File name: Pandora32s1_GreenbeltMD_20241107_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20241108T051408.0Z 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 v1.8.60 Instrument operation file used: Pandora32_OF_v1d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20241107_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: 20241107 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 20241107T134136.4Z 9077.570560 101 1 6.15 2 71.00 131.75 130.95 93.01 0.00 1 0.00 1 0 25 2.711e-02 7.466e-03 2.763e-02 5.375e-03 3.384544e-01 2.674459e-03 4.014760e-03 -6.000000e+00 1.529515e-02 224.19 -2.00 3.47 -2.00 318.05 0.00e+00 4.570546e-04 4.822305e-04 1.365931e-04 -6.000000e+00 6.811978e-04 282.36 -2.00 20.00 -2.00 317.33 0.00e+00 3.034 0.000 302.00 328.00 3 3.6529e+00 7.1276e-03 3.4362e-02 -6.0000e+00 3.7708e-02 2.1473e-02 8.0982e-03 1.7095e-02 -6.0000e+00 4.0984e-02 -5.9727e-03 5.2622e-03 8.4754e-03 -6.0000e+00 2.4484e-02 -3.3868e-03 2.7412e-03 2.4912e-03 -6.0000e+00 1.0533e-02 4.6338e-04 7.1254e-04 1.5219e-04 2.6606e-05 -6.0000e+00 7.2123e-04 4.0605e-03 1.0450e-04 12 9 1 12 9 1 98.81 21.76 0.32 0.00406 0.00941 3 8 1 5 0 1537.130 26.62 20.01 21.76 25.50 5.4 1008.96 -10567 -2456 -7535 3073 5618 5683 2966 -2561 -15133 -10689 1365 -5257 -2670 7120 2891 3570 -521 -56 -543 7800 -129 -1969 -3244 65 1402 -35 3700 -2271 -872 -1305 -2975 -3255 3088 -1113 -3412 -3524 -5769 -1541 -1148 1552 -771 -2077 -1713 -2243 2110 898 2842 -498 68 1083 -724 3656 18 925 94 -452 1297 972 1164 1735 1323 -158 520 2556 172 -251 125 714 334 -24 837 -559 735 -37 -45 446 -1112 -497 -707 -722 -2136 -1691 -716 -1642 -982 -343 -162 274 433 -501 727 1324 -232 447 593 -739 691 -64 1506 -429 -879 -939 -1016 228 -1024 -997 -299 -419 -397 639 992 181 188 162 237 321 180 -7 -164 119 -525 -74 415 -194 337 192 6 519 191 938 746 -23 -444 6 530 -63 -360 25 -288 103 -97 -93 -650 -645 -159 -542 197 320 301 167 -169 -1272 -930 108 -451 -248 707 346 480 -78 -9 -90 1250 -23 -356 -599 12 279 -7 773 -484 -174 -256 -624 -751 740 -293 -892 -884 -1544 -452 -394 603 -336 -965 -819 -1095 1000 431 1344 -239 32 514 -364 1899 10 544 58 -284 823 620 733 1074 834 -105 371 1916 135 -191 90 498 242 -19 715 -501 658 -33 -38 351 -821 -351 -510 -569 -1865 -1592 -708 -1693 -1051 -383 -188 326 516 -593 819 1407 -235 440 602 -811 810 -81 1988 -578 -1150 -1160 -1197 268 -1271 -1294 -398 -576 -564 943 1525 286 295 245 343 445 247 -10 -240 181 -815 -115 629 -289 487 271 8 703 270 1392 1156 -36 -719 10 905 -111 -651 46 -530 188 -174 -161 -1114 SS 20241107T135535.2Z 9077.580268 107 1 48.59 2 69.02 134.63 128.35 94.95 0.00 1 0.00 1 0 17 1.201e-02 4.939e-03 2.719e-03 5.773e-04 3.092990e-01 2.872968e-04 3.678127e-03 -6.000000e+00 6.773529e-03 224.18 -2.00 3.47 -2.00 318.04 0.00e+00 5.064530e-04 5.117209e-05 1.017774e-04 -6.000000e+00 3.017968e-04 282.36 -2.00 20.00 -2.00 317.32 0.00e+00 2.766 0.000 302.00 328.00 3 1.7083e+00 7.6533e-04 3.1346e-02 -6.0000e+00 1.6699e-02 -1.8814e-04 8.6880e-04 1.5635e-02 -6.0000e+00 1.8152e-02 2.1836e-03 5.5897e-04 7.7522e-03 -6.0000e+00 1.0844e-02 -6.2069e-03 2.8960e-04 2.2754e-03 -6.0000e+00 4.6638e-03 4.3988e-03 1.3631e-04 1.6520e-05 2.4355e-05 -6.0000e+00 3.1954e-04 4.0634e-03 5.1348e-06 10 0 0 10 0 0 100.00 21.86 0.27 0.00406 0.00509 850 199 1 5 0 57.150 26.62 20.00 21.86 26.45 5.4 1013.77 -383 -2779 -3055 -3974 -5475 -2877 -4614 -1503 -1507 -2616 -2920 -4208 -1113 -620 360 445 -27 807 241 1399 831 366 1253 561 170 -207 -407 -1492 -562 -565 610 1040 1390 -192 -2369 -1903 -1907 -1370 -178 -503 -632 -768 -764 -665 -95 -50 -715 -189 -541 -384 772 842 949 1135 622 748 683 333 378 677 925 1357 1602 1496 585 -171 -70 -462 548 935 91 312 -144 216 80 -241 -375 -1000 -496 -638 -1003 -1147 -1764 -1708 -863 -561 -169 151 235 396 544 654 106 528 699 308 227 516 285 -175 -376 -888 -569 25 -422 -938 -575 -603 -147 395 162 201 193 309 199 327 308 164 45 -65 -419 -53 68 104 311 406 5 824 572 218 159 -203 -139 31 24 -5 -99 178 -7 -149 20 -334 -404 -24 -203 -237 -303 -381 -180 -302 -107 -122 -232 -263 -388 -110 -72 48 68 -4 137 40 240 148 65 224 106 35 -45 -89 -319 -111 -109 121 228 335 -50 -609 -462 -486 -402 -62 -195 -276 -358 -370 -328 -47 -25 -353 -91 -258 -184 383 452 546 645 370 457 429 211 235 413 573 892 1152 1169 447 -134 -51 -320 393 708 78 281 -132 191 66 -194 -273 -686 -346 -501 -845 -1082 -1708 -1739 -927 -646 -195 180 283 465 633 697 104 523 720 332 259 654 372 -232 -501 -1085 -682 30 -517 -1238 -751 -826 -211 576 253 324 305 462 289 441 430 225 66 -97 -649 -82 106 157 449 559 6 1115 782 325 241 -320 -223 51 40 -9 -182 334 -12 -280 36 -579 -679 SS 20241107T153806.9Z 9077.651468 177 1 0.53 2 58.11 159.30 109.64 108.35 0.00 1 0.00 1 0 17 1.326e-02 7.774e-03 1.004e-02 5.861e-03 2.136278e-01 2.950285e-03 2.607715e-03 -6.000000e+00 7.475777e-03 224.18 -2.00 3.47 -2.00 315.61 0.00e+00 8.424074e-06 2.894957e-04 2.724288e-05 -6.000000e+00 3.331062e-04 282.35 -2.00 20.00 -2.00 314.98 0.00e+00 1.886 0.000 302.00 328.00 3 2.4406e+00 7.5503e-03 2.1435e-02 -6.0000e+00 1.8430e-02 5.5619e-03 8.4305e-03 1.0750e-02 -6.0000e+00 2.0034e-02 -3.4493e-03 4.8560e-03 5.3228e-03 -6.0000e+00 1.1968e-02 -1.0913e-04 2.2286e-03 1.5194e-03 -6.0000e+00 5.1476e-03 5.7305e-03 -4.1181e-04 1.6400e-04 1.9013e-05 -6.0000e+00 3.5272e-04 2.5040e-03 -6.4705e-05 12 9 1 12 1 1 999.00 22.50 0.30 0.00250 -0.00059 1 43 1 5 0 263.610 27.15 20.00 22.50 29.48 5.3 1029.64 742 -3323 142 -2632 -4255 -2944 -3932 -1472 -951 3084 -5390 -1037 1141 65 3610 2442 824 -2951 3515 677 1031 146 846 1238 273 2069 2050 -3386 -352 999 2375 449 576 -471 -1243 -1915 -1086 -617 -677 328 -623 -292 -315 -844 574 -920 422 -1153 -1463 -223 163 1910 211 1016 743 456 242 -370 1329 -92 100 1452 1821 1036 132 1267 115 -381 449 347 -113 -371 99 93 -1023 90 -1578 -713 -428 -475 188 -1492 -2307 -1291 182 -1399 -193 44 -947 401 741 1089 -327 24 821 67 1012 863 573 -528 109 -518 -147 491 154 -567 -967 -764 -13 -345 -305 -32 449 750 -128 -40 202 -13 -377 633 -466 -491 767 330 1032 387 725 1223 594 -324 240 -549 -258 122 -61 -13 -312 433 174 -312 171 -432 -934 178 -899 38 -709 -1065 -678 -925 -369 -261 868 -1617 -298 340 21 1275 936 331 -1239 1448 291 451 64 370 555 128 992 990 -1645 -159 431 1028 206 279 -237 -612 -911 -529 -328 -405 217 -443 -215 -236 -639 431 -695 314 -850 -1061 -159 118 1428 165 816 611 381 205 -315 1109 -77 84 1257 1650 982 127 1171 101 -325 388 320 -111 -379 101 94 -1012 83 -1390 -597 -358 -422 179 -1515 -2457 -1403 203 -1641 -232 54 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