File name: Pandora206s1_BuffaloNY_20240418_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T075634.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: Kang Sun Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 206 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora206_OF_v3d20211008.txt Instrument calibration file used: Pandora206s1_CF_v4d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20240418_L1_smca1c4d20220512p1-8.txt Full location name: University at Buffalo Short location name: BuffaloNY Country of location: Canada Location latitude [deg]: 43.0015 Location longitude [deg]: -78.7869 Location altitude [m]: 190 Local noon date: 20240418 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: None First and last pixel inside fitting window: 223 365 Nominal wavelengths inside fitting window [nm]: 305.0744 305.2154 305.3564 305.4973 305.6383 305.7792 305.9201 306.0611 306.2020 306.3428 306.4837 306.6246 306.7654 306.9063 307.0471 307.1879 307.3287 307.4695 307.6103 307.7511 307.8918 308.0326 308.1733 308.3140 308.4548 308.5955 308.7362 308.8768 309.0175 309.1582 309.2988 309.4394 309.5801 309.7207 309.8613 310.0019 310.1424 310.2830 310.4236 310.5641 310.7046 310.8451 310.9857 311.1261 311.2666 311.4071 311.5476 311.6880 311.8285 311.9689 312.1093 312.2497 312.3901 312.5305 312.6708 312.8112 312.9515 313.0919 313.2322 313.3725 313.5128 313.6531 313.7934 313.9336 314.0739 314.2141 314.3543 314.4946 314.6348 314.7750 314.9151 315.0553 315.1955 315.3356 315.4758 315.6159 315.7560 315.8961 316.0362 316.1763 316.3163 316.4564 316.5964 316.7364 316.8765 317.0165 317.1565 317.2964 317.4364 317.5764 317.7163 317.8563 317.9962 318.1361 318.2760 318.4159 318.5558 318.6956 318.8355 318.9753 319.1152 319.2550 319.3948 319.5346 319.6744 319.8141 319.9539 320.0937 320.2334 320.3731 320.5128 320.6525 320.7922 320.9319 321.0716 321.2112 321.3509 321.4905 321.6301 321.7697 321.9093 322.0489 322.1885 322.3280 322.4676 322.6071 322.7467 322.8862 323.0257 323.1652 323.3046 323.4441 323.5836 323.7230 323.8624 324.0018 324.1413 324.2806 324.4200 324.5594 324.6988 324.8381 324.9774 --------------------------------------------------------------------------------------- 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 20240418T115922.2Z 8874.499563 172 1 24.01 2 74.27 89.38 118.24 333.43 0.00 1 0.00 1 0 17 3.959e-01 1.017e-02 2.970e-01 9.557e-03 5.937521e-01 5.019592e-03 6.656368e-03 -6.000000e+00 2.245229e-01 228.59 -2.00 3.55 -2.00 320.46 0.00e+00 3.006010e-03 1.872421e-03 4.546834e-04 -6.000000e+00 1.099139e-02 278.34 -2.00 20.00 -2.00 319.91 0.00e+00 3.623 0.001 302.00 328.00 3 5.2972e+00 1.5097e-02 4.7492e-02 -6.0000e+00 5.6243e-01 1.0756e-01 1.9285e-02 3.1639e-02 -6.0000e+00 6.1226e-01 -3.2569e-02 1.9223e-02 1.7112e-02 -6.0000e+00 3.6066e-01 4.2805e-04 9.7176e-03 7.7878e-03 -6.0000e+00 1.5458e-01 3.5243e-05 2.0042e-03 2.6135e-04 6.6957e-05 -6.0000e+00 1.0696e-02 -1.7991e-02 6.2307e-04 12 8 8 10 0 0 100.00 18.16 0.70 -0.01799 -0.00293 6 6 2 8 0 4000.000 15.01 18.16 15.64 21.69 21.58 21.3 1009.42 -96185 -69865 900000 900000 900000 -84156 276582 900000 53668 900000 900000 60650 -56209 133057 -19899 36905 196754 -10451 -18759 -21973 43917 -5325 169381 -5850 22595 16400 6125 -28215 3314 -25373 35672 15083 -15250 -14119 -2590 -3789 -13398 7464 19787 12005 -15130 -1283 264 1386 19927 -8112 -10847 -17581 8950 -2154 2118 -1661 -332 -296 10863 3664 2647 -2123 -1014 -2074 3800 958 -553 4380 173 3360 -1610 2220 631 -744 1005 2248 256 560 224 -1647 1816 67 -3640 -2406 -47 -299 -659 -2037 -88 -163 2131 -791 -229 1290 460 35 199 353 -3437 271 810 958 -179 354 78 -465 181 -202 156 -1069 -663 806 -795 112 -441 224 -813 -106 15 479 -206 195 547 520 -616 -1131 82 84 1289 254 608 1213 242 -169 502 49 -518 -333 42 -66 -199 347 118 372 -2 -918 30 -923 -650 900000 900000 900000 -832 2575 900000 500 900000 900000 565 -932 1239 -371 472 1832 -268 -568 -729 779 -153 1577 -194 605 496 212 -1330 110 -1196 1090 667 -1033 -1032 -164 -237 -1025 545 1572 1212 -2262 -178 38 204 2457 -1357 -1897 -3373 1369 -388 407 -370 -79 -77 2682 1005 757 -634 -290 -589 1048 299 -198 1638 71 1309 -626 872 267 -371 544 1252 144 296 108 -744 733 27 -1721 -1294 -29 -202 -488 -1604 -73 -140 1875 -737 -212 1127 384 27 151 273 -2982 254 865 1139 -227 452 93 -517 181 -206 172 -1252 -791 1013 -1071 166 -706 373 -1351 -168 23 683 -299 293 852 845 -999 -1772 126 124 1836 351 803 1657 367 -279 893 90 -998 -659 90 -142 -438 774 262 805 -5 -1837 57 SS 20240418T145722.3Z 8874.623175 268 1 24.01 2 43.54 126.71 120.40 21.14 0.00 1 0.00 1 0 17 2.141e-02 1.161e-02 3.297e-02 9.298e-03 2.651225e-01 4.612461e-03 3.163183e-03 -6.000000e+00 1.201533e-02 228.60 -2.00 3.55 -2.00 317.53 0.00e+00 -7.834690e-04 6.885208e-04 7.689566e-05 -6.000000e+00 5.202243e-04 278.36 -2.00 20.00 -2.00 316.86 0.00e+00 1.378 0.000 302.00 328.00 3 7.6802e+00 1.2249e-02 1.9437e-02 -6.0000e+00 2.9971e-02 5.4540e-02 1.3812e-02 1.3682e-02 -6.0000e+00 3.2598e-02 1.5434e-02 8.4818e-03 6.7499e-03 -6.0000e+00 1.9352e-02 -1.4430e-02 4.2400e-03 1.9837e-03 -6.0000e+00 8.1833e-03 4.3640e-05 -4.9696e-04 2.5708e-04 1.9802e-05 -6.0000e+00 5.4597e-04 -1.1666e-02 6.7376e-05 12 8 8 10 0 0 -186.27 18.16 0.72 -0.01167 -0.01540 6 6 2 8 0 4000.000 15.00 18.16 16.01 21.69 21.58 21.5 1012.81 -1953 -3616 9078 512 3719 -2694 2671 1442 214 6740 -6 -1522 -3528 5922 -856 4078 1398 7996 964 -1430 1702 228 -278 -1042 -3341 -1532 2996 927 940 -3188 2045 4765 2535 -3783 395 -1525 -151 -3494 419 -486 -2695 -2611 2934 -1475 3372 254 -4519 -5020 -161 -989 588 597 -2492 1575 -1154 -140 1674 -196 803 -1423 -100 2786 1309 2848 -13 218 -1679 -1719 439 -1360 2039 589 1599 1672 1989 1000 -603 1446 -2283 -1058 -1517 -122 -2795 -1729 108 82 1270 724 1252 1410 644 -868 -179 -1954 -1347 -1636 1139 1445 1146 642 181 -1353 -1008 -477 367 -812 -432 -1987 -909 1175 1251 434 -699 -711 -1147 -553 -673 -1227 -580 53 1130 -241 873 444 1324 -667 -611 775 185 -470 -84 247 783 -26 330 1181 529 436 173 522 -650 -1627 -766 -187 -385 905 52 318 -236 238 146 25 781 -1 -190 -506 881 -155 781 285 1582 213 -335 394 53 -66 -268 -927 -436 819 241 223 -774 503 1221 725 -1197 110 -433 -45 -1255 175 -235 -1454 -1461 1601 -845 1822 141 -2579 -2796 -86 -534 331 350 -1588 1021 -793 -97 1162 -138 544 -974 -69 2020 1047 2401 -12 170 -1243 -1275 328 -1184 1880 557 1490 1540 1692 790 -436 968 -1662 -863 -1351 -119 -2883 -1835 121 99 1538 908 1567 1735 732 -941 -176 -1883 -1372 -1848 1349 1844 1551 849 232 -1613 -1154 -565 458 -1075 -595 -2830 -1342 1811 1978 698 -1089 -1056 -1607 -720 -879 -1683 -849 80 1714 -364 1273 638 1780 -899 -777 978 253 -670 -125 376 1206 -40 548 2041 913 772 309 921 -1117 -2720 -1238 SS 20240418T155828.1Z 8874.665603 304 1 24.00 2 35.86 147.00 115.41 36.26 0.00 1 0.00 1 0 17 3.448e-02 1.332e-02 2.718e-02 9.448e-03 2.368005e-01 4.678813e-03 2.861460e-03 -6.000000e+00 1.936427e-02 228.60 -2.00 3.55 -2.00 317.11 0.00e+00 1.342302e-03 6.296824e-04 6.686060e-05 -6.000000e+00 8.376432e-04 278.36 -2.00 20.00 -2.00 316.45 0.00e+00 1.233 0.000 302.00 328.00 3 7.8622e+00 1.2342e-02 1.7428e-02 -6.0000e+00 4.8303e-02 6.8229e-02 1.3876e-02 1.2369e-02 -6.0000e+00 5.2525e-02 4.4128e-03 8.2709e-03 6.0661e-03 -6.0000e+00 3.1183e-02 -9.6429e-03 4.0388e-03 1.9731e-03 -6.0000e+00 1.3193e-02 4.3558e-05 -3.6856e-04 2.6054e-04 1.9426e-05 -6.0000e+00 8.7884e-04 -1.1985e-02 2.4850e-04 12 9 8 11 8 0 62.97 18.16 0.91 -0.01198 -0.01475 6 6 2 8 0 4000.000 15.00 18.16 18.43 21.69 21.58 21.3 1025.23 -12450 3202 7809 16348 -5482 2431 -5528 10097 -7775 2348 -5086 5040 -7005 2501 13612 -4710 5923 -4724 -3533 -300 7450 -809 9007 -3125 3583 -5104 4566 -590 -1664 -3730 2568 2279 -1341 -673 -4157 -141 -3980 -3684 1822 2603 -2512 356 42 -1401 3031 -1446 -2134 -3685 -39 -1716 3151 -1674 1556 2750 2232 -2236 1056 305 348 766 -3772 1334 -701 1842 1231 2090 -3817 1068 641 380 1605 375 1917 1829 1386 -456 786 -1904 -2446 -2713 -667 -1261 -995 -1729 69 581 1660 -14 1200 681 -51 -1205 -265 -2128 614 -1015 429 1593 841 1320 -51 -1489 -2248 -1476 135 -1904 -460 -153 11 506 681 460 -153 -951 -1581 -423 -852 -1072 -142 251 416 -232 941 1374 1805 683 -600 1330 1043 -44 150 -292 -548 -256 -251 1756 -702 272 1055 431 106 -1485 -1552 -1780 430 1033 1866 -673 269 -674 1203 -1195 345 -809 726 -1239 460 2557 -1179 1378 -1262 -968 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