File name: Pandora132s1_Berlin_20241231_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241231T231528.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c13p1-8 Local principal investigator: Thomas Ruhtz Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 132 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora132_OF_v1d20200910.txt Instrument calibration file used: Pandora132s1_CF_v13d20210422.txt Level 1 file used: Pandora132s1_Berlin_20241231_L1_smca1c13d20210422p1-8.txt Full location name: Institute of Space Sciences FU Berlin Short location name: Berlin Country of location: Germany Location latitude [deg]: 52.4600 Location longitude [deg]: 13.3100 Location altitude [m]: 100 Local noon date: 20241231 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: Modification of session 11, but different RefDay (April 2021). First and last pixel inside fitting window: 243 385 Nominal wavelengths inside fitting window [nm]: 305.1071 305.2480 305.3889 305.5298 305.6707 305.8116 305.9524 306.0932 306.2341 306.3749 306.5157 306.6565 306.7973 306.9380 307.0788 307.2195 307.3603 307.5010 307.6417 307.7824 307.9231 308.0638 308.2044 308.3451 308.4857 308.6264 308.7670 308.9076 309.0482 309.1888 309.3293 309.4699 309.6104 309.7510 309.8915 310.0320 310.1725 310.3130 310.4534 310.5939 310.7344 310.8748 311.0152 311.1556 311.2960 311.4364 311.5768 311.7172 311.8575 311.9979 312.1382 312.2785 312.4188 312.5591 312.6994 312.8397 312.9800 313.1202 313.2604 313.4007 313.5409 313.6811 313.8213 313.9615 314.1016 314.2418 314.3819 314.5221 314.6622 314.8023 314.9424 315.0825 315.2225 315.3626 315.5026 315.6427 315.7827 315.9227 316.0627 316.2027 316.3427 316.4827 316.6226 316.7626 316.9025 317.0424 317.1823 317.3222 317.4621 317.6020 317.7418 317.8817 318.0215 318.1613 318.3012 318.4410 318.5807 318.7205 318.8603 319.0000 319.1398 319.2795 319.4192 319.5589 319.6986 319.8383 319.9780 320.1177 320.2573 320.3969 320.5366 320.6762 320.8158 320.9554 321.0949 321.2345 321.3741 321.5136 321.6531 321.7927 321.9322 322.0717 322.2111 322.3506 322.4901 322.6295 322.7689 322.9084 323.0478 323.1872 323.3266 323.4659 323.6053 323.7447 323.8840 324.0233 324.1627 324.3020 324.4413 324.5805 324.7198 324.8591 324.9983 --------------------------------------------------------------------------------------- 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: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Temperature at electronics board 1 [°C], 999=no temperature signal Column 98: Temperature at electronics board 2 [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: 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 20241231T085634.6Z 9131.372623 117 1 49.65 2 80.91 149.19 87.98 145.35 0.00 1 0.00 1 0 17 5.450e-01 1.330e-02 2.917e-01 5.982e-03 7.164766e-01 3.324636e-03 8.733650e-03 -6.000000e+00 3.092843e-01 220.87 -2.00 3.85 -2.00 321.62 0.00e+00 7.999482e-03 1.500130e-03 1.029878e-03 -6.000000e+00 1.352612e-02 266.74 -2.00 20.00 -2.00 321.24 0.00e+00 6.012 0.005 302.00 328.00 3 1.2193e+00 1.0815e-02 7.2305e-02 -6.0000e+00 7.6120e-01 2.7387e-01 1.5497e-02 4.4733e-02 -6.0000e+00 8.3260e-01 -3.1137e-01 1.7731e-02 2.5077e-02 -6.0000e+00 4.9308e-01 1.2989e-01 8.6124e-03 1.2205e-02 -6.0000e+00 2.1197e-01 2.0571e-04 -1.1831e-03 1.7977e-04 1.3889e-04 -6.0000e+00 1.5131e-02 3.6663e-02 0.0000e+00 12 9 8 11 4 0 98.14 23.96 0.32 0.03666 0.02777 133 28 4 8 0 373.210 13.53 23.96 9.48 28.40 28.73 29.4 941.24 123547 -211352 900000 -175030 900000 -211674 -9099 -213138 77035 -89430 90049 -81834 -151796 900000 -127903 279780 -69470 900000 -29458 5955 -33833 -37119 57595 -76576 61338 -75108 106934 -68903 83788 -24998 -5339 17830 -22828 -5227 -39138 56387 -28635 33467 -1527 11080 661 -4700 417 -9153 15588 -13589 23274 -677 17812 8687 22367 16472 567 14865 2620 14535 -2598 8577 -1495 2595 4065 4906 15115 3285 11312 1660 6998 -1486 5559 3348 2123 5034 42 4939 -1655 5902 -3772 4572 -802 -972 -1256 -2808 -789 -2776 659 -57 1311 -1184 1035 -791 -42 48 -3613 35 -1395 813 -1420 906 -1055 23 -1177 -997 1057 -2571 -503 -2529 -827 -1128 792 -33 78 3 -905 376 -686 695 -915 842 277 -210 1188 1028 2058 -132 1225 -921 1031 110 565 102 -657 386 -181 617 -298 111 15 246 -352 -102 521 -1388 900000 720 -3584 900000 -1948 900000 -3140 -53 -3840 449 -573 525 -668 -3056 900000 -3389 1631 -1498 900000 -498 73 -611 -692 436 -2366 501 -2452 623 -2088 586 -612 -134 426 -918 -177 -1779 1019 -1385 1053 -82 601 44 -348 31 -758 1036 -1251 1546 -60 1412 830 2099 1824 80 1949 368 2050 -396 1255 -235 396 661 904 2627 708 2296 364 1476 -369 1470 1018 695 1611 13 1387 -445 1483 -937 1143 -251 -364 -547 -1391 -412 -1567 382 -35 831 -776 647 -476 -24 25 -2001 21 -967 646 -1338 935 -1161 24 -1128 -853 849 -2243 -459 -2484 -851 -1272 987 -47 120 6 -1427 560 -983 968 -1339 1279 444 -339 1828 1512 2898 -184 1624 -1202 1336 160 936 190 -1336 820 -410 1483 -766 293 40 659 -925 -252 1188 -3061 900000 SS 20241231T091507.5Z 9131.385504 123 1 50.08 2 79.55 153.29 86.49 149.02 0.00 1 0.00 1 0 17 3.918e-01 7.197e-03 1.521e-01 3.935e-03 6.507801e-01 2.129008e-03 8.006613e-03 -6.000000e+00 2.204049e-01 220.87 -2.00 3.85 -2.00 321.30 0.00e+00 6.086463e-03 8.937921e-04 8.039796e-04 -6.000000e+00 9.472003e-03 266.74 -2.00 20.00 -2.00 320.91 0.00e+00 5.301 0.003 302.00 328.00 3 1.2870e+00 6.6383e-03 6.3977e-02 -6.0000e+00 5.4214e-01 1.5761e-01 9.1684e-03 3.9299e-02 -6.0000e+00 5.9195e-01 -1.1172e-01 1.0379e-02 2.2052e-02 -6.0000e+00 3.5123e-01 3.8006e-02 5.1404e-03 1.0463e-02 -6.0000e+00 1.5175e-01 3.9896e-04 -8.4767e-04 1.1755e-04 1.1173e-04 -6.0000e+00 1.0818e-02 3.6317e-02 0.0000e+00 11 9 0 11 4 0 99.90 23.88 0.30 0.03632 0.02995 199 42 4 8 0 249.120 13.84 23.88 9.87 28.40 28.73 29.4 942.59 -139544 -135860 900000 -161483 -73021 -126945 -158797 -113644 -128238 -95538 -141207 -99244 -98854 -37147 -51955 -42874 -11641 -31948 -54515 -37665 -10229 -19634 -26817 -13681 6236 -21621 -25230 -11360 -40184 -16047 -7091 2397 4986 1345 -337 -12923 -4430 -14374 2107 -8584 213 2579 2624 1721 4431 4382 810 7390 2903 7489 4214 2513 4521 5374 2216 696 3270 2073 1041 -25 2320 3926 4375 4887 2423 2623 405 1303 437 1352 237 1241 359 1146 -383 348 -1341 -1026 -247 -1166 -1058 -1678 -1721 -944 -1295 -102 -94 768 566 -65 623 -298 -1229 58 -580 -119 384 7 -338 -229 -189 -534 827 -158 -1325 -1204 -941 -287 402 122 157 -97 -270 -370 -4 370 801 140 472 -461 542 778 752 91 18 -593 821 844 -258 -206 -512 42 -27 147 -91 -315 395 266 -25 -289 92 -453 900000 -1119 -1185 900000 -1921 -336 -1023 -1949 -1003 -1427 -806 -2059 -1180 -1555 -413 -837 -740 -165 -613 -1401 -853 -177 -377 -586 -283 112 -531 -639 -248 -1233 -449 -223 82 186 52 -13 -580 -211 -921 138 -721 18 227 241 163 420 429 85 763 333 899 587 395 760 957 386 127 586 405 200 -5 439 830 1050 1275 655 689 109 375 145 500 94 493 138 403 -123 101 -390 -321 -90 -508 -532 -946 -1040 -600 -880 -72 -70 567 409 -44 395 -180 -749 38 -440 -104 386 8 -397 -257 -192 -490 722 -146 -1327 -1267 -1049 -345 536 182 253 -160 -436 -567 -5 525 1169 218 767 -762 860 1179 1102 129 25 -786 1081 1222 -429 -381 -1020 87 -59 345 -226 -809 1023 692 -65 -699 207 -979 900000 SS 20241231T092105.1Z 9131.389642 126 1 47.59 2 79.15 154.63 86.04 150.22 0.00 1 0.00 1 0 25 4.116e-01 2.738e-02 3.556e-01 2.194e-02 6.139495e-01 1.187358e-02 7.808548e-03 -6.000000e+00 2.347978e-01 220.87 -2.00 3.85 -2.00 320.95 0.00e+00 9.637128e-03 4.451649e-03 1.146728e-03 -6.000000e+00 1.037747e-02 266.74 -2.00 20.00 -2.00 320.56 0.00e+00 5.122 0.003 302.00 328.00 3 4.0510e+00 3.5423e-02 6.0643e-02 -6.0000e+00 5.7867e-01 3.9148e-01 4.5201e-02 3.5054e-02 -6.0000e+00 6.3277e-01 -3.5729e-01 4.4944e-02 2.1018e-02 -6.0000e+00 3.7176e-01 1.5923e-01 2.2763e-02 1.1223e-02 -6.0000e+00 1.5960e-01 2.7902e-05 -2.1679e-03 6.4950e-04 1.2771e-04 -6.0000e+00 1.1756e-02 3.4397e-02 0.0000e+00 12 9 9 12 5 1 99.96 24.10 0.77 0.03440 0.01811 17 4 1 8 0 2643.180 14.58 24.10 9.95 28.40 28.73 29.3 942.21 -112348 -140109 -52857 900000 -72337 900000 -119339 900000 -155295 -132893 -121789 900000 900000 900000 108951 152053 778 -70196 54060 3276 36348 -16892 -96282 24112 -18282 -54825 26209 -37480 -7715 64945 40367 109641 16865 23805 -27385 -4269 57335 37485 61404 31986 -17820 55557 29291 35386 11933 55738 23624 11101 59019 14362 21697 10770 45082 15172 27355 16888 16614 -8395 10248 13033 9723 2533 8000 3828 -8235 12177 -698 -6427 -7547 4896 -2934 -73 1639 -8058 -200 1499 6590 4364 2124 2820 -6054 7199 -6370 2477 -5217 3974 -4821 3569 -1361 -249 2590 -818 -2991 -3758 -747 -3048 1295 396 159 218 -2412 -1637 -4557 -1747 -1328 1291 -2987 801 759 -240 -799 2428 1637 -3161 1218 -894 1425 -1176 405 -21 2170 3310 616 367 365 561 2258 1125 -1550 152 59 -337 12 -894 -343 -254 1774 1327 156 417 -2764 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