File name: Pandora25s1_HoustonTX_20230525_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20240927T201455.4Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 Local principal investigator: Jimmy Flynn Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 25 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora25_OF_v7d20190903.txt Instrument calibration file used: Pandora25s1_CF_v6d20220503.txt Level 1 file used: Pandora25s1_HoustonTX_20230525_L1_smca1c6d20220503p1-8.txt Full location name: University Of Houston Short location name: HoustonTX Country of location: United States Location latitude [deg]: 29.7200 Location longitude [deg]: -95.3400 Location altitude [m]: 19 Local noon date: 20230525 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: Update session 4 for SO2 First and last pixel inside fitting window: 281 423 Nominal wavelengths inside fitting window [nm]: 305.1116 305.2524 305.3931 305.5338 305.6745 305.8152 305.9558 306.0965 306.2371 306.3777 306.5183 306.6589 306.7995 306.9401 307.0806 307.2212 307.3617 307.5022 307.6427 307.7832 307.9236 308.0641 308.2045 308.3449 308.4853 308.6257 308.7661 308.9065 309.0468 309.1872 309.3275 309.4678 309.6081 309.7484 309.8886 310.0289 310.1691 310.3093 310.4495 310.5897 310.7299 310.8701 311.0102 311.1504 311.2905 311.4306 311.5707 311.7108 311.8509 311.9909 312.1310 312.2710 312.4110 312.5510 312.6910 312.8310 312.9709 313.1109 313.2508 313.3907 313.5306 313.6705 313.8104 313.9503 314.0901 314.2300 314.3698 314.5096 314.6494 314.7892 314.9290 315.0687 315.2085 315.3482 315.4879 315.6276 315.7673 315.9070 316.0466 316.1863 316.3259 316.4656 316.6052 316.7448 316.8843 317.0239 317.1635 317.3030 317.4425 317.5821 317.7216 317.8611 318.0005 318.1400 318.2794 318.4189 318.5583 318.6977 318.8371 318.9765 319.1159 319.2552 319.3946 319.5339 319.6732 319.8125 319.9518 320.0911 320.2304 320.3696 320.5089 320.6481 320.7873 320.9265 321.0657 321.2049 321.3441 321.4832 321.6223 321.7615 321.9006 322.0397 322.1788 322.3178 322.4569 322.5960 322.7350 322.8740 323.0130 323.1520 323.2910 323.4300 323.5689 323.7079 323.8468 323.9857 324.1246 324.2635 324.4024 324.5413 324.6801 324.8190 324.9578 --------------------------------------------------------------------------------------- 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 20230525T121522.9Z 8545.510681 56 1 49.11 2 80.39 71.28 126.16 18.85 0.00 1 0.00 1 0 25 5.721e-01 2.602e-02 2.105e-01 7.134e-03 7.591066e-01 4.281182e-03 8.459515e-03 -6.000000e+00 3.415710e-01 230.99 -2.00 3.24 -2.00 321.45 0.00e+00 -8.077737e-03 2.306550e-03 4.826720e-03 -6.000000e+00 2.047340e-02 290.91 -2.00 20.00 -2.00 320.85 0.00e+00 5.709 0.002 302.00 328.00 3 3.2616e+00 1.5995e-02 7.1442e-02 -6.0000e+00 8.5591e-01 1.6487e-01 2.3425e-02 4.7891e-02 -6.0000e+00 9.3332e-01 -2.5912e-01 2.3088e-02 2.6180e-02 -6.0000e+00 5.5184e-01 1.1454e-01 1.0578e-02 7.8826e-03 -6.0000e+00 2.4389e-01 3.2046e-05 -1.3666e-03 2.1166e-04 1.3459e-04 -6.0000e+00 1.7921e-02 -2.9010e-02 2.2100e-04 12 8 8 10 0 0 68.42 24.81 0.39 -0.02901 -0.03928 19 4 1 5 0 2584.570 27.26 20.00 24.81 27.73 28.9 1100.00 900000 900000 900000 900000 900000 -309105 900000 -160650 900000 -197916 -192136 900000 -117371 900000 900000 -63860 -43530 900000 3662 900000 900000 900000 83120 900000 -94253 900000 -62964 900000 -22153 -124320 900000 900000 232952 -17386 -3216 900000 900000 900000 900000 7471 -16787 115144 39979 44318 100495 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-1449 -2418 1146 91 -476 1019 2396 607 -186 -583 -1763 2321 -1080 577 139 -1744 2433 -2790 -69 -3271 -5396 1060 -2871 -1285 2729 -2424 -1828 1244 3982 -1539 -891 1835 -585 -1154 -2960 -2571 -1336 3391 3102 1804 185 3141 464 2741 938 960 1592 -1752 -948 5183 -2264 -2002 1533 3555 -350 -1231 760 -4808 -1181 SS 20230525T122356.5Z 8545.516626 61 1 49.41 2 78.63 72.23 125.57 21.08 0.00 1 0.00 1 0 25 4.756e-01 1.217e-02 1.115e-01 2.855e-03 6.555472e-01 1.544692e-03 6.913322e-03 -6.000000e+00 2.792503e-01 230.99 -2.00 3.24 -2.00 320.80 0.00e+00 2.856595e-03 6.783955e-04 7.421528e-04 -6.000000e+00 1.273465e-02 290.91 -2.00 20.00 -2.00 320.11 0.00e+00 4.897 0.001 302.00 328.00 3 2.5783e+00 5.0798e-03 5.8421e-02 -6.0000e+00 6.9928e-01 9.7224e-02 6.7146e-03 3.2297e-02 -6.0000e+00 7.5665e-01 -1.4395e-01 6.1889e-03 1.6893e-02 -6.0000e+00 4.4816e-01 5.7090e-02 3.0226e-03 6.1470e-03 -6.0000e+00 1.9111e-01 1.4976e-04 -4.4640e-04 7.9043e-05 6.7797e-05 -6.0000e+00 1.3160e-02 -2.9762e-02 2.3250e-04 12 8 8 10 0 0 37.07 24.81 0.36 -0.02976 -0.03312 55 12 1 5 0 898.230 27.26 20.00 24.81 28.13 29.2 1100.00 -222027 900000 -175293 268536 -111108 -168988 900000 -161849 900000 -168023 -103044 -50364 -102464 -66757 -18784 -69673 -29123 34930 -4988 -12517 18233 -7158 -14143 26054 -43636 30615 -40504 30899 -26874 -35133 34466 14208 -162 -6035 -14183 19642 48943 57596 12302 -8967 3023 8531 7769 6289 20463 5036 -2567 -2188 10788 4924 10547 2329 -94 7441 1384 5860 5224 -2741 1095 -951 2983 2339 1094 3102 -1162 1478 3427 -400 5125 1803 4217 1192 1180 -743 2269 221 -4671 -1117 -1973 1101 -1558 -1282 -2544 -155 -1520 -997 -279 153 -170 1505 875 545 776 -593 -624 -32 -462 -295 369 -780 265 -1753 -1115 -1796 186 -947 -995 -986 36 -577 -313 558 478 297 -494 627 502 171 -442 -371 -214 435 903 452 594 841 465 819 811 360 567 -180 -25 683 -211 -275 -467 454 -137 -203 -58 -381 -652 -5472 900000 -3485 747 -1085 -2832 900000 -3134 900000 -4186 -1470 -497 -2079 -1233 -276 -1950 -630 458 -103 -293 328 -164 -364 502 -1732 644 -1679 644 -950 -1454 885 522 -8 -328 -804 812 1700 2182 859 -902 305 877 845 711 2064 599 -336 -295 1352 696 1568 416 -19 1501 312 1323 1220 -689 259 -227 708 610 325 1010 -413 504 1135 -141 1886 776 1944 588 578 -354 973 88 -1823 -427 -839 529 -880 -812 -1765 -111 -1165 -805 -233 131 -146 1241 687 406 558 -441 -507 -29 -475 -336 449 -965 312 -1937 -1144 -1849 199 -1071 -1175 -1225 48 -830 -485 900 777 473 -761 928 743 262 -710 -615 -354 701 1412 692 883 1214 656 1176 1260 613 1031 -344 -49 1400 -455 -616 -1065 1042 -317 -460 -126 -799 -1334 SS 20230525T122959.8Z 8545.520832 64 1 49.50 2 77.37 72.89 125.11 22.62 0.00 1 0.00 1 0 25 2.351e-01 6.396e-03 6.443e-02 1.705e-03 5.989545e-01 9.049643e-04 6.320320e-03 -6.000000e+00 1.374485e-01 230.99 -2.00 3.24 -2.00 320.37 0.00e+00 1.423949e-03 3.465656e-04 2.756173e-04 -6.000000e+00 6.165112e-03 290.91 -2.00 20.00 -2.00 319.63 0.00e+00 4.446 0.001 302.00 328.00 3 2.1861e+00 2.8097e-03 5.3163e-02 -6.0000e+00 3.4330e-01 1.8936e-02 3.5750e-03 2.9508e-02 -6.0000e+00 3.7107e-01 -3.3342e-02 3.2087e-03 1.4675e-02 -6.0000e+00 2.2080e-01 6.1061e-03 1.6147e-03 4.9702e-03 -6.0000e+00 9.3921e-02 3.6664e-04 -2.1574e-04 4.7316e-05 4.9557e-05 -6.0000e+00 6.4648e-03 -2.9625e-02 2.1041e-04 10 0 0 10 0 0 37.27 24.82 0.30 -0.02962 -0.03125 105 22 1 5 0 471.330 27.26 20.00 24.82 28.33 29.0 1100.00 -131939 -59189 -60169 -7231 -98371 -84871 900000 -75343 54149 -70401 -92927 32523 -70285 6413 -20184 -25369 -21048 12570 -13893 -11309 -6231 -22782 -8593 -13337 -17186 -3949 -15547 -14222 -4489 -23040 16532 1634 3268 -4803 -6777 1828 5483 16111 -1749 -1156 -3823 2711 -2230 2537 3436 1575 -1808 -2247 1671 92 4125 -740 1772 2410 540 1059 2646 -1754 1360 -434 1268 951 859 1303 -127 676 981 523 1236 1636 805 1290 542 357 1059 925 -2590 -1578 -654 -373 -1013 -1385 -1740 -1060 -624 -864 -79 419 676 913 895 1007 484 -270 -71 195 -111 634 251 -344 -69 -876 -809 -768 -47 -1039 -820 -848 -28 -509 191 295 334 -88 112 286 182 323 -364 -253 -383 175 380 271 38 663 84 1024 602 304 228 -6 -43 305 -90 -97 -253 138 -125 -148 -115 -347 -66 -1942 -510 -561 -40 -1190 -906 900000 -930 221 -1023 -1750 213 -1497 84 -416 -644 -574 277 -421 -355 -192 -827 -289 -513 -742 -160 -714 -628 -179 -1166 678 90 202 -340 -474 118 379 1196 -186 -144 -547 391 -353 393 537 255 -308 -396 295 17 833 -173 440 643 155 314 796 -550 406 -130 387 317 319 532 -55 282 402 220 563 836 451 749 315 200 548 439 -1190 -722 -324 -211 -654 -996 -1349 -858 -531 -775 -73 397 641 842 784 835 389 -221 -63 192 -121 756 319 -441 -84 -1010 -877 -834 -53 -1244 -1018 -1102 -38 -753 300 481 545 -141 172 426 270 494 -581 -417 -633 283 599 418 57 968 121 1477 935 510 407 -11 -82 605 -187 -208 -552 304 -276 -322 -241 -706 -130 SS 20230525T123535.2Z 8545.524713 67 1 49.52 2 76.21 73.50 124.66 24.03 0.00 1 0.00 1 0 25 1.651e-01 5.726e-03 4.016e-02 1.288e-03 5.571884e-01 6.747808e-04 5.935543e-03 -6.000000e+00 9.581938e-02 230.99 -2.00 3.24 -2.00 320.02 0.00e+00 9.599618e-04 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