File name: Pandora206s1_BuffaloNY_20231208_L2Fit_fout2c1d20220512p1-8.txt File generation date: 20240113T150025.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Kang Sun Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 206 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora206_OF_v3d20211008.txt Instrument calibration file used: Pandora206s1_CF_v1d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20231208_L1_smca1c1d20220512p1-8.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: 20231208 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]: 305.0398 305.1808 305.3218 305.4628 305.6038 305.7447 305.8857 306.0266 306.1675 306.3084 306.4493 306.5902 306.7311 306.8720 307.0128 307.1537 307.2945 307.4353 307.5761 307.7169 307.8577 307.9985 308.1393 308.2800 308.4207 308.5615 308.7022 308.8429 308.9836 309.1243 309.2649 309.4056 309.5462 309.6869 309.8275 309.9681 310.1087 310.2493 310.3899 310.5305 310.6710 310.8116 310.9521 311.0926 311.2331 311.3736 311.5141 311.6546 311.7950 311.9355 312.0759 312.2164 312.3568 312.4972 312.6376 312.7779 312.9183 313.0587 313.1990 313.3394 313.4797 313.6200 313.7603 313.9006 314.0408 314.1811 314.3214 314.4616 314.6018 314.7421 314.8823 315.0225 315.1626 315.3028 315.4430 315.5831 315.7232 315.8634 316.0035 316.1436 316.2837 316.4238 316.5638 316.7039 316.8439 316.9839 317.1240 317.2640 317.4040 317.5439 317.6839 317.8239 317.9638 318.1038 318.2437 318.3836 318.5235 318.6634 318.8033 318.9431 319.0830 319.2228 319.3627 319.5025 319.6423 319.7821 319.9219 320.0616 320.2014 320.3412 320.4809 320.6206 320.7603 320.9000 321.0397 321.1794 321.3191 321.4587 321.5984 321.7380 321.8776 322.0172 322.1568 322.2964 322.4360 322.5755 322.7151 322.8546 322.9941 323.1336 323.2731 323.4126 323.5521 323.6916 323.8310 323.9705 324.1099 324.2493 324.3887 324.5281 324.6675 324.8069 324.9462 --------------------------------------------------------------------------------------- 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 20231208T153657.7Z 8742.650668 262 1 25.07 2 68.93 157.76 59.98 215.74 0.00 1 0.00 1 0 17 4.889e-02 7.183e-03 2.996e-02 4.586e-03 3.179312e-01 2.226653e-03 3.826840e-03 -6.000000e+00 2.681020e-02 222.42 -2.00 3.55 -2.00 318.56 0.00e+00 9.050949e-04 4.471209e-04 1.772443e-04 -6.000000e+00 1.172222e-03 275.15 -2.00 20.00 -2.00 317.96 0.00e+00 2.755 0.000 302.00 328.00 3 4.9121e+00 5.9903e-03 3.1228e-02 -6.0000e+00 6.6013e-02 2.5645e-02 6.8543e-03 1.6316e-02 -6.0000e+00 7.2156e-02 -3.5230e-04 4.7249e-03 8.1234e-03 -6.0000e+00 4.2959e-02 -5.0503e-03 2.4974e-03 2.5180e-03 -6.0000e+00 1.8359e-02 1.8302e-04 -1.6920e-04 1.2844e-04 2.5356e-05 -6.0000e+00 1.2447e-03 1.4325e-02 -8.9562e-05 12 9 1 12 1 1 99.98 17.91 0.16 0.01432 0.01305 15 17 1 8 0 1566.730 15.00 17.91 12.55 21.48 21.38 19.3 955.79 7086 4648 1938 6329 -5124 -7120 48715 -335 8410 -3416 8189 -2300 -11436 -3907 161 -262 -1309 1021 9181 185 1759 3009 4574 1602 -575 938 -562 -984 -353 2303 1067 6243 1638 -1834 -2267 -5970 -696 -9049 -371 -1947 -903 -2123 1181 -2401 555 -1408 -759 -2125 -1117 -477 1335 878 -404 1892 169 1928 173 941 622 -302 608 1055 1463 1793 307 -397 -620 -1907 931 -425 527 198 1310 655 2934 -336 -285 -719 -1216 -1128 -931 31 -2225 -1109 -1115 254 897 333 -67 856 424 242 193 -87 217 -537 555 740 413 19 1 -918 -631 -198 -413 -1196 -456 -607 -144 331 456 723 -469 -154 -740 -98 -358 112 -172 -36 -362 50 616 -184 655 28 314 581 513 -414 881 22 -390 -76 425 2 428 218 95 9 -79 -351 -908 328 245 110 323 -257 -350 1518 -18 479 -234 493 -159 -1005 -373 17 -31 -164 131 1179 27 259 430 663 256 -99 166 -102 -169 -56 357 183 1111 338 -411 -469 -1250 -153 -2437 -111 -702 -354 -880 492 -1048 235 -612 -323 -903 -466 -200 590 422 -202 986 93 1061 99 532 344 -167 345 646 979 1258 219 -270 -398 -1218 619 -320 431 169 1101 531 2215 -234 -186 -452 -817 -842 -761 28 -2134 -1098 -1188 279 1027 396 -81 974 458 240 182 -80 215 -582 647 941 560 25 1 -1082 -711 -231 -515 -1578 -608 -856 -208 513 732 1177 -744 -233 -1065 -135 -498 158 -261 -56 -579 78 934 -276 924 39 415 779 749 -639 1385 36 -655 -130 767 4 809 424 185 16 -147 -629 -1598 SS 20231208T154245.8Z 8742.654697 265 1 21.76 2 68.54 159.14 60.61 217.18 0.00 1 0.00 1 0 25 1.460e-02 5.128e-03 1.441e-02 2.569e-03 3.145257e-01 1.241415e-03 3.792723e-03 -6.000000e+00 8.007991e-03 222.42 -2.00 3.55 -2.00 318.48 0.00e+00 9.150005e-04 2.446621e-04 1.000846e-04 -6.000000e+00 3.501032e-04 275.15 -2.00 20.00 -2.00 317.89 0.00e+00 2.708 0.000 302.00 328.00 3 3.7805e+00 3.3262e-03 3.0735e-02 -6.0000e+00 1.9718e-02 1.6514e-02 3.8083e-03 1.6063e-02 -6.0000e+00 2.1552e-02 -8.2888e-03 2.5647e-03 8.0278e-03 -6.0000e+00 1.2831e-02 -1.7288e-03 1.3464e-03 2.4765e-03 -6.0000e+00 5.4839e-03 6.0084e-04 -2.4756e-05 7.1666e-05 2.5092e-05 -6.0000e+00 3.7173e-04 1.4245e-02 -6.9344e-05 12 1 1 12 1 1 99.97 17.92 0.45 0.01425 0.01406 40 27 1 8 0 530.680 15.00 17.92 12.69 21.48 21.27 19.4 957.24 -4254 -1399 -2575 1356 -2224 -2662 -6610 493 -2694 -2198 -4413 -2190 -725 -2828 6284 -1893 -1297 -237 587 1107 972 -1974 1934 -115 124 -220 -517 -435 -1915 -2581 797 285 1631 603 -2359 -5770 -2475 -1245 -1032 -603 -1088 -147 -54 -1240 732 -805 -582 -898 0 -400 1270 418 1100 958 1065 1168 900 464 38 588 1635 1684 1533 1289 232 335 -706 -585 389 172 599 89 740 484 149 -107 -529 -1010 -612 -1105 -569 -1298 -1576 -1210 -892 -393 -413 55 199 678 468 255 85 92 107 104 601 957 16 -156 -27 -892 -428 11 -740 -976 -581 -428 -88 -115 490 363 238 62 -302 57 -77 -76 -67 100 -329 10 274 106 597 154 590 846 566 172 242 59 -125 42 35 -175 47 93 34 -147 -19 -551 -302 -240 -85 -165 79 -117 -135 -374 29 -185 -160 -324 -162 -61 -286 677 -249 -179 -34 87 171 153 -316 306 -20 23 -42 -100 -79 -326 -444 145 57 355 139 -515 -1269 -584 -337 -338 -212 -421 -59 -22 -527 304 -342 -244 -371 0 -164 552 198 549 509 586 655 518 267 21 326 928 1035 1036 945 172 228 -457 -372 262 134 508 79 650 408 117 -75 -339 -623 -400 -832 -482 -1233 -1472 -1174 -929 -437 -483 66 240 780 496 248 83 88 110 110 707 1256 22 -215 -35 -1061 -473 13 -935 -1298 -807 -577 -126 -175 794 599 379 93 -448 79 -108 -112 -97 154 -519 15 412 152 878 217 788 1145 837 253 378 95 -207 72 64 -314 85 175 64 -269 -36 -1005 -536 SS 20231208T155610.4Z 8742.664009 269 1 8.73 2 67.73 162.35 62.17 220.42 0.00 1 0.00 1 0 25 1.343e-02 5.194e-03 4.278e-03 9.350e-04 3.027914e-01 4.531006e-04 3.667750e-03 -6.000000e+00 7.365420e-03 222.42 -2.00 3.55 -2.00 318.07 0.00e+00 6.174208e-04 7.908490e-05 8.496540e-05 -6.000000e+00 3.220173e-04 275.15 -2.00 20.00 -2.00 317.47 0.00e+00 2.617 0.000 302.00 328.00 3 1.2156e+00 1.2016e-03 2.9650e-02 -6.0000e+00 1.8135e-02 -1.0285e-02 1.3659e-03 1.5402e-02 -6.0000e+00 1.9823e-02 -1.1570e-02 8.8389e-04 7.6995e-03 -6.0000e+00 1.1802e-02 1.4158e-03 4.5897e-04 2.2941e-03 -6.0000e+00 5.0439e-03 8.8089e-03 -6.4343e-05 2.5979e-05 2.3610e-05 -6.0000e+00 3.4192e-04 1.4129e-02 -7.9498e-05 12 1 1 12 1 1 98.16 17.92 0.29 0.01413 0.01365 142 235 2 8 0 60.190 15.00 17.92 13.50 21.48 21.38 19.6 964.26 -5458 -1091 -3203 -2432 -5240 -4945 -3681 -3509 -1576 -2350 -3630 -4271 -1218 -2266 106 -535 714 -256 1882 539 879 -123 311 140 -346 41 -534 -572 -2377 476 523 1263 1159 -179 -2332 -2204 -2506 -1527 -510 -256 -680 -828 -286 -708 135 -441 32 -475 -782 -66 924 859 786 1146 638 1190 695 830 307 612 1031 1349 1614 1632 377 -176 -228 -695 623 476 641 408 488 314 214 -125 -388 -873 -276 -776 -1039 -866 -2133 -1467 -1067 -642 -372 -22 309 287 430 470 99 364 396 219 430 660 156 -357 -207 -669 -522 -45 -617 -798 -529 -619 -360 185 276 191 109 141 -191 293 40 235 3 95 -302 53 232 323 683 350 570 980 447 291 186 46 -181 17 69 -71 5 140 -41 -199 -177 -393 -534 -387 -82 -255 -181 -350 -317 -249 -266 -132 -211 -325 -396 -126 -277 15 -84 116 -44 331 100 166 -23 60 29 -75 9 -123 -123 -483 94 112 293 297 -49 -594 -547 -690 -484 -176 -105 -306 -389 -139 -349 66 -217 16 -227 -370 -31 464 467 453 700 372 703 423 502 199 391 679 878 1149 1256 294 -127 -154 -463 438 385 569 349 450 278 176 -92 -260 -614 -188 -608 -922 -789 -2104 -1500 -1171 -753 -425 -26 364 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