File name: Pandora32s1_GreenbeltMD_20240801_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20240802T052005.6Z 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 v1.8.59 Instrument operation file used: Pandora32_OF_v1d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20240801_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: 20240801 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 20240801T114215.8Z 8979.487683 172 1 49.95 2 73.48 80.19 39.76 91.38 0.00 1 0.00 1 0 17 1.404e-01 9.411e-03 8.061e-02 4.232e-03 4.647553e-01 2.197884e-03 5.309786e-03 -6.000000e+00 8.144583e-02 232.08 -2.00 3.47 -2.00 319.84 0.00e+00 2.504051e-03 6.855789e-04 7.000591e-04 -6.000000e+00 3.651376e-03 290.62 -2.00 20.00 -2.00 319.04 0.00e+00 3.459 0.001 302.00 328.00 3 4.6101e+00 6.4632e-03 4.2121e-02 -6.0000e+00 2.0399e-01 -1.1769e-02 7.7676e-03 2.4340e-02 -6.0000e+00 2.2021e-01 -3.9357e-02 6.1987e-03 1.2343e-02 -6.0000e+00 1.3138e-01 1.0955e-02 3.2190e-03 4.2049e-03 -6.0000e+00 5.5973e-02 1.0053e-04 7.0447e-05 1.2072e-04 4.4151e-05 -6.0000e+00 3.7430e-03 1.0074e-02 -3.4253e-05 12 8 8 10 0 0 84.27 22.22 0.61 0.01007 0.01060 15 4 1 5 0 3329.770 26.51 20.01 22.22 31.62 4.8 1043.28 27477 -34764 -43521 -28056 -96677 -13516 3388 2715 -412 -26594 -24757 -78750 22364 -15061 37969 -10 -17913 9084 -7872 10473 -6033 -10025 8681 745 13943 -11023 30812 -6594 2015 -9951 -14195 -779 3337 -2008 -10890 589 -5340 -4492 1035 -96 116 -575 7400 5741 1796 2113 3222 7462 -837 7039 1394 1032 2139 497 1950 -838 -685 731 -1649 2153 1345 2372 2050 1551 1528 -2106 -2087 -1696 890 1576 -1611 363 -483 683 -145 -1318 -2854 -1162 367 -2609 -1291 -79 -812 -2543 181 -482 -190 -87 311 1193 1075 1929 -25 -1539 163 377 -279 1812 544 269 -119 -1562 -731 -249 -1149 -1756 -543 486 -254 226 601 442 427 -47 115 -157 586 -530 -64 278 -362 -118 1116 372 495 309 -681 172 -117 144 168 -834 -897 -28 667 356 -161 -154 357 -49 553 -311 -647 252 -683 -1007 -557 -3388 -202 45 41 -7 -653 -615 -3434 435 -514 948 0 -984 417 -456 538 -377 -652 483 48 845 -897 1723 -512 139 -778 -1274 -71 331 -226 -1301 61 -621 -600 158 -18 24 -128 1598 1294 426 506 774 1734 -213 1717 384 313 693 175 712 -324 -272 288 -654 815 524 981 936 780 803 -1114 -1051 -844 459 909 -1050 244 -330 448 -90 -762 -1536 -598 196 -1616 -896 -60 -671 -2237 164 -464 -192 -91 325 1214 1041 1745 -22 -1331 147 375 -308 2167 705 354 -151 -1861 -812 -277 -1360 -2198 -699 646 -357 338 954 727 701 -76 175 -229 843 -792 -100 452 -599 -192 1766 578 746 452 -972 245 -177 235 290 -1498 -1651 -53 1313 730 -338 -328 762 -103 1127 -617 -1256 SS 20240801T115604.3Z 8979.497272 175 1 49.03 2 70.83 82.23 37.15 93.62 0.00 1 0.00 1 0 17 4.595e-02 6.083e-03 2.723e-02 2.543e-03 4.113562e-01 1.307035e-03 4.755939e-03 -6.000000e+00 2.666083e-02 232.08 -2.00 3.47 -2.00 319.14 0.00e+00 1.097887e-03 3.263408e-04 4.123453e-04 -6.000000e+00 1.195284e-03 290.62 -2.00 20.00 -2.00 318.29 0.00e+00 3.008 0.000 302.00 328.00 3 4.2582e+00 3.6777e-03 3.6881e-02 -6.0000e+00 6.6774e-02 -3.2953e-02 4.2820e-03 2.1531e-02 -6.0000e+00 7.2085e-02 -7.0426e-03 3.1086e-03 1.0526e-02 -6.0000e+00 4.3006e-02 -1.8516e-03 1.6367e-03 3.0145e-03 -6.0000e+00 1.8322e-02 2.3476e-04 -1.2048e-04 7.2424e-05 3.1399e-05 -6.0000e+00 1.2253e-03 1.0571e-02 -2.3962e-05 10 0 0 10 0 0 77.64 22.31 0.45 0.01057 0.00967 25 6 1 5 0 1961.060 26.62 20.00 22.31 31.79 4.9 1045.81 -13401 -21872 -17262 -9919 -22623 -8687 6585 -10812 -480 -20833 -3214 -14185 537 -5166 -763 2657 -3280 2041 704 6447 -5308 -2036 6674 1779 -640 -1019 5761 -2683 -2124 -6391 -3804 -1039 495 -2303 -5125 -2201 -4871 -3388 -3476 -875 -547 743 -257 1430 866 990 679 1843 -397 -1392 690 1321 129 630 1573 -546 268 -305 65 1346 1338 1471 1836 2121 999 -292 469 -643 -345 2128 470 526 -402 648 -372 -852 -865 -1196 -1240 -1176 -952 -928 -1098 -1874 -672 -393 -15 355 488 1090 727 1395 -567 -579 -166 390 -25 714 238 -90 -636 -1239 -577 -452 -769 -1178 -629 -380 189 414 653 541 321 535 -81 35 -96 -73 94 -216 -189 61 470 370 -38 74 -92 149 103 374 436 -184 -411 -151 370 -28 173 -157 145 44 317 -153 -882 -339 -696 -563 -299 -706 -224 153 -334 -15 -875 -117 -596 22 -273 -46 179 -256 161 60 547 -523 -196 602 179 -71 -120 649 -317 -239 -745 -468 -140 74 -378 -843 -339 -813 -643 -793 -230 -160 228 -83 465 286 329 228 610 -135 -488 252 519 55 283 734 -267 134 -154 32 651 660 768 1043 1298 639 -183 278 -378 -213 1428 349 409 -317 494 -271 -578 -541 -726 -780 -822 -743 -791 -1002 -1794 -668 -410 -17 397 548 1200 765 1381 -538 -539 -162 409 -29 886 316 -120 -825 -1516 -666 -523 -939 -1513 -831 -519 269 620 1029 877 519 836 -122 50 -137 -106 144 -345 -305 98 736 566 -57 107 -130 209 152 587 719 -313 -715 -269 686 -55 339 -312 290 87 609 -285 -1625 SS 20240801T120227.0Z 8979.501702 179 1 48.04 2 69.60 83.18 35.95 94.71 0.00 1 0.00 1 0 17 3.498e-02 6.052e-03 1.846e-02 2.158e-03 3.877494e-01 1.106042e-03 4.503561e-03 -6.000000e+00 2.029618e-02 232.08 -2.00 3.47 -2.00 318.85 0.00e+00 9.793341e-04 2.545477e-04 4.598887e-04 -6.000000e+00 9.099800e-04 290.62 -2.00 20.00 -2.00 318.00 0.00e+00 2.839 0.000 302.00 328.00 3 4.1472e+00 3.0704e-03 3.4795e-02 -6.0000e+00 5.0834e-02 -3.8826e-02 3.5415e-03 2.0318e-02 -6.0000e+00 5.4879e-02 3.6141e-04 2.4686e-03 9.8894e-03 -6.0000e+00 3.2740e-02 -4.5315e-03 1.2976e-03 2.7601e-03 -6.0000e+00 1.3947e-02 3.1835e-04 -1.8270e-04 6.1173e-05 2.8333e-05 -6.0000e+00 9.3291e-04 1.0860e-02 -4.3245e-05 10 0 0 10 0 0 91.02 22.36 0.46 0.01086 0.00949 30 7 1 5 0 1601.150 26.62 20.00 22.36 32.15 4.9 1047.84 -8051 -11848 -5574 -11160 -3457 -16115 -3086 -6930 -6274 -8896 -16527 -14989 2614 -8880 -2187 -1781 1077 2255 2129 3965 -2143 -1696 2620 1281 -1381 1806 3058 -931 483 -6132 -1840 -1506 474 -2981 -4745 -1612 -7256 -1438 -3689 274 -258 55 -82 875 1446 571 305 1877 -303 -374 -367 2525 558 1348 385 476 -96 219 1128 317 693 1826 1685 2334 661 447 -604 -345 -198 1379 257 -223 -106 361 -322 -530 -1562 -1464 -1129 -1104 -1474 -488 -1290 -1588 -136 -531 -180 239 733 847 536 1109 -620 -241 254 276 297 619 495 -495 -263 -1392 -787 -312 -1045 -751 -807 -534 -168 694 643 319 532 316 343 -123 -185 139 42 228 -125 70 677 -81 297 225 -97 321 129 110 127 -229 -479 117 -33 47 67 -23 276 -87 128 -153 -659 -253 -449 -212 -442 -115 -570 -100 -264 -271 -429 -879 -811 136 -620 -171 -160 103 226 228 401 -239 -189 284 150 -179 241 410 -126 61 -816 -253 -234 81 -565 -886 -280 -1412 -308 -985 84 -83 19 -30 318 526 212 113 683 -113 -142 -148 1084 264 676 205 243 -50 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