File name: Pandora159s1_Wakkerstroom_20240512_L2Fit_fout2c3d20201207p1-8.txt File generation date: 20240515T031349.7Z 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_20240512_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: 20240512 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 20240512T054532.6Z 8898.239961 69 1 49.19 2 75.84 60.37 127.71 74.47 0.00 1 0.00 1 0 25 1.291e-01 9.734e-03 1.149e-01 6.479e-03 4.310051e-01 3.270531e-03 4.420355e-03 -6.000000e+00 7.247090e-02 225.04 -2.00 3.06 -2.00 320.05 0.00e+00 3.251939e-03 1.048790e-03 2.949324e-04 -6.000000e+00 3.196329e-03 278.91 -2.00 20.00 -2.00 319.44 0.00e+00 4.003 0.000 302.00 328.00 3 4.2495e+00 9.5189e-03 3.7865e-02 -6.0000e+00 1.7919e-01 4.7563e-02 1.1459e-02 2.0269e-02 -6.0000e+00 1.9529e-01 -1.0457e-02 9.7054e-03 1.0025e-02 -6.0000e+00 1.1631e-01 -1.9732e-03 5.0320e-03 4.4583e-03 -6.0000e+00 4.9447e-02 1.7158e-04 -6.0832e-04 1.8967e-04 4.1346e-05 -6.0000e+00 3.4502e-03 8.8282e-03 12 9 8 11 8 0 99.92 19.14 0.71 0.00883 0.00426 25 5 1 8 0 1967.220 15.00 19.14 17.66 21.38 21.27 26.4 839.07 -22935 -3345 -27365 -19017 -69576 39828 -34733 -15276 -33286 35464 -39788 -38003 -51535 -9605 46961 -20904 22520 -14067 -9476 6292 -252 -6248 9283 3193 18737 3142 11075 1819 -603 3284 -13199 9672 -641 15650 -9346 -4755 2897 2037 3758 -575 -3545 -1940 235 -149 3527 -811 1216 -3224 4354 3541 6601 -2975 747 2912 -2669 -62 -9 1859 -462 2365 -459 1242 163 1140 1028 2457 1015 1453 1665 -515 1427 -2348 1656 -1833 1225 -1257 -786 1638 891 -95 -1997 -82 -1552 -669 -2391 -179 -1161 444 -1291 585 285 722 1906 1323 2486 -254 1267 402 143 -1262 -4 -497 803 -817 -1153 -719 -1476 -894 204 1191 -168 584 -643 148 142 1990 54 427 -699 -324 -395 -1134 35 -242 1166 178 2391 1090 811 -211 -227 -206 -29 248 -33 -608 -230 611 -829 574 -45 -220 -94 -407 -56 -595 -364 -1981 386 -742 -306 -880 510 -1200 -1227 -2277 -346 1179 -1150 888 -845 -578 347 -15 -397 523 203 1098 222 727 126 -42 227 -1208 810 -66 1434 -1034 -500 311 261 571 -106 -742 -424 53 -34 786 -191 282 -787 1001 854 1675 -906 236 959 -967 -23 -3 671 -167 828 -172 501 74 557 511 1142 455 654 816 -294 872 -1540 1036 -1129 679 -643 -370 741 443 -55 -1339 -60 -1240 -558 -2160 -169 -1162 450 -1329 569 259 604 1486 1040 2101 -248 1372 490 186 -1645 -4 -551 825 -878 -1340 -879 -1899 -1203 290 1822 -280 991 -1078 234 208 2750 77 628 -1105 -535 -656 -1856 55 -368 1680 248 3150 1485 1212 -347 -398 -374 -54 482 -68 -1318 -508 1364 -1872 1247 -95 -442 -184 SS 20240512T060552.6Z 8898.254081 76 1 13.60 2 71.98 57.36 123.58 73.09 0.00 1 0.00 1 0 25 2.036e-02 7.563e-03 1.806e-02 2.744e-03 3.495178e-01 1.358028e-03 3.683020e-03 -6.000000e+00 1.143053e-02 225.04 -2.00 3.06 -2.00 318.56 0.00e+00 1.301788e-03 2.787881e-04 1.451441e-04 -6.000000e+00 5.041315e-04 278.91 -2.00 20.00 -2.00 317.90 0.00e+00 3.191 0.000 302.00 328.00 3 3.3170e+00 3.6723e-03 3.0205e-02 -6.0000e+00 2.8263e-02 9.0223e-03 4.2005e-03 1.5852e-02 -6.0000e+00 3.0801e-02 4.9423e-03 2.8844e-03 7.8099e-03 -6.0000e+00 1.8345e-02 -8.5111e-03 1.5177e-03 2.4931e-03 -6.0000e+00 7.7996e-03 9.3729e-04 -6.1564e-04 7.8309e-05 2.5831e-05 -6.0000e+00 5.4414e-04 8.3189e-03 12 9 1 12 1 1 98.81 19.14 0.21 0.00832 0.00369 14 12 1 8 0 905.680 15.00 19.14 19.33 21.38 21.27 26.5 847.42 -6849 -127 -9109 -8841 -6471 2006 -948 -1009 -3243 -6223 -621 -6676 -2249 -5205 2000 3307 -749 -2742 -1723 -262 -1406 857 -807 -53 -2190 -1153 -185 2441 402 4984 611 2959 1013 -4063 -2204 -831 -518 -1334 2085 -2130 -1647 -1539 303 -1375 -951 -106 456 -60 -474 1698 -189 225 766 1349 711 1184 185 472 119 798 2138 602 1353 63 191 764 872 1043 1650 178 -72 -789 82 -334 -468 166 492 1187 663 439 -738 -1010 -2339 -664 -978 -593 -324 -528 -44 -370 565 232 898 1746 1445 707 753 206 -760 -715 -349 -615 834 803 -1388 -655 -1784 -865 -175 13 -154 -395 217 338 799 1135 813 445 187 -916 -923 -491 241 342 770 215 1318 1888 588 689 292 261 -387 507 -323 -494 37 -743 -620 -119 47 -47 144 -318 -6 -491 -450 -293 82 -43 -51 -187 -389 -37 -446 -167 -471 197 357 -90 -353 -231 -36 -200 119 -117 -8 -365 -198 -31 383 62 748 104 547 209 -900 -454 -168 -114 -346 624 -756 -633 -619 124 -579 -400 -45 190 -25 -198 707 -85 109 390 719 393 667 107 271 67 447 1224 373 902 45 137 520 563 668 1126 137 -59 -676 70 -274 -362 117 322 756 449 333 -623 -926 -2290 -667 -1037 -660 -373 -623 -52 -424 608 235 853 1640 1438 772 894 265 -1031 -961 -446 -735 949 935 -1744 -853 -2417 -1207 -255 20 -247 -643 343 514 1146 1561 1124 638 282 -1440 -1465 -769 369 508 1104 300 1766 2547 850 1056 467 425 -647 867 -579 -916 70 -1422 -1189 -223 85 -84 252 SS 20240512T061255.9Z 8898.258980 80 1 48.77 2 70.67 56.25 122.15 72.60 0.00 1 0.00 1 0 25 1.621e-02 6.659e-03 6.399e-03 9.690e-04 3.302198e-01 4.802357e-04 3.489798e-03 -6.000000e+00 9.101080e-03 225.04 -2.00 3.06 -2.00 318.68 0.00e+00 1.685373e-03 1.003899e-04 2.760809e-04 -6.000000e+00 4.013955e-04 278.91 -2.00 20.00 -2.00 318.00 0.00e+00 2.988 0.000 302.00 328.00 3 2.4510e+00 1.3042e-03 2.8409e-02 -6.0000e+00 2.2503e-02 7.4448e-03 1.4939e-03 1.5243e-02 -6.0000e+00 2.4524e-02 -1.1843e-03 1.0312e-03 7.3915e-03 -6.0000e+00 1.4606e-02 -4.1745e-03 5.4191e-04 2.5931e-03 -6.0000e+00 6.2100e-03 2.6876e-03 -7.2037e-04 2.8084e-05 2.5619e-05 -6.0000e+00 4.3325e-04 8.4356e-03 12 9 1 12 9 1 99.37 19.13 0.25 0.00844 0.00302 148 32 1 8 0 327.200 15.00 19.13 20.02 21.38 21.27 26.7 851.53 -3639 -5624 -4667 -9757 -3934 -6554 -2001 -3246 -1942 -3405 -2259 -550 -2440 -583 -1737 -522 -1346 -490 -872 -13 -242 748 1324 -58 409 -892 -1788 -1416 1295 1002 1298 2159 576 -1352 -636 150 -364 288 86 -1855 -1757 -1008 -1200 -1125 -190 -833 -662 -280 -90 1173 796 815 1018 669 625 1018 372 279 525 1292 1761 1198 1173 335 -586 626 541 1173 1651 125 -188 -209 -272 -111 -136 483 530 1058 1252 -495 -414 -1332 -2047 -825 -1087 -1000 -562 -534 -209 -203 507 606 1256 2014 1390 708 781 196 -737 -568 -444 -165 775 498 -1140 -787 -925 -719 -5 -88 -244 -386 -28 261 520 1111 818 550 3 -838 -795 -203 -155 -132 710 474 1267 1690 519 397 120 65 81 399 -294 -365 -9 -66 -548 -251 -141 -257 169 -168 -293 -247 -510 -174 -288 -90 -167 -110 -204 -134 -34 -178 -49 -174 -58 -159 -61 -114 -2 -33 101 182 -9 64 -147 -296 -221 187 147 206 379 113 -277 -122 28 -75 70 25 -646 -669 -401 -494 -469 -79 -349 -274 -114 -36 479 349 387 514 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