File name: Pandora132s1_Berlin_20231126_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T210723.7Z 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_20231126_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: 20231126 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 20231126T075054.7Z 8730.327022 290 1 49.61 2 83.44 137.65 103.50 329.96 0.00 1 0.00 1 0 17 4.740e-01 2.925e-02 4.604e-01 2.893e-02 9.910571e-01 1.657543e-02 1.160414e-02 -6.000000e+00 2.653893e-01 220.53 -2.00 3.85 -2.00 322.25 0.00e+00 -9.084078e-03 7.946966e-03 5.958303e-03 -6.000000e+00 1.230226e-02 269.83 -2.00 20.00 -2.00 321.83 0.00e+00 7.965 0.011 302.00 328.00 3 1.1902e+00 5.7487e-02 1.0460e-01 -6.0000e+00 6.4977e-01 1.3618e+00 7.2076e-02 7.9938e-02 -6.0000e+00 7.1172e-01 -1.7580e+00 6.1330e-02 3.3952e-02 -6.0000e+00 4.2295e-01 7.0484e-01 3.1268e-02 1.1959e-02 -6.0000e+00 1.8010e-01 2.3377e-05 -1.3573e-03 7.7445e-04 1.4757e-04 -6.0000e+00 1.3353e-02 -3.4303e-02 0.0000e+00 12 9 9 12 4 4 96.50 3.20 0.49 -0.03430 -0.04450 38 8 4 8 0 1305.270 15.01 3.20 6.53 20.46 20.87 27.1 911.46 -47808 71220 -4558 900000 900000 -97672 -73722 -47857 -65159 -93245 -17687 -112440 900000 900000 16217 9929 -50453 -39942 133887 4035 66054 900000 145118 56114 900000 -11286 126532 -51549 -65334 52306 5849 168732 150844 -22663 5116 12230 142411 -29324 -39996 170382 41167 73225 38289 24323 14257 -4826 132674 7749 12750 59151 58793 393 1650 -2210 22642 72750 58603 -7170 53809 24818 65033 10877 14367 -12785 10656 28984 28040 43529 30384 23472 14762 9474 23515 13896 30594 14110 7179 -18141 21065 8711 10489 9834 12533 -1314 5470 923 -4985 -2064 2337 4961 -1650 2426 -11572 6078 -12324 -1878 -5758 226 -5200 -1677 -4440 -2492 -6441 -8408 -2574 -368 -2182 -3652 -2965 -3010 -193 2363 793 -1938 -2670 3226 -1300 548 51 2058 2947 1180 2184 3976 895 2213 1388 1920 -80 -196 1423 60 -312 651 -39 144 -132 297 709 -1528 -573 -921 -675 -1960 2007 -128 900000 900000 -4004 -2455 -1349 -2337 -4539 -498 -7202 900000 900000 457 331 -3232 -2354 3773 145 1862 900000 4090 1581 900000 -492 3566 -2773 -3683 1474 214 4755 4251 -1469 231 483 4014 -2149 -3945 4802 2320 3096 2266 1577 964 -381 3739 546 898 2834 3148 42 191 -286 2425 4921 4624 -1051 3943 2238 3849 1196 1741 -2306 1622 3676 3635 5152 4624 4366 3245 2243 4639 2741 4484 2147 1113 -3834 3503 1989 2808 3076 4239 -544 2235 413 -2458 -1001 1060 2083 -693 937 -5185 2501 -7155 -1068 -4027 172 -4610 -1448 -3663 -1775 -4291 -5666 -1741 -259 -1660 -3088 -2848 -3393 -243 3178 1124 -2805 -3776 4199 -1795 778 77 3058 4175 1599 2798 4879 1103 2608 1632 2445 -123 -352 2848 132 -745 1666 -109 415 -386 868 2019 -4198 -1424 -2099 -1479 SS 20231126T075911.2Z 8730.332768 294 1 49.50 2 82.61 139.41 104.06 331.79 0.00 1 0.00 1 0 17 6.515e-01 2.396e-02 3.682e-01 1.113e-02 9.366496e-01 6.371138e-03 1.091288e-02 -6.000000e+00 3.687734e-01 220.53 -2.00 3.85 -2.00 322.28 0.00e+00 1.053357e-02 3.339977e-03 3.163898e-03 -6.000000e+00 1.645779e-02 269.83 -2.00 20.00 -2.00 321.87 0.00e+00 7.204 0.008 302.00 328.00 3 4.7749e-01 2.2721e-02 9.3563e-02 -6.0000e+00 9.0727e-01 1.0149e+00 3.1196e-02 7.0021e-02 -6.0000e+00 9.9555e-01 -1.3474e+00 3.1348e-02 3.0823e-02 -6.0000e+00 5.8695e-01 5.5091e-01 1.4933e-02 1.4687e-02 -6.0000e+00 2.4711e-01 1.0283e-04 -8.4940e-04 3.0612e-04 1.8263e-04 -6.0000e+00 1.8372e-02 -3.5227e-02 0.0000e+00 12 9 9 12 4 4 0.51 3.37 0.41 -0.03523 -0.04161 142 30 4 8 0 348.540 14.88 3.37 7.07 20.46 20.87 27.1 914.40 -73308 53771 -161239 900000 -142846 900000 -158882 900000 -98525 170586 10330 -175709 900000 -136356 266251 -49551 155755 61664 900000 123689 20080 49957 -46376 900000 -70039 125576 -57659 -21894 -5040 -18608 152200 -48693 347986 -1541 103912 -17439 48192 26566 8499 102166 20256 65749 10580 138332 16965 42298 66334 37982 92430 9152 52488 26476 69933 13834 61638 30009 27103 37439 5851 36127 9779 52527 16286 29147 22564 19124 22528 1243 35054 5005 27097 8536 17677 2280 4445 7467 -9244 8824 -4919 8364 -3348 2012 -411 475 35 -969 2480 -1966 9578 -3474 3939 -2025 -2325 -3761 -4202 -216 -6240 62 -3221 735 -3125 -1544 -1659 -3335 -1572 -5294 -54 -4226 1149 -1301 -76 223 -2563 -444 -2748 656 -1572 1106 2 1476 1505 604 3519 1473 3426 206 2330 722 1421 524 -315 858 -614 744 -390 1008 -432 853 -152 -33 596 -2283 -1811 -1156 583 -6831 900000 -3800 900000 -4226 900000 -1456 1849 112 -6405 900000 -5911 2885 -1367 1688 668 900000 1340 317 596 -1279 900000 -2484 1361 -1704 -475 -93 -444 1649 -2427 3771 -57 1239 -661 992 777 350 1882 922 1995 573 2099 864 1696 2157 1729 2604 645 2673 1951 3638 1349 3874 2634 2438 2921 590 2584 933 3643 1888 3411 3032 2673 3076 222 5014 1101 5168 1998 3621 497 838 1214 -1703 1454 -1098 2003 -1078 708 -149 180 14 -414 1068 -900 3850 -1520 1648 -856 -985 -1761 -2111 -126 -4586 50 -2942 650 -2666 -1139 -1102 -2235 -1100 -4073 -42 -3747 1102 -1491 -98 313 -3790 -635 -3879 875 -2181 1569 3 2228 2190 836 4517 1879 4169 251 2752 943 2170 944 -644 1880 -1463 1882 -1066 2835 -1249 2444 -433 -87 1460 -5283 -4031 SS 20231126T083445.1Z 8730.357466 306 1 51.58 2 79.38 147.15 106.08 339.83 0.00 1 0.00 1 0 17 5.656e-01 9.018e-03 9.999e-02 2.317e-03 7.247806e-01 1.231165e-03 8.756612e-03 -6.000000e+00 3.150794e-01 220.53 -2.00 3.85 -2.00 321.52 0.00e+00 5.757267e-03 5.750117e-04 1.578995e-03 -6.000000e+00 1.357262e-02 269.83 -2.00 20.00 -2.00 321.09 0.00e+00 5.221 0.003 302.00 328.00 3 2.9580e-01 3.9990e-03 6.5557e-02 -6.0000e+00 7.7342e-01 1.6243e-01 5.7957e-03 4.2219e-02 -6.0000e+00 8.4666e-01 -1.7426e-01 6.5923e-03 2.5333e-02 -6.0000e+00 5.0323e-01 6.6291e-02 3.1515e-03 1.1952e-02 -6.0000e+00 2.1335e-01 1.0800e-03 1.6935e-04 6.4544e-05 1.4835e-04 -6.0000e+00 1.5416e-02 -3.5830e-02 0.0000e+00 12 9 1 12 4 4 9.26 3.38 0.25 -0.03583 -0.03456 550 117 2 8 0 90.000 14.83 3.38 8.50 20.46 20.87 27.0 919.93 -216816 -152775 -224141 -121622 -220327 -164561 -195600 -159168 -186129 -158681 -137141 -151421 -113258 -109631 -30991 -81714 -33735 -56262 -55704 -45222 -47350 -30729 -55193 -8686 -39373 -32326 -28842 -39160 -33558 -44016 -12454 -26641 121 -20010 -993 -16754 -7466 -2888 -4989 6303 205 8327 418 6281 4784 4693 7625 7141 9907 2609 11797 5209 7935 7086 4867 4254 3625 3415 799 3696 2052 6437 4195 6034 5007 1914 3888 586 3991 2419 3114 1732 1189 939 -497 -1097 -2710 -2108 -2287 956 -1096 -823 -1782 -2208 -924 -1364 775 -310 1244 669 735 -168 -1545 -746 -1600 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