963 308.8365 308.9768 309.1170 309.2572 309.3974 309.5376 309.6778 309.8179 309.9581 310.0982 310.2383 310.3784 310.5185 310.6586 310.7987 310.9388 311.0788 311.2189 311.3589 311.4989 311.6389 311.7789 311.9189 312.0589 312.1988 312.3388 312.4787 312.6186 312.7585 312.8984 313.0383 313.1782 313.3180 313.4579 313.5977 313.7375 313.8773 314.0171 314.1569 314.2967 314.4364 314.5762 314.7159 314.8556 314.9954 315.1351 315.2747 315.4144 315.5541 315.6937 315.8334 315.9730 316.1126 316.2522 316.3918 316.5314 316.6710 316.8105 316.9501 317.0896 317.2291 317.3686 317.5081 317.6476 317.7871 317.9265 318.0660 318.2054 318.3448 318.4842 318.6236 318.7630 318.9024 319.0417 319.1811 319.3204 319.4598 319.5991 319.7384 319.8777 320.0169 320.1562 320.2955 320.4347 320.5739 320.7131 320.8523 320.9915 321.1307 321.2699 321.4090 321.5482 321.6873 321.8264 321.9655 322.1046 322.2437 322.3828 322.5219 322.6609 322.7999 322.9390 323.0780 323.2170 323.3560 323.4949 323.6339 323.7729 323.9118 324.0507 324.1896 324.3285 324.4674 324.6063 324.7452 324.8840 --------------------------------------------------------------------------------------- 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 20260404T222004.6Z 9590.930608 580 1 14.91 2 60.34 42.30 91.54 237.77 0.00 1 0.00 1 0 17 2.230e-02 1.007e-02 6.319e-03 2.975e-03 2.395498e-01 1.508733e-03 3.029950e-03 -6.000000e+00 1.277502e-02 225.99 -2.00 3.69 -2.00 316.26 0.00e+00 3.043643e-04 1.677300e-04 9.319931e-05 -6.000000e+00 5.554093e-04 278.00 -2.00 20.00 -2.00 315.66 0.00e+00 2.012 0.000 302.00 328.00 3 5.2069e+00 3.9050e-03 2.2995e-02 -6.0000e+00 3.1662e-02 3.0885e-02 4.3626e-03 1.2747e-02 -6.0000e+00 3.4366e-02 -1.2681e-02 2.5422e-03 6.2982e-03 -6.0000e+00 2.0440e-02 4.3664e-03 1.1992e-03 1.7984e-03 -6.0000e+00 8.7517e-03 3.2369e-04 2.8503e-04 8.5123e-05 2.1446e-05 -6.0000e+00 6.1256e-04 1.0122e-02 0.0000e+00 12 9 9 12 9 1 97.80 25.32 0.01 0.01012 0.01226 5 2 1 8 0 2484.870 20.00 25.32 16.76 35.25 33.75 1.0 949.59 1408 439 442 2285 10182 -4600 -5937 -8707 917 -7294 -10292 -3271 2562 -2024 -46 219 -2384 1573 -1790 2245 -2466 3286 -770 1546 1603 1091 1207 1233 2472 -300 -1297 2810 1892 3589 -7080 1571 -3269 -3678 169 821 -1299 1643 -829 660 633 303 261 -327 -3041 778 1659 1067 1105 154 867 113 1089 267 -964 1280 2216 1785 1788 1927 282 -820 710 -2459 128 600 1250 99 -199 784 161 -705 -688 -1430 -2212 -973 -1783 -1048 -1808 -2779 -1449 -97 134 179 573 97 -59 -234 -493 -150 -532 -404 46 1470 1054 1266 -235 -846 -2422 -32 389 -648 -569 81 -582 -82 629 268 -54 694 575 76 -739 494 -4 699 -158 207 965 526 821 765 -80 288 377 -270 625 -170 -101 -303 -355 -28 -134 302 101 -95 214 -627 -1027 246 84 87 412 1651 -752 -1038 -1729 183 -1672 -2402 -724 594 -557 -14 67 -783 513 -626 778 -910 1134 -283 584 631 447 497 477 872 -107 -489 1083 793 1532 -3153 622 -1476 -1767 93 490 -871 1117 -555 472 451 216 182 -224 -2085 511 1131 782 795 118 683 91 886 219 -785 1009 1773 1530 1555 1789 268 -730 614 -2119 111 546 1177 99 -202 763 157 -626 -587 -1150 -1826 -827 -1714 -1043 -1952 -2992 -1642 -117 161 223 720 119 -71 -258 -528 -151 -555 -435 55 1814 1335 1676 -299 -1010 -2885 -37 465 -833 -764 107 -816 -115 929 407 -80 1007 767 99 -951 648 -5 996 -225 292 1394 736 1083 1011 -101 355 488 -377 865 -247 -149 -436 -539 -44 -213 487 166 -154 335 -1002 -1598 SS 20260404T222947.0Z 9590.937349 582 1 53.15 2 59.22 39.83 92.91 236.07 0.00 1 0.00 1 0 17 5.544e-02 1.995e-02 7.327e-03 3.026e-03 2.361410e-01 1.532313e-03 2.909957e-03 -6.000000e+00 3.176118e-02 225.99 -2.00 3.69 -2.00 316.69 0.00e+00 3.995342e-04 1.879716e-04 8.550726e-05 -6.000000e+00 1.381131e-03 278.00 -2.00 20.00 -2.00 316.07 0.00e+00 1.946 0.000 302.00 328.00 3 6.4149e+00 3.9831e-03 2.2303e-02 -6.0000e+00 7.8718e-02 6.6092e-02 4.4613e-03 1.2429e-02 -6.0000e+00 8.5445e-02 -3.2313e-02 2.6211e-03 6.1260e-03 -6.0000e+00 5.0822e-02 2.0560e-02 1.2542e-03 1.8107e-03 -6.0000e+00 2.1755e-02 1.0206e-04 7.1950e-04 8.7780e-05 1.9804e-05 -6.0000e+00 1.5232e-03 1.1454e-02 0.0000e+00 12 9 8 11 8 0 99.90 25.31 -0.32 0.01145 0.01686 17 2 1 8 0 3126.060 19.99 25.31 17.19 35.25 33.75 1.0 951.51 11421 3217 3771 4429 34845 -6638 -8115 -19657 5131 -20660 -18651 -5698 5991 -2387 609 565 -11830 4379 -4549 2788 -468 4209 -5594 6460 828 4707 1393 7078 7243 48 -6051 3437 1523 13353 -15098 8966 -2059 -4766 1252 3181 -2901 6697 -1319 595 1440 1670 1627 1358 -7118 3919 2998 1069 1318 -96 819 -841 -80 -690 -3442 4888 5042 2529 70 2242 -2578 -3008 5128 -5909 2008 413 942 -430 -258 1985 -476 -741 -1066 -3257 -3093 -591 -2879 -910 -2585 -3522 -2065 686 528 239 1478 -1148 293 -1168 -707 18 -485 -542 -1213 1849 593 3893 462 -659 -3695 1736 1585 -564 -269 1443 -747 -430 810 -837 -626 1319 1501 259 -2015 789 -833 736 -75 -145 1509 -129 2050 1073 -1691 -10 -370 -991 1781 -301 520 -627 -521 192 -358 249 -177 496 59 -555 -1000 1655 548 649 703 3599 -993 -1298 -3886 874 -4780 -4161 -1135 1177 -577 161 164 -3659 1305 -1394 899 -143 1336 -1816 2149 275 1556 477 2358 2219 16 -2179 1196 580 4658 -5946 2966 -827 -2051 603 1761 -1869 4080 -896 400 954 1099 1049 852 -4736 2323 1877 727 940 -67 586 -621 -60 -515 -2588 3656 3862 1941 60 1990 -2405 -2606 3787 -4707 1533 360 900 -437 -263 1921 -442 -621 -881 -2577 -2493 -474 -2646 -907 -2813 -3733 -2302 800 649 306 1890 -1461 341 -1259 -751 18 -502 -614 -1415 2324 809 5102 593 -796 -4285 1918 1904 -736 -365 2022 -1040 -630 1240 -1331 -964 1865 2093 339 -2639 1037 -1184 1027 -109 -211 2117 -191 2801 1408 -2167 -12 -482 -1382 2544 -423 736 -919 -804 311 -602 426 -309 842 98 -889 -1560 SS 20260404T235102.7Z 9590.993781 644 1 54.15 2 52.40 16.75 103.11 220.80 0.00 1 0.00 1 0 17 9.015e-03 7.199e-03 1.020e-03 6.814e-04 1.945817e-01 3.488305e-04 2.498114e-03 -6.000000e+00 5.165387e-03 225.98 -2.00 3.69 -2.00 315.05 0.00e+00 3.166377e-04 3.000690e-05 3.595895e-05 -6.000000e+00 2.245566e-04 277.99 -2.00 20.00 -2.00 314.53 0.00e+00 1.635 0.000 302.00 328.00 3 4.2739e+00 8.9094e-04 1.8698e-02 -6.0000e+00 1.2802e-02 3.5318e-02 9.8879e-04 1.0385e-02 -6.0000e+00 1.3895e-02 -3.5873e-03 5.6775e-04 5.1252e-03 -6.0000e+00 8.2646e-03 -1.1732e-03 2.5475e-04 1.4582e-03 -6.0000e+00 3.5388e-03 1.2629e-03 1.2568e-04 1.9379e-05 1.9072e-05 -6.0000e+00 2.4767e-04 9.6161e-03 0.0000e+00 11 8 0 10 0 0 99.96 25.31 0.32 0.00962 0.01056 118 12 1 8 0 458.860 19.99 25.31 20.25 35.25 33.75 0.9 964.79 -281 241 -391 -1127 353 -1786 -1385 -1263 738 -1548 -2469 -1534 -823 -555 393 188 -312 646 268 1245 852 742 954 855 604 1268 701 112 380 265 387 1540 1267 813 -3300 -1729 -2821 -2001 -448 -62 -823 -148 -611 393 -289 -112 -168 -510 -1285 -203 563 524 832 916 849 698 813 207 84 479 957 1239 1479 1648 561 -274 -55 -1126 45 565 419 547 432 713 204 -132 -657 -1304 -1076 -1079 -1405 -973 -1818 -2703 -1212 -578 -176 356 730 404 392 82 -433 -429 -13 36 438 996 681 528 -63 -916 -1714 -489 -258 -742 -585 -266 -204 226 530 539 332 328 -113 -224 -234 23 283 590 94 314 608 345 611 503 -54 295 392 112 462 33 -98 -159 39 47 -131 362 120 -105 -296 -590 -970 -88 81 -134 -363 99 -524 -392 -393 249 -561 -886 -548 -297 -224 176 85 -147 309 133 628 437 377 491 433 318 685 382 58 191 129 195 808 666 442 -1750 -930 -1557 -1178 -291 -45 -620 -116 -491 316 -232 -89 -131 -405 -997 -154 439 413 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