File name: Pandora101s1_Izana_20231022_L2Fit_fout2c22d20230904p1-8.txt File generation date: 20240911T131155.4Z Data description: Level 2 spectral fitting results file Data file version: fout2c22p1-8 Local principal investigator: Alberto Redondas Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 101 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora101_OF_v3d20220624.txt Instrument calibration file used: Pandora101s1_CF_v22d20230904.txt Level 1 file used: Pandora101s1_Izana_20231022_L1_smca1c22d20230904p1-8.txt Full location name: Izana Atmospheric Research Center Short location name: Izana Country of location: Spain Location latitude [deg]: 28.3090 Location longitude [deg]: -16.4994 Location altitude [m]: 2360 Local noon date: 20231022 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: Based on session 12 fieldcal with sens applied First and last pixel inside fitting window: 222 363 Nominal wavelengths inside fitting window [nm]: 305.1209 305.2618 305.4026 305.5434 305.6843 305.8251 305.9659 306.1066 306.2474 306.3882 306.5289 306.6697 306.8104 306.9511 307.0918 307.2325 307.3732 307.5139 307.6545 307.7952 307.9358 308.0764 308.2170 308.3576 308.4982 308.6388 308.7794 308.9199 309.0605 309.2010 309.3415 309.4820 309.6225 309.7630 309.9035 310.0440 310.1844 310.3249 310.4653 310.6057 310.7461 310.8865 311.0269 311.1673 311.3076 311.4480 311.5883 311.7287 311.8690 312.0093 312.1496 312.2898 312.4301 312.5704 312.7106 312.8509 312.9911 313.1313 313.2715 313.4117 313.5519 313.6920 313.8322 313.9723 314.1125 314.2526 314.3927 314.5328 314.6729 314.8129 314.9530 315.0931 315.2331 315.3731 315.5131 315.6531 315.7931 315.9331 316.0731 316.2130 316.3530 316.4929 316.6329 316.7728 316.9127 317.0526 317.1924 317.3323 317.4722 317.6120 317.7518 317.8916 318.0315 318.1712 318.3110 318.4508 318.5906 318.7303 318.8701 319.0098 319.1495 319.2892 319.4289 319.5686 319.7082 319.8479 319.9875 320.1272 320.2668 320.4064 320.5460 320.6856 320.8252 320.9647 321.1043 321.2438 321.3833 321.5229 321.6624 321.8019 321.9413 322.0808 322.2203 322.3597 322.4991 322.6386 322.7780 322.9174 323.0568 323.1961 323.3355 323.4749 323.6142 323.7535 323.8928 324.0321 324.1714 324.3107 324.4500 324.5893 324.7285 324.8677 --------------------------------------------------------------------------------------- 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 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: 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 20231022T080619.5Z 8695.337726 60 1 50.20 2 79.05 108.97 169.88 73.74 0.00 1 0.00 1 0 25 1.989e-01 6.138e-03 6.314e-02 2.490e-03 5.675829e-01 1.287340e-03 6.028593e-03 -6.000000e+00 1.118265e-01 225.27 -2.00 3.19 -2.00 320.35 0.00e+00 2.302605e-03 4.620782e-04 5.274827e-04 -6.000000e+00 4.864620e-03 278.04 -2.00 20.00 -2.00 319.82 0.00e+00 5.082 0.001 302.00 328.00 3 4.6506e+00 3.8363e-03 4.6817e-02 -6.0000e+00 2.7695e-01 8.1863e-02 4.8110e-03 2.7079e-02 -6.0000e+00 3.0066e-01 -4.0809e-02 4.6073e-03 1.4347e-02 -6.0000e+00 1.7879e-01 1.1211e-02 2.3563e-03 5.1215e-03 -6.0000e+00 7.7852e-02 5.3920e-05 -5.7770e-04 6.7585e-05 5.1991e-05 -6.0000e+00 5.1484e-03 -4.1146e-04 0.0000e+00 12 1 1 12 1 1 100.00 20.96 0.15 -0.00041 -0.00475 280 73 1 5 0 167.320 20.96 15.00 14.43 10.50 0.2 886.43 -61341 -72217 -56075 -79299 -71566 -100822 -60061 -52732 -45013 -55363 -44834 -43179 -25637 -22212 -25154 -5658 -14422 -6711 -22971 -15821 -18186 -12067 -12200 -1826 -14669 3990 -13459 -4527 -1605 -2123 1355 -2794 -1693 -9091 -7270 -11443 -2010 -5381 1505 -460 882 -984 4394 3164 2758 444 1086 1834 567 3545 647 1875 1539 3210 1553 1808 1013 299 232 1698 1242 2455 2680 2514 995 211 437 -390 923 313 826 149 510 -360 7 -756 -1669 -1621 -762 -424 -1381 -1273 -1886 -1506 -829 -135 -57 622 435 836 451 218 -927 -344 72 -110 568 521 464 -115 -526 -1130 -359 -1105 -1259 -1087 -619 -181 367 458 811 699 508 65 -97 54 -467 81 -257 -260 -87 456 218 415 153 -31 363 303 353 207 -116 -204 71 -229 -27 -286 334 35 42 -56 -123 -286 -636 -940 -644 -1068 -821 -1580 -703 -663 -586 -843 -643 -715 -453 -480 -688 -147 -452 -213 -918 -618 -734 -461 -498 -74 -725 171 -680 -201 -69 -102 75 -189 -128 -750 -555 -934 -171 -529 170 -62 128 -154 680 503 446 75 185 319 104 678 142 451 403 888 456 550 316 92 70 500 389 850 1049 1081 436 89 181 -170 451 163 459 85 281 -187 4 -345 -731 -736 -394 -238 -901 -929 -1481 -1244 -728 -125 -56 608 419 759 379 171 -710 -276 65 -115 628 647 607 -145 -612 -1271 -380 -1244 -1422 -1283 -768 -238 529 732 1304 1150 817 106 -148 79 -710 129 -438 -424 -149 742 343 628 223 -43 489 439 579 351 -212 -387 141 -482 -61 -626 737 79 93 -127 -260 -571 SS 20231022T081040.5Z 8695.340746 63 1 4.96 2 78.14 109.55 169.00 75.48 0.00 1 0.00 1 0 25 1.364e-01 6.840e-03 4.197e-02 2.586e-03 5.317132e-01 1.313559e-03 5.688265e-03 -6.000000e+00 7.668783e-02 225.27 -2.00 3.19 -2.00 319.60 0.00e+00 1.405690e-03 3.753309e-04 7.151210e-04 -6.000000e+00 3.335918e-03 278.04 -2.00 20.00 -2.00 319.03 0.00e+00 4.724 0.001 302.00 328.00 3 3.3570e+00 3.6935e-03 4.3500e-02 -6.0000e+00 1.8992e-01 4.8961e-02 4.4066e-03 2.5009e-02 -6.0000e+00 2.0617e-01 -3.4352e-02 3.7986e-03 1.2992e-02 -6.0000e+00 1.2260e-01 8.8529e-03 2.0143e-03 4.1616e-03 -6.0000e+00 5.3394e-02 2.7115e-04 -3.6177e-04 6.8694e-05 4.0786e-05 -6.0000e+00 3.5299e-03 -1.2748e-03 0.0000e+00 12 9 1 12 1 1 99.83 20.96 0.20 -0.00127 -0.00399 30 81 1 5 0 150.200 20.96 15.00 14.42 10.50 0.2 886.43 -60309 -43896 -40985 -43022 -52877 -57847 -50018 -42578 -37129 -28627 -35773 -26169 -17551 -20232 -10363 -9397 -7234 -5532 -3851 -4295 -4605 -3244 -10 325 -1533 -1360 -5782 -6614 -5622 -3539 -5249 2811 -2911 -5053 -4580 -4327 -3001 22 665 512 -1370 1074 551 282 1228 854 1373 247 65 461 2058 1674 2094 1625 1984 1634 488 355 -272 377 1253 2068 2444 2652 592 376 -172 366 906 931 761 -23 561 483 -595 -1481 -2061 -3115 -1487 -2159 -1432 -1408 -1471 -1112 -802 518 225 708 355 383 249 -735 -842 -473 -204 446 580 841 242 69 -895 -995 -395 -334 -1156 -1188 -452 -68 386 789 889 676 426 374 -66 -110 -531 -56 -36 -167 12 525 527 374 -53 -34 173 586 210 123 -443 -40 -342 -505 -172 -41 217 365 208 -160 28 -539 -1171 -808 -754 -749 -933 -1094 -984 -902 -833 -621 -866 -666 -513 -760 -429 -441 -363 -297 -217 -254 -276 -193 -1 22 -113 -105 -459 -505 -421 -284 -458 264 -326 -583 -494 -478 -374 3 120 108 -321 260 139 72 315 223 361 67 18 138 619 557 752 627 797 683 210 150 -113 155 538 984 1205 1423 324 195 -88 194 542 636 520 -17 381 331 -372 -839 -1110 -1747 -937 -1610 -1129 -1240 -1292 -1028 -793 537 245 779 385 394 236 -701 -774 -455 -206 481 712 1087 330 91 -1156 -1152 -434 -387 -1460 -1480 -589 -94 550 1237 1420 1104 677 590 -97 -158 -782 -87 -56 -269 18 837 813 555 -81 -49 242 874 334 205 -791 -71 -628 -986 -339 -85 451 767 433 -319 56 -1008 SS 20231022T082722.8Z 8695.352347 72 1 1.30 2 74.71 111.85 165.59 80.43 0.00 1 0.00 1 0 25 4.495e-02 6.850e-03 3.812e-02 4.460e-03 4.286392e-01 2.241867e-03 4.679783e-03 -6.000000e+00 2.526987e-02 225.27 -2.00 3.19 -2.00 318.67 0.00e+00 7.181255e-04 4.798066e-04 3.468632e-04 -6.000000e+00 1.099295e-03 278.04 -2.00 20.00 -2.00 318.07 0.00e+00 3.724 0.000 302.00 328.00 3 3.7400e+00 6.0602e-03 3.4543e-02 -6.0000e+00 6.2582e-02 1.2651e-02 6.9423e-03 2.0030e-02 -6.0000e+00 6.7942e-02 -9.8164e-04 5.0926e-03 1.0092e-02 -6.0000e+00 4.0402e-02 -4.9777e-03 2.7374e-03 3.0091e-03 -6.0000e+00 1.7592e-02 4.3756e-04 -2.2241e-04 1.2110e-04 3.0143e-05 -6.0000e+00 1.1635e-03 8.0133e-05 0.0000e+00 12 9 1 12 1 1 99.75 20.96 0.26 0.00008 -0.00159 6 84 1 5 0 144.350 20.96 15.01 14.41 10.82 0.2 890.56 -3066 -20164 -3981 1714 -25366 -5980 -25802 -7026 -16760 2231 -15377 -6967 -4934 1004 -3156 50 -4538 3225 -984 226 2435 -1601 -2481 5051 -2920 -106 -2868 -8431 4311 1843 5093 22 -1708 -579 -3344 381 -2764 6 -930 757 -693 -203 -77 -419 -822 527 -948 1237 -319 -418 -183 1019 1138 622 216 795 1115 -557 1418 1021 957 136 2456 1396 914 289 876 224 928 559 917 979 516 -190 -945 326 -520 -1104 -2045 -1474 -713 -1593 -2178 -1845 -1119 -284 91 -183 88 225 -184 -32 534 -386 355 769 1278 661 -437 125 -763 -1014 -234 -394 -832 -607 -861 13 421 903 754 780 681 130 104 -25 154 -83 -543 -776 -247 504 624 -8 339 65 213 920 -281 308 -260 -107 -130 -251 141 -539 265 54 -94 159 -526 78 -97 -757 -142 53 -938 -185 -1088 -284 -831 95 -796 -373 -285 66 -257 4 -448 316 -106 25 268 -183 -304 625 -419 -15 -418 -1226 537 250 763 4 -345 -115 -641 72 -616 2 -276 255 -257 -73 -28 -156 -310 197 -359 499 -123 -169 -81 487 583 340 114 431 612 -306 801 579 532 85 1653 952 616 196 568 150 652 448 787 805 443 -154 -703 229 -345 -746 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