File name: Pandora159s1_Wakkerstroom_20240730_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20240730T221216.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Refilwe Kai Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 159 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora159_OF_v6d20191004.txt Instrument calibration file used: Pandora159s1_CF_v3d20201207.txt Level 1 file used: Pandora159s1_Wakkerstroom_20240730_L1_smca1c3d20201207p1-8.txt Full location name: Global Change Institute, University of Witwatersrand field site in Wakkerstroom Short location name: Wakkerstroom Country of location: South Africa Location latitude [deg]: -27.3493 Location longitude [deg]: 30.1438 Location altitude [m]: 1760 Local noon date: 20240730 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: 222 364 Nominal wavelengths inside fitting window [nm]: 305.0731 305.2139 305.3547 305.4955 305.6363 305.7770 305.9178 306.0585 306.1992 306.3399 306.4806 306.6213 306.7620 306.9026 307.0433 307.1839 307.3246 307.4652 307.6058 307.7464 307.8869 308.0275 308.1681 308.3086 308.4492 308.5897 308.7302 308.8707 309.0112 309.1517 309.2921 309.4326 309.5730 309.7135 309.8539 309.9943 310.1347 310.2751 310.4155 310.5558 310.6962 310.8365 310.9769 311.1172 311.2575 311.3978 311.5381 311.6784 311.8186 311.9589 312.0991 312.2393 312.3795 312.5198 312.6599 312.8001 312.9403 313.0805 313.2206 313.3607 313.5009 313.6410 313.7811 313.9212 314.0612 314.2013 314.3414 314.4814 314.6214 314.7615 314.9015 315.0415 315.1814 315.3214 315.4614 315.6013 315.7413 315.8812 316.0211 316.1610 316.3009 316.4408 316.5807 316.7205 316.8604 317.0002 317.1400 317.2798 317.4196 317.5594 317.6992 317.8389 317.9787 318.1184 318.2582 318.3979 318.5376 318.6773 318.8170 318.9566 319.0963 319.2359 319.3756 319.5152 319.6548 319.7944 319.9340 320.0736 320.2131 320.3527 320.4922 320.6318 320.7713 320.9108 321.0503 321.1898 321.3292 321.4687 321.6081 321.7476 321.8870 322.0264 322.1658 322.3052 322.4446 322.5839 322.7233 322.8626 323.0019 323.1413 323.2806 323.4199 323.5591 323.6984 323.8377 323.9769 324.1162 324.2554 324.3946 324.5338 324.6730 324.8121 324.9513 --------------------------------------------------------------------------------------- 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: 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 77: 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 78: 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 79: 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 80: 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 81: 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 82: Atmospheric variability [%], 999=no atmospheric variability was determined Column 83: Wavelength effective temperature [°C], 999=no effective temperature given Column 84: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 85: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 86: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 87: Number of bright count cycles Column 88: Number of dark count cycles Column 89: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 90: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 91: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 92: Integration time [ms] Column 93: Spectrometer control temperature [°C], 999=no temperature signal Column 94: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 95: Temperature in head sensor [°C], 999=no temperature signal Column 96: Temperature at electronics board 1 [°C], 999=no temperature signal Column 97: Temperature at electronics board 2 [°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 20240730T052055.9Z 8977.222869 160 1 4.84 2 82.75 64.94 53.35 3.31 0.00 1 0.00 1 0 25 5.196e-01 3.025e-02 4.306e-01 2.518e-02 8.395115e-01 1.459683e-02 8.458325e-03 -6.000000e+00 3.041213e-01 225.93 -2.00 3.06 -2.00 321.76 0.00e+00 1.842586e-02 7.446029e-03 1.241541e-03 -6.000000e+00 1.634579e-02 276.70 -2.00 20.00 -2.00 321.31 0.00e+00 7.336 0.002 302.00 328.00 3 1.9288e+00 5.0590e-02 7.4726e-02 -6.0000e+00 7.6252e-01 6.3631e-01 6.8226e-02 5.4827e-02 -6.0000e+00 8.3967e-01 -7.8238e-01 6.7935e-02 2.1311e-02 -6.0000e+00 4.9125e-01 3.2493e-01 3.2225e-02 1.9594e-02 -6.0000e+00 2.0542e-01 7.2854e-05 -2.6623e-03 6.9077e-04 2.0212e-04 -6.0000e+00 1.5709e-02 1.3569e-02 12 9 9 12 1 1 999.00 18.25 0.46 0.01357 -0.00644 2 7 4 8 0 1610.160 15.00 18.25 12.28 20.77 20.77 25.4 811.54 900000 -211756 -114126 -13417 -210960 37966 -146591 900000 900000 -134500 900000 -178189 900000 900000 25732 900000 900000 900000 -131308 900000 40029 -54233 900000 900000 900000 40612 900000 900000 900000 -49620 135043 -46985 900000 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-978 4218 -4864 1794 2091 -1084 3550 227 4817 -2754 5343 962 71 -1619 989 -711 3270 -2398 -1459 381 -222 -147 -2039 -2682 -4934 618 -6438 -1691 -681 219 2572 -583 -628 -2338 -3513 -2090 -2905 2433 -1266 -4856 -2349 42 -788 3004 1227 6064 -3776 2446 -1896 5035 1820 3900 3504 -1745 613 2685 -703 4646 -301 -1070 5358 1549 -426 -2407 3077 -3221 -4333 1645 -104 -255 -3078 SS 20240730T052626.1Z 8977.226691 163 1 11.01 2 81.65 64.23 53.31 1.80 0.00 1 0.00 1 0 25 5.486e-01 1.452e-02 3.744e-01 9.151e-03 7.681996e-01 4.955562e-03 7.382334e-03 -6.000000e+00 3.119511e-01 225.93 -2.00 3.06 -2.00 321.51 0.00e+00 1.093310e-02 2.470939e-03 4.196992e-03 -6.000000e+00 1.377649e-02 276.70 -2.00 20.00 -2.00 321.04 0.00e+00 6.487 0.002 302.00 328.00 3 1.7879e+00 1.6797e-02 7.0964e-02 -6.0000e+00 7.7563e-01 2.6185e-01 2.4283e-02 5.7516e-02 -6.0000e+00 8.4755e-01 -2.7888e-01 2.6505e-02 1.9420e-02 -6.0000e+00 5.0343e-01 1.0564e-01 1.2465e-02 1.4809e-02 -6.0000e+00 2.1148e-01 1.9032e-04 -1.2002e-03 2.4223e-04 9.6717e-05 -6.0000e+00 1.4929e-02 1.4210e-02 12 9 9 12 1 1 40.52 18.25 0.42 0.01421 0.00519 12 12 4 8 0 846.170 15.00 18.25 12.57 20.77 20.77 25.5 813.14 -267110 -166512 -241403 900000 -200005 93700 -62595 38207 -180854 -100169 -87234 -156936 -100463 -12762 -98640 -78063 900000 -101518 900000 -108681 -6905 18711 136840 -57212 -22696 -66202 -53117 45220 -98224 43948 -60030 37577 -6642 63334 -53388 53032 -36309 -12540 19074 -4450 10642 -1173 13851 2003 14493 -7773 44026 22112 22903 5379 3352 14786 -3601 6473 -2649 18227 -1095 9408 -4006 16641 -1393 5172 2255 14136 6654 3643 9610 -2119 8116 2913 8516 33 1680 627 4121 -547 -1927 -3324 -2067 3485 -243 1899 -4684 1238 -3188 734 -1687 -664 47 -974 -167 1535 1310 -618 1649 -536 1478 48 -882 -805 251 -700 2624 70 -2023 -1815 -1603 -617 -1739 -615 -679 -756 -1837 163 555 1756 782 -251 -250 -822 526 -282 1023 184 1895 186 3032 1511 786 475 144 709 -215 30 -746 106 362 384 -702 143 -369 -550 -477 -4469 -1485 -4039 900000 -2011 836 -558 341 -1830 -893 -778 -1686 -896 -114 -1468 -1170 900000 -2478 900000 -3274 -79 167 1221 -1143 -341 -1565 -1129 403 -3342 437 -2043 622 -196 1015 -2514 895 -1580 -515 697 -238 550 -73 796 133 881 -609 2212 1445 1589 480 343 1521 -485 861 -404 2343 -173 1322 -620 2098 -220 856 445 2830 1518 848 2121 -546 2119 919 2760 12 586 207 1194 -149 -508 -933 -662 1265 -107 934 -2667 703 -2003 470 -1155 -461 32 -647 -104 885 739 -376 1116 -431 1346 51 -1009 -919 267 -674 2240 61 -1935 -1828 -1693 -689 -2157 -847 -1033 -1213 -2986 255 826 2514 1146 -387 -403 -1365 849 -437 1520 268 2642 256 3972 2117 1247 849 281 1448 -464 68 -1792 262 906 972 -1784 347 -854 -1203 -1017 SS 20240730T054158.4Z 8977.237481 168 1 47.31 2 78.57 62.18 53.36 357.54 0.00 1 0.00 1 0 25 1.686e-01 6.783e-03 1.631e-01 2.704e-03 6.055797e-01 1.420677e-03 6.070799e-03 -6.000000e+00 9.488552e-02 225.93 -2.00 3.06 -2.00 320.93 0.00e+00 3.321490e-03 5.948857e-04 2.081782e-03 -6.000000e+00 4.135048e-03 276.70 -2.00 20.00 -2.00 320.40 0.00e+00 4.884 0.001 302.00 328.00 3 1.9879e+00 4.4623e-03 5.0011e-02 -6.0000e+00 2.3525e-01 5.5580e-02 5.9224e-03 3.3153e-02 -6.0000e+00 2.5639e-01 -3.1738e-02 6.1771e-03 1.4604e-02 -6.0000e+00 1.5240e-01 2.2528e-03 3.0468e-03 5.9069e-03 -6.0000e+00 6.4482e-02 6.7063e-04 -1.0057e-03 7.5898e-05 5.2954e-05 -6.0000e+00 4.5075e-03 1.4257e-02 12 9 1 12 1 1 99.88 18.25 0.39 0.01426 0.00670 124 28 4 8 0 378.440 15.00 18.25 13.20 20.77 20.77 25.5 815.48 -14297 -60294 -19187 -97615 -24293 -87846 -38244 -42432 -49234 -23070 16910 43618 -65772 3087 -30433 21567 -20587 -3909 -27014 5799 -6178 -5625 1682 -12992 2629 -14789 -1244 -12329 -4042 -14036 2125 -5473 -6382 -3902 -9402 -1684 -7960 3726 -2608 2920 -3423 -50 -2597 335 62 -1130 -1889 21 1990 1872 2437 2874 3899 940 2011 -387 731 -1798 36 -1541 1467 2097 3033 1444 -784 2722 722 2343 643 1287 -820 -469 -1543 395 -820 -114 1003 -237 1430 -375 416 -1752 -2106 -1508 -806 -753 -275 -331 -341 423 1413 814 1304 2381 1010 833 311 22 -1044 51 24 352 1237 494 -1266 -951 -780 -879 84 -360 -320 -432 -176 267 598 1606 720 808 -248 -1085 -924 210 -592 -276 44 469 1609 1348 412 224 170 -163 76 243 -130 -619 241 -232 -447 -141 126 141 266 -49 -382 -86 -842 -102 -695 -202 -269 -376 -146 76 173 -899 30 -474 262 -390 -69 -654 107 -132 -120 35 -343 64 -454 -34 -364 -109 -458 70 -234 -317 -199 -487 -81 -452 227 -208 262 -366 -6 -311 40 8 -142 -245 3 269 271 390 512 752 202 451 -92 177 -444 9 -365 351 553 902 487 -281 912 242 796 248 566 -403 -238 -779 184 -352 -44 355 -86 577 -182 233 -1140 -1370 -1031 -584 -581 -222 -274 -280 330 1108 598 912 1700 819 716 310 25 -1289 62 26 352 1236 465 -1308 -1033 -890 -1071 111 -533 -520 -733 -295 426 893 2273 1036 1219 -401 -1840 -1547 334 -915 -410 62 637 2082 1828 635 389 321 -326 158 533 -307 -1418 560 -549 -1055 -345 289 303 557 SS 20240730T054809.4Z 8977.241776 171 1 50.02 2 77.36 61.33 53.45 355.85 0.00 1 0.00 1 0 25 9.681e-02 5.943e-03 9.060e-02 2.023e-03 5.545377e-01 1.041673e-03 5.496669e-03 -6.000000e+00 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