File name: Pandora32s1_GreenbeltMD_20250301_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20250302T052830.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c12p1-8 Local principal investigator: Thomas Hanisco Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 32 Spectrometer number: 1 Processing software version used: BlickP v1.8.74 Instrument operation file used: Pandora32_OF_v2d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20250301_L1_smca1c12d20221109p1-8.txt Full location name: Goddard Space Flight Center Short location name: GreenbeltMD Country of location: USA Location latitude [deg]: 38.9926 Location longitude [deg]: -76.8396 Location altitude [m]: 90 Local noon date: 20250301 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: Based on session 11 with new SO2 and HCHO field cal First and last pixel inside fitting window: 259 401 Nominal wavelengths inside fitting window [nm]: 305.0059 305.1469 305.2878 305.4288 305.5697 305.7106 305.8515 305.9924 306.1333 306.2742 306.4150 306.5559 306.6967 306.8375 306.9783 307.1191 307.2599 307.4007 307.5415 307.6822 307.8230 307.9637 308.1044 308.2451 308.3858 308.5265 308.6672 308.8079 308.9485 309.0892 309.2298 309.3704 309.5110 309.6516 309.7922 309.9328 310.0733 310.2139 310.3544 310.4950 310.6355 310.7760 310.9165 311.0570 311.1974 311.3379 311.4784 311.6188 311.7592 311.8996 312.0400 312.1804 312.3208 312.4612 312.6015 312.7419 312.8822 313.0226 313.1629 313.3032 313.4435 313.5837 313.7240 313.8643 314.0045 314.1447 314.2849 314.4252 314.5654 314.7055 314.8457 314.9859 315.1260 315.2662 315.4063 315.5464 315.6865 315.8266 315.9667 316.1068 316.2468 316.3869 316.5269 316.6669 316.8070 316.9470 317.0869 317.2269 317.3669 317.5069 317.6468 317.7867 317.9266 318.0666 318.2065 318.3463 318.4862 318.6261 318.7659 318.9058 319.0456 319.1854 319.3252 319.4650 319.6048 319.7446 319.8843 320.0241 320.1638 320.3035 320.4432 320.5829 320.7226 320.8623 321.0020 321.1416 321.2813 321.4209 321.5605 321.7001 321.8397 321.9793 322.1189 322.2584 322.3980 322.5375 322.6770 322.8165 322.9560 323.0955 323.2350 323.3745 323.5139 323.6534 323.7928 323.9322 324.0716 324.2110 324.3504 324.4898 324.6291 324.7685 324.9078 --------------------------------------------------------------------------------------- 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 20250301T130611.6Z 9191.545968 78 1 48.82 2 74.64 113.17 84.31 93.88 0.00 1 0.00 1 0 17 1.675e-01 5.873e-03 6.867e-02 2.200e-03 5.633888e-01 1.128989e-03 6.424594e-03 -6.000000e+00 9.500583e-02 225.67 -2.00 3.47 -2.00 320.17 0.00e+00 2.038518e-03 3.863818e-04 4.129615e-04 -6.000000e+00 4.119034e-03 277.22 -2.00 20.00 -2.00 319.63 0.00e+00 3.705 0.001 302.00 328.00 3 2.9848e+00 3.2925e-03 4.6602e-02 -6.0000e+00 2.3543e-01 1.9858e-02 4.0807e-03 2.8992e-02 -6.0000e+00 2.5582e-01 -2.0646e-02 3.8464e-03 1.5125e-02 -6.0000e+00 1.5219e-01 3.0888e-03 1.9795e-03 5.3083e-03 -6.0000e+00 6.4984e-02 3.5244e-04 -5.4290e-05 6.0716e-05 5.5308e-05 -6.0000e+00 4.4556e-03 1.7479e-04 4.1375e-05 11 1 0 11 8 0 99.99 20.71 0.41 0.00017 -0.00023 108 25 1 5 0 451.980 25.68 19.85 20.71 15.48 5.5 955.17 22058 -69606 -52815 -68200 -38754 -61519 -74651 -7332 -59790 -26714 -45937 -66512 -7273 -38700 -11311 -6577 -17161 -12040 -11962 4124 -19629 -2528 -11944 -3450 -5069 -10743 2023 -17472 -5404 -5926 -787 3160 1384 3908 -9811 -2476 -2279 -369 -1907 -1563 3022 -1479 -1664 2406 3454 1962 780 2724 -923 -699 1831 1497 3282 1143 679 1580 1634 -87 -990 1027 257 1601 2025 2715 1120 -562 599 503 669 2017 717 -15 -772 271 -43 -655 -223 -2361 -1348 -1595 -817 -1022 -1504 -1472 -1013 -332 -79 587 222 597 927 1132 -78 -378 359 264 256 833 235 -115 -111 -658 -933 -433 -687 -1309 -717 -757 -192 570 327 552 93 583 128 227 169 -29 10 -335 -495 113 110 328 131 396 -98 974 440 59 162 -194 -216 -138 -90 17 -288 180 96 6 78 -182 -201 99 -869 -618 -944 -407 -765 -1004 -63 -909 -355 -708 -1349 -108 -906 -254 -171 -566 -416 -450 141 -888 -97 -515 -147 -241 -580 99 -1026 -272 -306 -44 200 104 291 -831 -187 -181 -34 -216 -215 456 -255 -303 436 627 368 151 527 -191 -151 420 384 841 325 207 498 533 -29 -328 325 83 549 779 1167 525 -265 267 224 319 1087 408 -9 -478 160 -24 -350 -108 -1130 -682 -940 -520 -745 -1219 -1269 -862 -300 -75 579 222 577 839 1015 -66 -319 325 254 283 979 307 -155 -142 -766 -1053 -477 -808 -1553 -887 -992 -269 825 524 887 152 964 199 334 245 -43 16 -564 -845 187 174 503 194 593 -141 1391 650 98 280 -357 -413 -263 -183 36 -639 385 205 14 162 -360 -400 SS 20250301T132615.3Z 9191.559900 88 1 35.09 2 71.10 116.83 80.49 96.90 0.00 1 0.00 1 0 17 9.834e-02 6.895e-03 4.666e-02 3.652e-03 4.769151e-01 1.848629e-03 5.505742e-03 -6.000000e+00 5.582232e-02 225.67 -2.00 3.47 -2.00 319.38 0.00e+00 1.168565e-03 4.925351e-04 2.859920e-04 -6.000000e+00 2.424165e-03 277.22 -2.00 20.00 -2.00 318.80 0.00e+00 3.050 0.000 302.00 328.00 3 4.4213e+00 5.1476e-03 3.8685e-02 -6.0000e+00 1.3834e-01 3.9316e-02 6.0410e-03 2.4191e-02 -6.0000e+00 1.5037e-01 -2.0434e-02 4.9052e-03 1.2295e-02 -6.0000e+00 8.9392e-02 3.7423e-03 2.6030e-03 3.9495e-03 -6.0000e+00 3.8438e-02 1.7071e-04 4.4159e-04 1.0195e-04 4.0238e-05 -6.0000e+00 2.6379e-03 -1.4811e-03 1.2016e-04 12 9 1 12 1 1 99.98 20.82 0.30 -0.00148 0.00184 14 5 1 5 0 2338.870 25.79 19.97 20.82 16.05 5.5 958.70 900000 -10245 -35448 -43915 -29452 -67819 -23109 -14056 -14744 -16655 -39093 -10712 -10996 -18601 1939 11091 -10592 1196 343 818 -1725 -13869 9166 -2955 -2097 -138 5838 -2224 -10132 -7251 -1694 -2641 8053 -3681 -1597 -4383 -2113 -2259 -2909 2884 -929 466 967 -496 3570 306 589 1685 2514 -1507 -387 1956 2426 2440 648 1484 611 -646 140 190 915 1391 1108 2155 -144 976 264 1457 502 1411 -586 -504 -301 -300 281 -54 -1831 -1834 -1846 -1216 -923 -1231 -898 -2178 -533 -724 177 95 -61 1039 350 1874 -50 199 989 542 -121 511 461 -147 14 -1231 -1024 -75 -422 -1340 -960 -7 73 40 458 433 142 136 431 -76 -64 201 198 -313 -199 -170 373 224 684 56 -415 868 182 297 52 229 -482 280 -92 5 -162 -417 255 251 248 -243 -648 900000 -197 -935 -1255 -682 -2102 -490 -307 -370 -465 -1393 -307 -363 -802 83 514 -668 73 23 56 -127 -1148 622 -239 -182 -13 516 -207 -973 -678 -164 -295 927 -513 -215 -581 -288 -353 -550 615 -232 123 266 -142 994 89 172 489 734 -469 -127 687 915 982 279 654 279 -300 64 85 410 658 576 1213 -87 572 149 801 292 905 -420 -379 -228 -220 194 -35 -1094 -1059 -1107 -812 -692 -1021 -800 -2046 -518 -742 188 104 -68 1116 361 1804 -46 180 933 561 -138 634 612 -200 18 -1519 -1180 -86 -505 -1693 -1251 -10 102 60 722 708 233 218 655 -111 -92 296 304 -502 -322 -273 582 342 1012 80 -581 1202 267 469 86 395 -852 507 -174 9 -323 -843 517 503 481 -457 -1191 SS 20250301T133105.2Z 9191.563254 91 1 1.17 2 70.26 117.74 79.57 97.64 0.00 1 0.00 1 0 25 1.102e-01 9.718e-03 6.645e-02 6.712e-03 4.566430e-01 3.369923e-03 5.363657e-03 -6.000000e+00 6.251100e-02 225.67 -2.00 3.47 -2.00 318.78 0.00e+00 1.755667e-03 7.451371e-04 1.657625e-04 -6.000000e+00 2.711318e-03 277.22 -2.00 20.00 -2.00 318.18 0.00e+00 2.929 0.000 302.00 328.00 3 2.3159e+00 9.1568e-03 3.7140e-02 -6.0000e+00 1.5490e-01 1.5817e-02 1.0515e-02 2.3235e-02 -6.0000e+00 1.6834e-01 -2.3424e-02 7.7576e-03 1.1633e-02 -6.0000e+00 1.0014e-01 4.9869e-03 4.1415e-03 3.7502e-03 -6.0000e+00 4.2751e-02 1.6259e-03 -5.3644e-04 1.8462e-04 3.7795e-05 -6.0000e+00 2.9330e-03 -1.1389e-03 -9.8240e-05 12 9 9 12 1 1 999.00 20.86 0.21 -0.00114 -0.00517 2 29 1 5 0 387.800 25.90 19.87 20.86 16.25 5.5 960.13 -44017 13160 -32082 48963 -50213 -46552 -7874 -47580 280 -35422 1942 -1896 -21933 24642 -4556 24981 3009 7307 -307 4510 11548 -9021 -375 -7377 -9231 -3205 -8675 3682 -7007 1810 -382 -4688 6663 -5775 -2927 -8915 -1122 -6156 -801 4289 1 1945 -1986 1895 595 4025 2183 -25 3673 2431 1142 1177 241 2906 801 1616 2063 -756 277 -1426 2474 -1043 2610 2458 607 -1303 -1032 104 -1236 2442 259 488 489 -49 -317 -994 -78 638 -1278 -1619 -870 -1634 -2548 -1386 -614 -1021 -1018 566 246 1248 -91 846 -993 918 590 894 -265 126 1078 -815 33 -914 -300 139 -1184 -735 -1484 -1056 399 366 27 917 681 261 547 -377 -145 86 -709 119 -107 771 -290 -40 811 583 265 396 1002 938 -447 -130 76 271 -30 -387 316 -285 330 -580 177 -95 -937 -1569 325 -1303 939 -2224 -1867 -228 -2221 10 -1824 73 -77 -1230 1090 -316 1543 252 630 -30 447 1116 -1053 -41 -911 -1244 -433 -1260 468 -941 225 -52 -759 1098 -1143 -557 -1715 -211 -1371 -202 1210 0 664 -726 688 220 1463 812 -10 1368 935 468 520 114 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