File name: Pandora75s1_EssexMD_20240605_L2Fit_fout2c1d20221230p1-8.txt File generation date: 20240606T050905.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 75 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora75_OF_v3d20220127.txt Instrument calibration file used: Pandora75s1_CF_v104d20221230.txt Level 1 file used: Pandora75s1_EssexMD_20240605_L1_smca1c1d20221230p1-8.txt Full location name: MDE Essex Monitoring Site Short location name: EssexMD Country of location: United States Location latitude [deg]: 39.3109 Location longitude [deg]: -76.4745 Location altitude [m]: 12 Local noon date: 20240605 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: OoB-data based on session 103 First and last pixel inside fitting window: 196 337 Nominal wavelengths inside fitting window [nm]: 305.0663 305.2078 305.3493 305.4908 305.6322 305.7737 305.9151 306.0566 306.1980 306.3394 306.4807 306.6221 306.7635 306.9048 307.0461 307.1874 307.3287 307.4700 307.6112 307.7524 307.8937 308.0349 308.1761 308.3172 308.4584 308.5996 308.7407 308.8818 309.0229 309.1640 309.3051 309.4461 309.5872 309.7282 309.8692 310.0102 310.1512 310.2921 310.4331 310.5740 310.7149 310.8558 310.9967 311.1376 311.2784 311.4193 311.5601 311.7009 311.8417 311.9825 312.1233 312.2640 312.4048 312.5455 312.6862 312.8269 312.9676 313.1083 313.2489 313.3896 313.5302 313.6708 313.8114 313.9520 314.0925 314.2331 314.3736 314.5141 314.6547 314.7951 314.9356 315.0761 315.2165 315.3570 315.4974 315.6378 315.7782 315.9186 316.0590 316.1993 316.3397 316.4800 316.6203 316.7606 316.9009 317.0411 317.1814 317.3216 317.4619 317.6021 317.7423 317.8825 318.0227 318.1628 318.3030 318.4431 318.5832 318.7233 318.8634 319.0035 319.1436 319.2836 319.4237 319.5637 319.7037 319.8437 319.9837 320.1237 320.2636 320.4036 320.5435 320.6834 320.8233 320.9632 321.1031 321.2430 321.3828 321.5227 321.6625 321.8023 321.9421 322.0819 322.2217 322.3615 322.5012 322.6409 322.7807 322.9204 323.0601 323.1998 323.3395 323.4791 323.6188 323.7584 323.8980 324.0376 324.1772 324.3168 324.4564 324.5960 324.7355 324.8750 --------------------------------------------------------------------------------------- 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 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: 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 20240605T172047.3Z 8922.722770 322 1 51.64 2 17.01 192.88 19.89 227.89 0.00 1 0.00 1 0 17 1.039e-02 7.687e-03 2.892e-03 1.610e-03 1.628546e-01 8.787617e-04 1.950580e-03 -6.000000e+00 6.429086e-03 232.40 -2.00 3.48 -2.00 315.78 0.00e+00 4.624719e-04 8.735918e-05 1.306765e-04 -6.000000e+00 2.811937e-04 286.76 -2.00 20.00 -2.00 315.06 0.00e+00 1.046 0.000 302.00 328.00 3 5.0136e+00 2.2864e-03 1.3523e-02 -6.0000e+00 1.6121e-02 5.0198e-02 2.5218e-03 8.3801e-03 -6.0000e+00 1.7315e-02 -7.2983e-03 1.4498e-03 4.0678e-03 -6.0000e+00 1.0305e-02 -6.3771e-03 6.5393e-04 1.1242e-03 -6.0000e+00 4.3846e-03 1.0427e-03 -6.2163e-04 5.1127e-05 1.6374e-05 -6.0000e+00 3.2033e-04 -3.8098e-02 2.2903e-04 11 9 0 11 16 0 99.94 23.57 0.44 -0.03810 -0.04277 55 9 1 5 0 938.820 26.32 20.00 23.57 33.73 4.2 1057.14 -1001 -177 807 -1853 -1506 -2563 -660 -124 367 -888 -1924 -2620 -1868 -846 -947 702 254 914 1613 1118 1481 1316 813 1013 1374 754 1031 -648 25 -599 908 963 541 -1097 -2199 -3452 -3084 -2043 -1068 -760 -906 -315 -86 -50 -50 228 -103 -590 -680 -458 405 489 962 1062 1094 1000 519 479 199 411 784 1412 1682 1449 613 -153 -670 -792 590 1035 907 626 1007 690 40 -1250 -1512 -1996 -2052 -1683 -1518 -1879 -1808 -1743 -674 -294 283 992 709 883 181 -214 -417 -504 -445 140 638 493 220 13 -869 -1366 -825 -553 -896 -1024 -593 -250 355 834 819 697 355 -161 -243 -139 -52 29 522 406 507 426 751 484 71 215 -104 519 67 -54 -375 -416 -327 143 108 131 498 239 54 -109 -579 -1081 -225 -43 197 -445 -357 -570 -145 -29 95 -244 -536 -732 -549 -271 -336 265 100 365 656 467 626 556 347 446 624 353 480 -292 10 -239 360 399 236 -495 -961 -1488 -1406 -1048 -636 -521 -619 -224 -63 -37 -36 164 -79 -441 -492 -325 293 372 761 874 924 857 451 415 171 352 685 1299 1495 1345 566 -145 -590 -671 512 983 853 618 996 664 40 -1143 -1254 -1565 -1639 -1460 -1453 -1969 -1833 -1858 -758 -352 354 1273 913 1094 209 -249 -444 -515 -468 158 717 603 282 16 -1048 -1549 -986 -679 -1074 -1301 -785 -344 507 1238 1255 1067 521 -220 -306 -181 -67 39 678 561 721 603 1034 641 98 282 -131 650 88 -74 -490 -557 -444 201 159 203 790 387 88 -174 -905 -1653 SS 20240605T172607.8Z 8922.726479 326 1 4.82 2 17.28 196.96 20.65 230.52 0.00 1 0.00 1 0 17 9.394e-03 7.922e-03 1.238e-03 9.532e-04 1.614727e-01 5.291875e-04 1.949685e-03 -6.000000e+00 5.811751e-03 232.40 -2.00 3.48 -2.00 314.25 0.00e+00 5.090930e-04 3.950849e-05 4.669866e-05 -6.000000e+00 2.541866e-04 286.76 -2.00 20.00 -2.00 313.69 0.00e+00 1.047 0.000 302.00 328.00 3 2.5046e+00 1.3578e-03 1.3503e-02 -6.0000e+00 1.4573e-02 3.8849e-02 1.4874e-03 8.3566e-03 -6.0000e+00 1.5652e-02 -1.1880e-02 8.5536e-04 4.0419e-03 -6.0000e+00 9.3157e-03 -3.7512e-03 3.6992e-04 1.1193e-03 -6.0000e+00 3.9638e-03 1.2904e-02 -6.8121e-04 2.9732e-05 1.8079e-05 -6.0000e+00 2.8956e-04 -3.8493e-02 2.2502e-04 12 9 1 12 1 1 99.63 23.57 0.46 -0.03849 -0.04361 27 49 1 5 0 172.050 26.32 20.01 23.57 33.99 4.2 1059.51 -632 -237 337 -269 -1277 -1228 -922 -365 188 -1013 -1042 -1785 -1297 -801 151 -173 170 773 1193 1716 1408 1198 1420 1359 1227 1165 627 148 337 183 376 1052 699 -989 -2707 -3063 -2839 -1931 -837 -635 -953 -520 -362 -160 -204 255 -353 -620 -564 -121 202 809 797 909 780 926 974 362 418 495 933 1500 1832 1349 459 -277 -610 -521 523 1147 684 941 658 585 -38 -618 -1401 -1812 -1702 -1625 -1731 -1940 -1805 -1525 -809 -317 202 665 647 559 278 -75 -578 -337 -54 157 644 807 448 -297 -929 -1211 -713 -312 -696 -1025 -555 -318 377 761 802 568 335 -61 -152 -184 271 457 543 451 429 496 414 523 561 196 17 232 208 32 -173 -357 -237 161 31 134 324 249 -164 -200 -498 -1139 -266 -101 146 -112 -518 -461 -349 -148 83 -446 -459 -789 -603 -383 79 -93 94 434 684 1001 836 710 846 835 738 720 388 93 195 108 210 609 425 -624 -1665 -1840 -1805 -1307 -622 -492 -811 -440 -313 -140 -177 218 -295 -525 -461 -97 166 693 683 810 714 858 910 340 387 457 881 1426 1773 1367 463 -272 -580 -476 491 1126 704 971 684 615 -38 -582 -1259 -1611 -1537 -1527 -1722 -2021 -1920 -1703 -920 -369 246 803 783 677 325 -84 -615 -343 -56 170 732 959 558 -367 -1094 -1390 -817 -367 -846 -1273 -692 -412 489 1029 1082 766 448 -78 -187 -222 323 565 691 588 577 665 542 678 689 238 20 270 253 39 -222 -468 -306 213 43 189 455 358 -237 -284 -713 -1598 SS 20240605T173849.7Z 8922.735297 335 1 51.95 2 18.18 206.13 22.55 236.13 0.00 1 0.00 1 0 17 1.681e-02 1.027e-02 1.021e-02 4.899e-03 1.790763e-01 2.645302e-03 2.171550e-03 -6.000000e+00 1.040000e-02 232.40 -2.00 3.48 -2.00 316.47 0.00e+00 1.006991e-03 3.035921e-04 1.836441e-04 -6.000000e+00 4.549080e-04 286.77 -2.00 20.00 -2.00 315.70 0.00e+00 1.052 0.000 302.00 328.00 3 6.4969e+00 6.9165e-03 1.4195e-02 -6.0000e+00 2.6077e-02 8.6701e-02 7.6707e-03 9.2888e-03 -6.0000e+00 2.8010e-02 -1.9662e-02 4.4277e-03 4.5100e-03 -6.0000e+00 1.6671e-02 -2.3229e-03 2.0453e-03 1.3013e-03 -6.0000e+00 7.0920e-03 2.2383e-04 -1.0373e-03 1.5598e-04 1.6533e-05 -6.0000e+00 5.1823e-04 -3.6713e-02 2.5194e-04 12 9 8 11 24 0 99.99 23.57 0.49 -0.03671 -0.04451 14 2 1 5 0 3710.500 26.32 20.00 23.57 34.78 4.1 1062.94 1130 40 -4532 4276 -3099 -3171 -2720 2142 -239 -490 70 -857 -8677 -5943 -746 166 1314 1626 1177 2615 -1328 1809 2452 1318 577 253 1072 247 -351 -1444 2600 -1246 87 -2205 -773 -3368 -2452 -3348 1344 904 -1479 1351 -984 1128 365 1429 -882 -283 -1079 -1330 181 372 1065 1405 1547 400 1501 -1030 1955 444 -1361 2219 2171 2248 695 106 -344 -1043 24 375 1196 626 1151 713 -148 -1871 -2672 -2993 -2027 -1411 -2647 -1537 -1462 -1258 -260 -317 521 1491 1116 1435 599 -694 -1800 -2134 208 -544 50 164 1220 214 -700 -1212 -1195 -934 -831 -1002 -767 159 289 1248 957 1168 667 34 -614 -1005 -638 -355 588 49 634 333 1003 445 1012 -444 -278 294 72 156 -689 -135 -672 -8 601 75 586 31 166 165 -300 -1595 207 8 -981 886 -623 -591 -508 410 -51 -111 16 -195 -2264 -1672 -221 53 433 547 408 915 -491 645 873 489 223 100 421 93 -124 -493 866 -452 33 -866 -287 -1249 -954 -1491 669 522 -958 891 -681 771 251 961 -592 -182 -677 -827 114 246 731 1001 1130 299 1121 -786 1428 328 -1052 1751 1830 1977 614 88 -290 -853 20 314 1078 594 1091 657 -141 -1650 -2149 -2273 -1553 -1173 -2466 -1546 -1566 -1415 -281 -364 626 1828 1376 1698 729 -779 -1871 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