File name: Pandora257s1_AustinTX_20240629_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20240630T064221.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Paul Walter Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 257 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora257_OF_v3d20221216.txt Instrument calibration file used: Pandora257s1_CF_v2d20230110.txt Level 1 file used: Pandora257s1_AustinTX_20240629_L1_smca1c2d20230110p1-8.txt Full location name: St. Edward's University Short location name: AustinTX Country of location: United States Location latitude [deg]: 30.2285 Location longitude [deg]: -97.7544 Location altitude [m]: 205 Local noon date: 20240629 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are latency correction, matrix method stray light correction (replaced by simple method) Data caveats: OOB session based on clearance session 1 First and last pixel inside fitting window: 228 370 Nominal wavelengths inside fitting window [nm]: 305.0779 305.2183 305.3587 305.4991 305.6395 305.7799 305.9203 306.0607 306.2010 306.3413 306.4817 306.6220 306.7623 306.9026 307.0429 307.1832 307.3234 307.4637 307.6039 307.7442 307.8844 308.0246 308.1648 308.3050 308.4452 308.5854 308.7255 308.8657 309.0058 309.1459 309.2860 309.4261 309.5662 309.7063 309.8464 309.9865 310.1265 310.2665 310.4066 310.5466 310.6866 310.8266 310.9666 311.1065 311.2465 311.3865 311.5264 311.6663 311.8062 311.9461 312.0860 312.2259 312.3658 312.5057 312.6455 312.7854 312.9252 313.0650 313.2048 313.3446 313.4844 313.6242 313.7639 313.9037 314.0434 314.1832 314.3229 314.4626 314.6023 314.7420 314.8816 315.0213 315.1610 315.3006 315.4402 315.5799 315.7195 315.8591 315.9986 316.1382 316.2778 316.4173 316.5569 316.6964 316.8359 316.9754 317.1149 317.2544 317.3939 317.5334 317.6728 317.8123 317.9517 318.0911 318.2305 318.3699 318.5093 318.6487 318.7880 318.9274 319.0667 319.2061 319.3454 319.4847 319.6240 319.7633 319.9025 320.0418 320.1810 320.3203 320.4595 320.5987 320.7379 320.8771 321.0163 321.1555 321.2946 321.4338 321.5729 321.7121 321.8512 321.9903 322.1294 322.2685 322.4075 322.5466 322.6856 322.8247 322.9637 323.1027 323.2417 323.3807 323.5197 323.6587 323.7976 323.9366 324.0755 324.2144 324.3533 324.4922 324.6311 324.7700 324.9089 --------------------------------------------------------------------------------------- Column 1: Two letter code of measurement routine Column 2: UT date and time for center-time of measurement, yyyymmddThhmmssZ (ISO 8601) Column 3: Fractional days since 1-Jan-2000 midnight for center-time of measurement Column 4: Routine count (1 for the first routine of the day, 2 for the second, etc.) Column 5: Repetition count (1 for the first set in the routine, 2 for the second, etc.) Column 6: Total duration of measurement set in seconds Column 7: Data processing type index Column 8: Solar zenith angle for center-time of measurement in degree Column 9: Solar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 10: Lunar zenith angle for center-time of measurement in degree Column 11: Lunar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 12: Pointing zenith angle in degree, absolute or relative (see next column), 999=tracker not used Column 13: Zenith pointing mode: zenith angle is... 0=absolute, 1=relative to sun, 2=relative to moon Column 14: Pointing azimuth in degree, increases clockwise, absolute (0=north) or relative (see next column), 999=tracker not used Column 15: Azimuth pointing mode: like zenith angle mode but also fixed scattering angles relative to sun (3) or moon (4) Column 16: Fitting result index: 0=no error or warning, 1, 2=warning, >2=error Column 17: Number of function evaluations used, 0=linear fitting or fitting not successful or no fitting done Column 18: rms of unweighted fitting residuals, -9=fitting not successful Column 19: Normalized rms of fitting residuals weighted with independent uncertainty, -9=fitting not successful or no uncertainty used Column 20: Expected rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 21: Expected normalized weighted rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 22: Ozone slant column amount [moles per square meter], -9e99=fitting not successful Column 23: Independent uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 24: Structured uncertainty of ozone slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 25: Common uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 26: rms-based uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 27: Ozone effective temperature [K] Column 28: Independent uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 29: Structured uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 30: Common uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 31: Effective ozone fitting wavelength [nm], -9=fitting not successful Column 32: Diffuse correction applied before fitting at effective fitting wavelength for ozone [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 33: Sulfur dioxide slant column amount [moles per square meter], -9e99=fitting not successful Column 34: Independent uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 35: Structured uncertainty of sulfur dioxide slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 36: Common uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 37: rms-based uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 38: Sulfur dioxide effective temperature [K] Column 39: Independent uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 40: Structured uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 41: Common uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 42: Effective sulfur dioxide fitting wavelength [nm], -9=fitting not successful Column 43: Diffuse correction applied before fitting at effective fitting wavelength for sulfur dioxide [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 44: Molecular scattering air mass factor used for molecular scattering subtraction before the fitting Column 45: Estimated uncertainty of molecular scattering air mass factor, -9=molecular scattering was not subtracted before the fitting Column 46: Lower limit used for wavelength scaling [nm] Column 47: Upper limit used for wavelength scaling [nm] Column 48: Order of smoothing polynomial Column 49: Smoothing polynomial coefficient, order 0 Column 50: Independent uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 51: Structured uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 52: Common uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 53: rms-based uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 54: Smoothing polynomial coefficient, order 1 Column 55: Independent uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 56: Structured uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 57: Common uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 58: rms-based uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 59: Smoothing polynomial coefficient, order 2 Column 60: Independent uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 61: Structured uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 62: Common uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 63: rms-based uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 64: Smoothing polynomial coefficient, order 3 Column 65: Independent uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 66: Structured uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 67: Common uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 68: rms-based uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 69: Mean value of measured data inside fitting window [same units as measurements] Column 70: Wavelength change polynomial coefficient, order 0 Column 71: Independent uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 72: Structured uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 73: Common uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 74: rms-based uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 75: L1 based wavelength change coefficient, order 0, -9=no L1 wavelength change determination Column 76: L1 based wavelength change coefficient, order 1, -9=no L1 wavelength change determination Column 77: L2Fit data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 78: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ1 limit, 0=L1 data quality above 0, 1=Spectral fitting was not successful, 2=Wavelength shift too large, 3=Normalized rms of fitting residuals weighted with independent uncertainty too large Column 79: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 80: L1 data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 81: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ1 limit, 0=Saturated data, 1=Too few dark counts measurements, 2=No temperature given or effective temperature too different from the reference temperature, 3=Dark count too high, 4=Unsuccessful dark background fitting, 5=The dark count differs significantly from the dark map for too many pixels, 6=Absolute value of estimated average residual stray light level too high, 7=Although attempted, no wavelength change could be retrieved, 8=Absolute value of retrieved wavelength shift too large, 9=Retrieved wavelength shift differs too much from the shift predicted by the effective temperature Column 82: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 83: Atmospheric variability [%], 999=no atmospheric variability was determined Column 84: Wavelength effective temperature [°C], 999=no effective temperature given Column 85: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 86: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 87: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 88: Number of bright count cycles Column 89: Number of dark count cycles Column 90: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 91: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 92: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 93: Integration time [ms] Column 94: Temperature at electronics board [°C], 999=no temperature signal Column 95: Spectrometer control temperature [°C], 999=no temperature signal Column 96: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 97: Temperature in head sensor [°C], 999=no temperature signal Column 98: Humidity in head sensor [%], -9=no humidity signal Column 99: Pressure in head sensor [hPa], -9=no pressure signal Columns 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: Normalized slant column residuals weighted with independent instrumental uncertainty for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting, 0=no independent instrumental uncertainty was given --------------------------------------------------------------------------------------- SS 20240629T125158.5Z 8946.536094 233 1 12.22 2 75.04 71.59 23.82 175.86 0.00 1 0.00 1 0 17 1.523e-01 9.524e-03 9.385e-02 4.113e-03 4.702933e-01 2.286812e-03 4.985608e-03 -6.000000e+00 9.780710e-02 230.57 -2.00 3.25 -2.00 319.56 0.00e+00 1.315188e-03 7.088598e-04 1.925635e-04 -6.000000e+00 4.647499e-03 292.27 -2.00 20.00 -2.00 318.71 0.00e+00 3.798 0.001 302.00 328.00 3 3.4466e+00 6.6758e-03 4.3555e-02 -6.0000e+00 2.4324e-01 1.8967e-02 7.9875e-03 2.3077e-02 -6.0000e+00 2.6225e-01 1.1853e-02 6.0276e-03 1.1205e-02 -6.0000e+00 1.5684e-01 -1.4563e-02 3.0739e-03 3.7204e-03 -6.0000e+00 6.5084e-02 2.3873e-04 1.0882e-04 1.4205e-04 4.8399e-05 -6.0000e+00 5.5390e-03 2.7240e-02 -5.3461e-05 12 9 9 12 1 1 99.98 28.53 0.60 0.02724 0.02806 18 8 1 5 0 643.070 36.25 20.00 28.53 32.97 0.0 990.89 54467 47860 -34267 900000 -63452 40674 -56732 -59610 -68938 -23843 25549 -3644 -8726 1681 36369 -17160 19488 7580 5957 -684 26911 -11143 46054 16152 -4078 -4787 -5684 616 -6086 -3417 -6229 -5609 -6751 5464 -9835 15515 -5839 -3468 -1917 9189 -1541 -633 7569 -6097 -132 -4287 -1038 3098 2080 3168 1440 6762 1557 4529 -2350 -970 1571 736 436 -711 -1697 -178 2619 -877 -2645 -572 3658 2575 -1379 -84 -713 1190 -641 822 281 651 1325 -3632 -578 226 -2015 -560 -3108 -1593 -60 -909 984 321 894 1354 -1107 15 311 941 703 1028 355 457 178 -566 -280 -541 69 -88 625 -1570 -824 -410 -236 1306 333 322 4 51 -113 -204 104 -213 334 109 75 -814 -102 975 -860 434 398 229 642 -54 259 -226 -176 -221 -274 -191 -288 336 920 -234 -10 -343 -188 371 384 -646 900000 -1552 359 -1433 -1721 -2405 -574 410 -89 -266 55 992 -908 789 374 318 -41 1263 -791 1939 978 -320 -392 -472 48 -510 -296 -614 -614 -812 605 -1290 1655 -862 -586 -376 1853 -383 -151 1912 -1645 -34 -1167 -277 887 565 900 449 2177 570 1715 -1001 -422 678 321 190 -317 -800 -89 1388 -469 -1469 -307 2031 1489 -822 -55 -501 852 -464 561 179 382 797 -2115 -353 154 -1593 -448 -2770 -1497 -60 -961 992 334 918 1437 -1135 14 284 866 698 1055 413 583 225 -717 -361 -654 79 -102 756 -2055 -1058 -558 -345 1900 521 519 6 78 -164 -305 155 -330 505 172 119 -1291 -157 1515 -1304 625 563 332 994 -85 440 -384 -312 -411 -539 -371 -579 682 1852 -464 -19 -667 -360 SS 20240629T130713.9Z 8946.546688 243 1 3.76 2 71.90 73.21 23.78 185.09 0.00 1 0.00 1 0 17 9.051e-02 1.317e-02 1.021e-01 1.127e-02 3.926521e-01 6.193506e-03 4.230804e-03 -6.000000e+00 5.808040e-02 230.57 -2.00 3.25 -2.00 318.88 0.00e+00 3.719314e-03 1.527102e-03 1.763213e-04 -6.000000e+00 2.708755e-03 292.27 -2.00 20.00 -2.00 317.98 0.00e+00 3.176 0.000 302.00 328.00 3 4.2588e+00 1.7300e-02 3.6498e-02 -6.0000e+00 1.4452e-01 6.2459e-02 2.0031e-02 1.9866e-02 -6.0000e+00 1.5580e-01 -1.6663e-02 1.3512e-02 9.5232e-03 -6.0000e+00 9.3201e-02 -5.4495e-03 6.8920e-03 4.6317e-03 -6.0000e+00 3.8658e-02 2.0419e-04 2.7081e-05 3.9518e-04 5.3471e-05 -6.0000e+00 3.2722e-03 2.6072e-02 -3.5261e-05 12 9 9 12 33 1 999.00 28.55 0.13 0.02607 0.02627 1 3 1 5 0 1878.250 36.50 20.00 28.55 33.23 0.0 992.42 10685 -6354 -32040 19098 -49494 -13229 -41915 -19373 28697 -11016 5911 -15228 21802 -1354 20075 -7212 3807 -3217 28657 13559 8231 -4616 -4192 22126 -8921 -5246 1923 -8456 -5006 1985 8936 4853 -1337 8618 -2639 4567 -9952 -5465 1503 8159 -7227 3406 6623 103 -4270 -3996 -2071 4375 1249 3999 2665 3471 -1515 -5186 -1155 2350 -4141 3081 864 -696 75 7478 5190 -822 -1566 -1474 2467 947 -1053 -2080 231 709 1296 -420 -2437 -740 2952 -3612 52 -1798 -3098 -861 -1904 -609 322 503 141 13 932 1559 12 1174 -27 -355 1028 1477 -321 1885 -91 -853 -714 -365 -384 -179 -756 30 -1497 -265 -674 745 -95 -5 -324 731 150 -562 1107 481 668 -976 -876 -1416 54 1772 430 1189 -878 -430 1822 453 536 -760 -464 54 -2 564 -658 133 911 343 -772 -243 -520 282 -216 -1443 504 -2502 -465 -2073 -830 820 -496 240 -853 982 -91 1257 -666 343 -332 2267 1296 850 -553 -516 2188 -1255 -726 247 -1189 -682 264 1208 752 -236 1421 -490 818 -2275 -1381 413 2385 -2455 1106 2164 37 -1612 -1517 -774 1543 463 1502 1081 1501 -735 -2756 -613 1235 -2350 1625 464 -385 43 4288 3287 -534 -1035 -949 1491 590 -716 -1565 183 579 1045 -330 -1821 -500 1970 -2345 34 -1365 -2675 -742 -1792 -603 337 557 153 14 1018 1758 13 1165 -26 -341 1037 1641 -376 2367 -123 -1153 -920 -439 -443 -209 -930 39 -2071 -359 -976 1139 -145 -7 -498 1129 219 -794 1533 693 1011 -1568 -1427 -2295 85 2607 612 1729 -1272 -631 2589 701 883 -1247 -790 96 -5 1032 -1257 256 1746 645 -1418 -455 -963 SS 20240629T131036.2Z 8946.549031 246 1 6.50 2 71.21 73.57 23.84 187.12 0.00 1 0.00 1 0 17 3.088e-02 6.538e-03 1.951e-02 3.006e-03 3.879439e-01 1.660569e-03 4.158344e-03 -6.000000e+00 1.981643e-02 230.57 -2.00 3.25 -2.00 318.31 0.00e+00 3.814886e-05 3.434014e-04 1.773605e-04 -6.000000e+00 9.241686e-04 292.27 -2.00 20.00 -2.00 317.41 0.00e+00 3.065 0.000 302.00 328.00 3 3.1742e+00 4.5324e-03 3.5305e-02 -6.0000e+00 4.9309e-02 1.4738e-02 5.1648e-03 1.8746e-02 -6.0000e+00 5.3158e-02 2.2021e-03 3.2917e-03 9.0104e-03 -6.0000e+00 3.1799e-02 -7.3837e-03 1.6551e-03 2.4361e-03 -6.0000e+00 1.3190e-02 6.9448e-04 2.7273e-04 1.0505e-04 3.5176e-05 -6.0000e+00 1.1164e-03 2.6612e-02 -1.0032e-05 12 9 1 12 1 1 99.99 28.56 0.47 0.02661 0.02866 15 13 1 5 0 406.020 36.25 20.00 28.56 33.31 0.0 993.69 1829 -16689 -10704 -4320 -6627 -9289 -8936 983 -11041 -14495 -4177 -3047 -7606 285 68 1393 1115 1709 5038 2277 2519 -4302 5785 2189 -640 -5334 -3414 -371 -3215 -1089 -1235 -2135 -1778 1166 -3296 283 -1728 692 -2603 1656 -1640 -1082 1326 -1601 720 -1038 -572 257 -1137 750 772 1875 1782 2178 -73 683 840 1410 558 862 1582 1542 2047 432 -535 -1181 298 708 429 964 -39 -10 95 -26 285 85 533 -1877 149 -791 -797 -1365 -1992 -1686 -1061 -816 -127 528 628 834 41 434 -428 132 883 824 -23 334 135 -950 -590 -127 -376 4 -369 -803 -660 -277 -648 531 527 -46 250 -101 -54 -34 280 342 538 301 -121 -267 240 608 -10 160 378 550 793 143 -55 47 -320 -222 -247 64 25 374 729 -312 -416 -373 -604 71 -846 -521 -192 -293 -428 -440 48 -670 -973 -271 -216 -649 26 7 161 140 227 681 329 374 -702 892 371 -107 -960 -600 -68 -603 -207 -230 -439 -390 255 -762 66 -455 207 -865 603 -677 -472 584 -739 327 -482 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