File name: Pandora21s1_Bremen_20220224_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T100516.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Tom Hanisco Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 21 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora21_OF_v4d20190904.txt Instrument calibration file used: Pandora21s1_CF_v1d20201116.txt Level 1 file used: Pandora21s1_Bremen_20220224_L1_smca1c1d20201116p1-8.txt Full location name: Bremen University Short location name: Bremen Country of location: Germany Location latitude [deg]: 53.0813 Location longitude [deg]: 8.8126 Location altitude [m]: 50 Local noon date: 20220224 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: None First and last pixel inside fitting window: 286 428 Nominal wavelengths inside fitting window [nm]: 305.0633 305.2039 305.3445 305.4851 305.6257 305.7662 305.9068 306.0473 306.1878 306.3283 306.4688 306.6093 306.7497 306.8902 307.0306 307.1711 307.3115 307.4519 307.5923 307.7326 307.8730 308.0134 308.1537 308.2940 308.4343 308.5747 308.7149 308.8552 308.9955 309.1357 309.2760 309.4162 309.5564 309.6966 309.8368 309.9770 310.1172 310.2573 310.3975 310.5376 310.6777 310.8178 310.9579 311.0980 311.2380 311.3781 311.5181 311.6582 311.7982 311.9382 312.0782 312.2182 312.3581 312.4981 312.6380 312.7779 312.9179 313.0578 313.1976 313.3375 313.4774 313.6172 313.7571 313.8969 314.0367 314.1765 314.3163 314.4561 314.5959 314.7356 314.8754 315.0151 315.1548 315.2945 315.4342 315.5739 315.7135 315.8532 315.9928 316.1325 316.2721 316.4117 316.5513 316.6908 316.8304 316.9700 317.1095 317.2490 317.3885 317.5280 317.6675 317.8070 317.9465 318.0859 318.2254 318.3648 318.5042 318.6436 318.7830 318.9224 319.0617 319.2011 319.3404 319.4798 319.6191 319.7584 319.8977 320.0369 320.1762 320.3155 320.4547 320.5939 320.7331 320.8723 321.0115 321.1507 321.2899 321.4290 321.5682 321.7073 321.8464 321.9855 322.1246 322.2637 322.4028 322.5418 322.6808 322.8199 322.9589 323.0979 323.2369 323.3759 323.5148 323.6538 323.7927 323.9317 324.0706 324.2095 324.3484 324.4872 324.6261 324.7650 324.9038 --------------------------------------------------------------------------------------- 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 20220224T084847.4Z 8090.367216 255 1 4.90 2 72.09 135.75 87.15 221.15 0.00 1 0.00 1 0 25 1.812e-01 1.460e-02 1.873e-01 1.091e-02 4.536821e-01 5.676583e-03 6.009422e-03 -6.000000e+00 1.073164e-01 223.99 -2.00 3.88 -2.00 319.15 0.00e+00 -5.701432e-05 1.291233e-03 2.131381e-04 -6.000000e+00 4.413741e-03 266.68 -2.00 20.00 -2.00 318.87 0.00e+00 3.208 0.001 302.00 328.00 3 4.4237e+00 1.5380e-02 4.0795e-02 -6.0000e+00 2.6620e-01 1.4437e-02 1.7638e-02 2.5649e-02 -6.0000e+00 2.9002e-01 -9.2448e-03 1.4465e-02 1.3188e-02 -6.0000e+00 1.7045e-01 5.5539e-03 7.8439e-03 3.9826e-03 -6.0000e+00 7.1489e-02 1.5390e-04 -1.0627e-03 3.3504e-04 4.9264e-05 -6.0000e+00 5.4777e-03 -1.7425e-02 -2.2568e-06 12 9 9 12 1 1 999.00 22.22 0.42 -0.01742 -0.02541 1 4 1 5 0 2361.163 25.28 19.99 22.22 15.07 28.4 1015.99 97787 -20037 900000 -93151 79727 6022 900000 76553 37440 34036 -18626 43682 -13983 15375 -34135 50331 2147 18627 -1038 4474 14465 -14454 18237 -18623 23665 -22684 1349 -7823 -2489 3005 -890 22944 -8037 9476 -7452 -3870 -15722 871 -3626 -3004 -899 -7720 7016 -2380 4156 1743 2782 107 973 -3447 3607 5015 -3628 8203 2185 2484 2934 651 1000 -762 2471 2851 3720 -764 3206 -5647 2988 299 3577 -264 -447 2286 -236 -1525 -306 1342 -1897 34 -197 -970 -1991 -2151 -519 -3273 -2061 -2098 1659 -1329 2665 -1022 765 1834 1142 507 -2406 1362 933 1013 305 -312 -533 -1323 -443 66 -1171 -1211 -525 -899 -396 -231 1206 -275 1089 481 -681 641 1000 227 -462 -264 -1324 -611 -1024 784 561 933 1891 840 -191 1700 678 -159 41 1084 -196 -976 -178 979 -669 -320 -481 268 -908 1040 -516 900000 -4876 848 117 900000 919 722 731 -679 968 -604 603 -2495 1933 141 1129 -80 344 1047 -1385 1335 -2048 1897 -2941 142 -879 -258 300 -100 2334 -1207 1285 -1169 -582 -2808 154 -793 -763 -250 -2436 2027 -763 1270 548 873 34 316 -1201 1255 1863 -1557 3386 993 1166 1405 320 484 -371 1189 1447 2030 -464 1956 -3639 1741 177 2165 -180 -330 1734 -184 -1171 -221 890 -1204 21 -125 -678 -1559 -1845 -470 -3177 -2074 -2214 1775 -1491 2925 -1131 804 1813 1082 476 -2394 1424 1067 1254 402 -418 -698 -1648 -520 77 -1418 -1532 -685 -1219 -559 -343 1870 -445 1749 758 -1039 933 1432 332 -702 -414 -2129 -972 -1602 1187 828 1336 2620 1166 -278 2591 1095 -267 70 1904 -359 -1860 -345 1909 -1323 -625 -920 495 -1651 SS 20220224T085323.0Z 8090.370406 258 1 16.29 2 71.61 136.84 87.60 222.06 0.00 1 0.00 1 0 25 8.446e-02 7.432e-03 9.423e-02 5.827e-03 4.488222e-01 3.022586e-03 5.941058e-03 -6.000000e+00 4.965827e-02 223.99 -2.00 3.88 -2.00 319.50 0.00e+00 5.493099e-04 7.575169e-04 2.347502e-04 -6.000000e+00 2.022961e-03 266.68 -2.00 20.00 -2.00 319.21 0.00e+00 3.130 0.001 302.00 328.00 3 4.6333e+00 8.2814e-03 4.0107e-02 -6.0000e+00 1.2317e-01 2.6557e-02 9.6093e-03 2.5515e-02 -6.0000e+00 1.3415e-01 2.1470e-02 8.3312e-03 1.3211e-02 -6.0000e+00 7.9084e-02 -1.8769e-02 4.4957e-03 4.0316e-03 -6.0000e+00 3.3120e-02 1.3323e-04 -1.4120e-03 1.8165e-04 5.0861e-05 -6.0000e+00 2.5326e-03 -1.5785e-02 -1.0559e-04 12 9 1 12 1 1 99.92 22.22 0.25 -0.01579 -0.02640 6 4 1 5 0 2303.802 25.28 19.99 22.22 15.00 28.3 1015.48 -28706 3124 -31580 -18425 24675 -7121 -9835 -36281 -36929 34403 3792 1667 40399 -16653 -93 13234 2194 -979 8416 -1118 -18273 643 -5932 701 2233 -1994 -2125 -122 9150 -4135 862 2689 451 1477 1396 -339 -7190 -1813 -1447 -4771 -4288 -286 -2855 2899 2472 -2630 -1657 -1890 -355 1215 1128 3981 -1707 517 1929 -561 1276 -898 3598 -90 1272 881 1223 2051 847 335 2604 -120 -415 960 1289 866 114 -471 329 -1484 -1749 1089 -462 381 -65 -2550 -1613 -989 -1306 -883 -280 209 465 315 772 644 562 1744 157 -182 756 1260 -678 -280 -326 -802 -440 198 -1118 -596 -1526 -586 -175 548 684 69 111 615 527 241 -14 -323 -509 -478 -1120 238 -10 -532 225 761 856 874 719 262 350 273 162 489 215 -118 -179 233 -441 -305 -550 -33 -12 -567 53 -768 -392 339 -127 -189 -989 -1132 600 91 44 867 -712 -4 583 118 -58 488 -74 -1474 44 -448 53 179 -176 -191 -10 705 -367 80 276 53 181 170 -41 -1005 -279 -265 -1058 -1061 -73 -781 770 667 -751 -473 -543 -102 357 353 1319 -643 203 787 -243 557 -402 1526 -39 556 412 622 1120 486 189 1391 -65 -239 603 881 625 83 -336 220 -930 -1017 598 -269 245 -47 -2087 -1413 -909 -1266 -900 -298 228 508 338 788 619 512 1544 147 -187 849 1545 -899 -377 -425 -984 -507 225 -1334 -744 -1999 -794 -249 822 1087 114 183 987 808 354 -20 -477 -785 -766 -1838 384 -16 -824 336 1094 1194 1212 1045 409 580 470 288 893 408 -234 -365 480 -917 -628 -1102 -64 -23 SS 20220224T085740.5Z 8090.373386 260 1 41.44 2 71.17 137.85 88.02 222.91 0.00 1 0.00 1 0 25 8.517e-02 7.077e-03 9.948e-02 6.230e-03 4.366610e-01 3.241698e-03 5.688670e-03 -6.000000e+00 5.013656e-02 223.99 -2.00 3.88 -2.00 319.67 0.00e+00 1.001773e-03 8.392964e-04 2.437180e-04 -6.000000e+00 2.040666e-03 266.68 -2.00 20.00 -2.00 319.38 0.00e+00 3.062 0.001 302.00 328.00 3 5.2274e+00 8.9284e-03 3.9066e-02 -6.0000e+00 1.2436e-01 6.0066e-02 1.0387e-02 2.4684e-02 -6.0000e+00 1.3539e-01 -2.2755e-03 9.0459e-03 1.2849e-02 -6.0000e+00 7.9820e-02 -4.8425e-03 4.8642e-03 3.9709e-03 -6.0000e+00 3.3467e-02 7.8460e-05 -1.1827e-04 1.9751e-04 4.9497e-05 -6.0000e+00 2.5528e-03 -1.7826e-02 1.3452e-04 12 9 1 12 1 1 99.96 22.22 0.29 -0.01783 -0.01871 11 3 1 5 0 3438.944 25.28 20.00 22.22 14.95 28.3 1015.09 -21667 -22100 2910 -26327 18931 -42688 41711 7011 11539 -46306 -990 -6349 -5363 12412 6597 17519 -10676 -10613 5544 -8668 -4377 -11984 11361 2228 11825 -7013 4019 -4241 -6187 -9311 -10187 362 -11177 -1956 -4400 5014 -1486 1190 1431 -8 -1159 -4079 1279 -348 7 -461 -660 -1055 3 1218 1936 1241 1156 -1349 3201 864 2 1115 194 2633 2640 2504 3411 1053 634 1757 1645 92 1495 -792 57 -1535 433 1209 543 -2018 -1118 -1029 -1860 -1009 -764 -1201 -868 -1773 -1123 -816 -144 425 1153 -493 451 -68 462 1217 1165 512 131 489 -208 -25 100 -466 -103 -621 -708 -390 -489 -534 2 -230 96 55 929 -348 -371 290 324 -571 -209 75 -825 250 -495 -400 1113 -159 1147 1187 452 332 299 -118 208 330 -279 235 192 314 -490 -86 -54 -157 -658 -428 -495 55 -636 288 -1091 529 134 235 -1706 -25 -182 -175 409 271 743 -645 -688 328 -614 -307 -914 716 163 845 -629 330 -367 -530 -834 -1001 36 -1389 -236 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