File name: Pandora32s1_GreenbeltMD_20230729_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20230801T071739.1Z 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 v1.8.49 Instrument operation file used: Pandora32_OF_v1d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20230729_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: 20230729 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 20230729T105026.5Z 8610.451696 85 1 48.86 2 82.70 71.75 140.60 273.24 0.00 1 0.00 1 0 17 5.394e-01 3.045e-02 2.564e-01 1.075e-02 8.104740e-01 6.089810e-03 9.284334e-03 -6.000000e+00 3.206631e-01 232.22 -2.00 3.47 -2.00 321.90 0.00e+00 -1.786480e-03 3.198394e-03 7.222857e-03 -6.000000e+00 1.474240e-02 290.53 -2.00 20.00 -2.00 321.33 0.00e+00 7.259 0.007 302.00 328.00 3 1.8031e+00 2.3321e-02 9.4666e-02 -6.0000e+00 8.0369e-01 9.7328e-01 2.9318e-02 7.2904e-02 -6.0000e+00 8.7076e-01 -1.4712e+00 2.0545e-02 2.4169e-02 -6.0000e+00 5.1563e-01 6.1793e-01 9.9873e-03 9.5143e-03 -6.0000e+00 2.1694e-01 3.0157e-05 -8.5986e-04 2.9747e-04 8.6166e-05 -6.0000e+00 1.4929e-02 2.9833e-02 2.4964e-05 12 9 8 11 4 0 82.95 26.83 1.41 0.02983 0.02337 26 6 1 5 0 1879.090 31.19 25.00 26.83 28.54 3.2 1017.35 89436 -77854 26829 -16562 -27845 -48406 900000 900000 -72352 66827 -58195 -73605 102592 55847 900000 32915 63545 137436 93531 900000 -28119 -26187 75668 -20090 101666 -52037 900000 263904 56060 -43590 95271 -36963 136668 7602 -8112 900000 -51770 29430 25179 173449 33186 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-1296 -2359 -1069 2634 364 -10350 288 -3322 59 601 -5584 1595 -3453 -4275 465 -4429 -2814 -5245 -4069 -2396 -1299 482 -2226 149 -2694 3224 -447 978 5649 -878 -1556 -3489 3093 644 1988 -624 4152 4483 1797 1264 2173 1746 106 3771 3520 -1074 -3019 2379 -1102 4134 -472 -6541 -665 976 626 873 -4379 SS 20230729T110119.0Z 8610.459248 88 1 48.65 2 80.69 73.37 142.60 275.04 0.00 1 0.00 1 0 25 4.744e-01 1.398e-02 1.476e-01 3.412e-03 7.023405e-01 1.859601e-03 8.396765e-03 -6.000000e+00 2.751452e-01 232.22 -2.00 3.47 -2.00 321.30 0.00e+00 7.419839e-03 9.388561e-04 4.389204e-03 -6.000000e+00 1.239137e-02 290.53 -2.00 20.00 -2.00 320.66 0.00e+00 5.870 0.003 302.00 328.00 3 1.4918e+00 6.6189e-03 7.1140e-02 -6.0000e+00 6.9005e-01 2.3170e-01 8.9953e-03 4.3106e-02 -6.0000e+00 7.4636e-01 -3.7614e-01 8.3733e-03 2.3366e-02 -6.0000e+00 4.4469e-01 1.5540e-01 3.9718e-03 7.7370e-03 -6.0000e+00 1.8838e-01 1.7770e-04 -8.3964e-04 9.2337e-05 1.3253e-04 -6.0000e+00 1.2659e-02 2.9359e-02 4.7862e-05 12 9 8 11 4 0 70.68 26.85 0.62 0.02936 0.02305 78 18 1 5 0 623.600 31.30 25.00 26.85 29.15 3.1 1019.92 -103845 -194627 -114102 -30727 -211140 -197019 -101633 -80561 -150537 -97166 -104961 -177190 -12042 -129931 46862 -11437 -71622 3672 -72173 900000 -70260 -19117 16063 -80434 37568 -70125 96652 -16382 4442 -21122 885 -19219 -2296 1992 -31256 2325 -8390 -5415 6470 14082 24949 8048 -6473 27084 3992 31442 7723 47637 4990 9355 13555 9798 21355 7763 13849 5868 7923 7935 3375 6033 -1507 10352 8425 4003 8138 306 6407 480 4323 5297 476 3698 -783 2818 -1600 -858 -400 -4160 176 -3420 -237 -1047 -1703 -812 596 439 -1250 380 -533 1111 1116 -1603 -488 -3701 -494 -1535 -576 433 -1235 -499 -1467 -1129 -1676 -1374 -1263 -2161 -899 -996 51 262 20 1184 160 569 528 543 -204 -83 708 -407 322 96 1196 1185 172 506 105 1432 179 470 411 -330 75 -289 166 -202 132 -253 -311 219 -255 109 -769 -705 -3966 -1139 -138 -5005 -3796 -809 -571 -2275 -956 -1154 -4249 -73 -3260 271 -146 -1837 52 -2261 900000 -2337 -393 235 -3133 500 -2741 789 -389 85 -559 23 -737 -88 80 -1629 87 -373 -262 339 818 1473 609 -599 1858 352 2166 695 2991 505 970 1496 1266 2715 1181 2107 1006 1369 1369 592 1011 -280 1874 1783 1011 2127 86 1660 135 1290 1741 183 1451 -320 1053 -572 -284 -122 -1326 58 -1392 -111 -548 -996 -502 388 295 -903 280 -398 791 774 -1068 -308 -2472 -358 -1269 -533 459 -1425 -583 -1638 -1168 -1581 -1281 -1261 -2325 -975 -1158 65 363 30 1891 255 905 798 788 -299 -128 1147 -677 530 157 1859 1787 261 738 148 2064 286 831 781 -659 158 -629 387 -486 324 -619 -780 530 -599 238 -1675 SS 20230729T111103.3Z 8610.466011 93 1 36.48 2 78.87 74.81 144.39 276.74 0.00 1 0.00 1 0 17 3.855e-01 1.219e-02 1.810e-01 4.116e-03 6.171051e-01 2.222678e-03 7.200309e-03 -6.000000e+00 2.254983e-01 232.22 -2.00 3.47 -2.00 320.79 0.00e+00 5.188873e-03 9.655338e-04 2.508155e-03 -6.000000e+00 1.039688e-02 290.53 -2.00 20.00 -2.00 320.09 0.00e+00 4.995 0.002 302.00 328.00 3 2.5794e+00 7.2951e-03 5.9874e-02 -6.0000e+00 5.6497e-01 9.0836e-02 9.5173e-03 3.4416e-02 -6.0000e+00 6.1153e-01 -1.4770e-01 8.7504e-03 1.8575e-02 -6.0000e+00 3.6277e-01 5.8258e-02 4.3035e-03 6.4264e-03 -6.0000e+00 1.5424e-01 1.4861e-04 -6.3375e-04 1.1463e-04 8.8492e-05 -6.0000e+00 1.0577e-02 2.8758e-02 7.6428e-05 12 9 9 12 5 1 96.54 26.88 0.48 0.02876 0.02400 28 9 1 5 0 1252.090 31.30 25.00 26.88 29.45 3.1 1021.03 900000 -192535 -136537 -150335 900000 -200902 900000 88759 354 4530 -151014 -60625 -22657 -35603 139314 -15330 18256 3718 13726 900000 -34827 -17511 -12727 15191 -23099 26731 86696 24921 -5580 -58675 38830 -33068 11671 -14615 -4864 13146 -22476 9451 -10236 25669 -2741 6608 2911 7990 11621 11518 19284 21591 3063 6050 -3282 12664 9706 10480 6616 -1264 2358 207 4846 -1724 3339 4745 1028 3856 -1668 1370 1338 1792 3403 725 884 -2586 707 52 -1905 -53 -1895 -1025 -2099 593 -388 -1978 -2503 -1945 1914 -1577 37 -95 172 1504 -99 323 -1745 -1540 135 -116 289 749 7 -1047 -134 -1686 -1152 -271 -1382 -1062 -288 -347 -50 157 266 330 610 -174 943 234 446 403 42 -13 158 681 408 805 -107 -449 400 372 -88 344 552 -35 -417 85 -396 -51 -182 -811 526 57 256 -118 -348 900000 -4902 -2240 -2817 900000 -5368 900000 356 2 24 -3729 -691 -221 -509 559 -275 271 70 258 900000 -1141 -487 -347 340 -798 609 1139 582 -172 -3138 964 -1935 522 -910 -271 602 -1537 560 -884 1887 -297 708 340 922 1324 1346 2151 2426 426 864 -561 2083 1793 2081 1442 -308 573 52 1132 -421 800 1221 308 1260 -608 481 457 618 1254 311 418 -1322 352 25 -866 -21 -730 -390 -878 281 -214 -1245 -1723 -1404 1417 -1269 31 -81 148 1253 -79 244 -1279 -1140 107 -104 291 836 8 -1295 -158 -1855 -1174 -275 -1494 -1206 -339 -429 -66 224 409 531 985 -276 1421 343 652 610 67 -22 261 1096 641 1230 -160 -654 563 535 -138 585 1003 -67 -821 173 -852 -114 -413 -1870 1206 128 555 -245 -709 SS 20230729T111610.3Z 8610.469564 96 1 39.18 2 77.91 75.56 145.32 277.67 0.00 1 0.00 1 0 25 2.456e-01 7.627e-03 7.155e-02 2.422e-03 5.796197e-01 1.280960e-03 6.624942e-03 -6.000000e+00 1.432399e-01 232.22 -2.00 3.47 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