File name: Pandora206s1_BuffaloNY_20241104_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T094229.0Z 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_20241104_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: 20241104 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 20241104T144430.9Z 9074.614247 127 1 7.62 2 66.24 144.44 95.71 124.02 0.00 1 0.00 1 0 17 3.353e-02 1.116e-02 4.236e-02 1.010e-02 2.850470e-01 4.950776e-03 3.477952e-03 -6.000000e+00 1.854976e-02 223.62 -2.00 3.55 -2.00 317.78 0.00e+00 1.064892e-03 8.078119e-04 1.765297e-04 -6.000000e+00 8.175472e-04 279.01 -2.00 20.00 -2.00 317.11 0.00e+00 2.464 0.000 302.00 328.00 3 5.5743e+00 1.3096e-02 2.8058e-02 -6.0000e+00 4.5742e-02 1.2902e-02 1.4821e-02 1.4778e-02 -6.0000e+00 4.9839e-02 -2.0158e-03 9.3821e-03 7.2913e-03 -6.0000e+00 2.9717e-02 -9.3058e-03 4.8276e-03 2.3213e-03 -6.0000e+00 1.2777e-02 1.3068e-04 4.3184e-05 2.8048e-04 2.3385e-05 -6.0000e+00 8.5307e-04 -4.2263e-02 2.2917e-04 12 9 9 12 1 1 999.00 18.13 0.76 -0.04226 -0.04194 1 7 4 8 0 3806.160 15.00 18.13 20.76 21.69 21.48 24.2 973.24 -1679 -11543 3299 -6424 6555 4541 12930 3345 -1388 13710 -10017 9683 -14523 -1119 2322 3618 5574 1156 4141 6523 2930 -2729 4509 2569 497 -6965 6578 -1653 -2631 1334 2382 -2129 3307 -1073 -2352 -2167 -4986 3646 -1126 846 -2441 1017 -1086 -2502 -766 -2189 -3229 -152 -1569 -1478 35 196 1904 1053 4437 1031 471 -1419 1603 -1847 1513 1742 1770 583 -199 -772 -1372 -1290 -88 1236 -39 2520 265 942 -787 192 -604 -764 -2245 -799 -1294 -866 -1470 -1965 -108 -400 1068 -293 1084 -4 -540 5861 2037 448 320 -450 726 -90 538 -79 -523 296 -2482 -594 -641 -1582 -1213 -384 690 -731 1082 216 -850 55 -62 91 -334 587 335 -1046 41 -491 679 -837 878 937 -455 815 839 781 374 -327 -926 227 203 373 778 -340 89 123 -181 -408 -664 -131 -1075 291 -605 474 311 853 269 -132 1215 -1120 887 -1909 -150 348 609 974 211 768 1282 589 -573 927 549 114 -1801 1520 -395 -610 289 547 -555 856 -311 -649 -586 -1438 1107 -431 364 -1213 512 -557 -1327 -397 -1159 -1710 -80 -818 -767 19 110 1110 657 2790 682 309 -951 1058 -1244 1007 1195 1328 463 -163 -611 -1010 -918 -64 1017 -35 2312 242 855 -681 153 -454 -540 -1654 -633 -1126 -807 -1492 -2016 -116 -451 1253 -362 1337 -5 -628 6050 1999 440 319 -486 863 -114 728 -107 -667 357 -2936 -698 -801 -2053 -1638 -525 981 -1094 1698 341 -1317 82 -87 123 -445 806 479 -1584 63 -749 1035 -1246 1252 1279 -616 1079 1158 1127 574 -509 -1477 370 342 646 1378 -624 161 221 -316 -708 -1121 SS 20241104T151400.2Z 9074.634725 142 1 45.80 2 63.39 151.62 91.56 128.75 0.00 1 0.00 1 0 17 9.294e-03 5.223e-03 3.567e-03 1.014e-03 2.532412e-01 4.954405e-04 3.121636e-03 -6.000000e+00 5.140175e-03 223.62 -2.00 3.55 -2.00 317.66 0.00e+00 4.556878e-04 7.722262e-05 6.547362e-05 -6.000000e+00 2.265555e-04 279.01 -2.00 20.00 -2.00 316.98 0.00e+00 2.220 0.000 302.00 328.00 3 3.6234e+00 1.3086e-03 2.5191e-02 -6.0000e+00 1.2675e-02 -2.4158e-02 1.4789e-03 1.3068e-02 -6.0000e+00 1.3812e-02 -4.7136e-03 9.0941e-04 6.4901e-03 -6.0000e+00 8.2356e-03 -2.0773e-03 4.6008e-04 1.8900e-03 -6.0000e+00 3.5398e-03 1.2433e-03 -1.8603e-04 2.8259e-05 2.0789e-05 -6.0000e+00 2.3647e-04 -4.1076e-02 1.8684e-04 10 0 0 10 0 0 99.97 18.14 0.36 -0.04108 -0.04247 183 57 1 8 0 250.240 15.00 18.14 22.75 21.69 21.48 24.3 985.05 -1602 -2370 -1540 -1986 -1819 -3136 -2264 -887 -346 -214 -802 -2819 -2007 -1510 698 -1031 -674 -2 1058 1300 862 286 670 518 -417 746 -363 -661 -871 497 469 782 1647 -208 -2380 -2594 -1981 -1317 -271 -268 -649 -1038 -565 -587 -320 -398 -356 -295 -510 -378 763 799 767 1387 702 926 1097 610 424 315 1021 1157 1390 1626 453 -182 -142 -678 294 305 470 380 244 575 183 -155 -238 -980 -201 -651 -994 -841 -1994 -1578 -1111 -630 -296 -78 271 284 399 329 225 356 743 125 280 786 253 -325 -112 -486 -674 -227 -464 -874 -702 -617 -462 108 282 291 69 102 -99 300 209 271 136 151 -296 -89 216 276 522 418 417 1005 719 230 391 15 -191 112 -14 -62 -169 200 -86 -314 -254 -317 -342 -152 -254 -171 -213 -170 -275 -206 -88 -39 -26 -96 -342 -269 -231 120 -203 -139 0 230 293 200 66 155 128 -109 201 -101 -175 -212 115 115 205 466 -64 -699 -718 -590 -447 -109 -117 -317 -533 -299 -316 -171 -213 -188 -152 -257 -189 395 446 452 860 456 609 738 413 282 207 680 825 1077 1359 390 -146 -104 -483 215 254 398 339 220 501 164 -126 -173 -670 -139 -512 -886 -763 -1975 -1619 -1215 -740 -367 -93 324 358 464 350 218 357 712 133 332 956 333 -427 -139 -603 -776 -264 -596 -1106 -926 -856 -670 165 427 451 112 154 -137 386 288 358 194 231 -470 -140 331 407 725 556 569 1347 956 330 592 24 -305 185 -23 -107 -299 362 -159 -567 -441 -534 -603 SS 20241104T170504.4Z 9074.711857 204 1 24.01 2 58.69 181.78 78.71 148.75 0.00 1 0.00 1 0 17 1.330e-01 3.190e-02 8.862e-02 2.065e-02 2.236264e-01 1.006038e-02 2.663687e-03 -6.000000e+00 7.355871e-02 223.61 -2.00 3.55 -2.00 317.64 0.00e+00 4.308180e-03 1.571807e-03 3.186860e-04 -6.000000e+00 3.241890e-03 279.00 -2.00 20.00 -2.00 316.98 0.00e+00 1.917 0.000 302.00 328.00 3 8.1832e+00 2.6529e-02 2.2007e-02 -6.0000e+00 1.8139e-01 6.3249e-02 3.0011e-02 1.2939e-02 -6.0000e+00 1.9763e-01 4.8588e-02 1.8662e-02 5.8356e-03 -6.0000e+00 1.1784e-01 -2.7420e-02 9.5163e-03 3.9057e-03 -6.0000e+00 5.0670e-02 1.6767e-05 -6.0497e-04 5.7773e-04 3.3096e-05 -6.0000e+00 3.3827e-03 -4.2242e-02 2.4478e-04 12 8 8 10 0 0 10.79 18.18 2.07 -0.04224 -0.04679 6 6 2 8 0 4000.000 15.00 18.18 21.19 21.69 21.58 24.4 976.05 -28593 84212 -6478 61561 -6571 58726 -5731 20151 12172 2497 -6730 23800 9335 -4134 24606 -9993 25621 -4508 13068 -9617 27805 -18103 31452 2250 12186 -24266 1778 5743 -14378 21091 -1692 7796 -10175 11164 -12900 17775 -15514 10179 3154 -2162 4213 -3118 5781 -4994 8123 -1572 2904 -8646 2665 -2626 3990 -4285 3155 120 4177 -415 1190 5062 -5842 -3302 -3121 4677 -3870 5203 -4534 4692 -6374 1768 -1043 1213 7152 732 4046 1658 3354 -1589 5210 -9163 -629 -10198 5353 -2864 -2669 -2469 -250 3557 3554 3761 -631 4141 -1936 4012 -186 -2672 -5644 -2502 -1017 2766 -4125 1410 1652 426 832 -2735 1717 -3950 1087 -3074 812 -1090 3162 180 -1392 -1462 -972 175 -2450 24 2044 1996 -231 -139 -1823 1456 499 1211 383 4451 445 -1966 2399 -282 361 -3378 1591 -1744 1911 1995 1463 -533 1557 -3630 -1184 -3634 4047 -787 3798 -678 3074 -566 1662 1202 290 -844 2164 1097 -629 3356 -2119 4144 -987 2589 -2402 5075 -4989 5413 539 2723 -7787 463 1376 -3903 4034 -418 1884 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