File name: Pandora206s1_BuffaloNY_20240928_L2Fit_fout2c1d20220512p1-8.txt File generation date: 20240929T050851.8Z 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 v1.8.60 Instrument operation file used: Pandora206_OF_v3d20211008.txt Instrument calibration file used: Pandora206s1_CF_v1d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20240928_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: 20240928 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 20240928T130034.2Z 9037.542063 202 1 24.01 2 71.13 112.20 29.73 140.46 0.00 1 0.00 1 0 17 5.630e-01 3.071e-02 2.656e-01 1.899e-02 3.525613e-01 9.669767e-03 4.286469e-03 -6.000000e+00 3.227218e-01 227.43 -2.00 3.55 -2.00 319.38 0.00e+00 1.845456e-03 2.576667e-03 1.239923e-03 -6.000000e+00 1.481993e-02 283.68 -2.00 20.00 -2.00 318.67 0.00e+00 3.055 0.000 302.00 328.00 3 6.6382e+00 2.7321e-02 3.5639e-02 -6.0000e+00 8.0088e-01 -6.6428e-03 3.2332e-02 2.1012e-02 -6.0000e+00 8.7116e-01 9.2715e-02 2.5899e-02 9.3385e-03 -6.0000e+00 5.1367e-01 -3.5840e-02 1.3648e-02 3.4370e-03 -6.0000e+00 2.1984e-01 2.2239e-05 -1.9045e-03 5.5163e-04 2.9422e-05 -6.0000e+00 1.4815e-02 -1.4214e-02 -1.0394e-04 12 9 8 11 8 0 8.16 17.95 -0.63 -0.01421 -0.02853 6 6 2 8 0 4000.000 15.00 17.95 24.08 20.96 20.77 24.1 965.88 -92017 900000 -26564 900000 209581 900000 900000 900000 163357 208618 335276 123108 9861 48183 69610 16927 341971 40151 43298 14041 146963 24293 43150 38212 12179 -32528 -16174 22061 -9595 37454 -28750 15391 7541 35094 17365 3088 8161 11807 45423 -7985 17884 -3228 8973 -13922 472 -7289 -8005 -17156 2994 -1241 11294 4785 -2458 -1665 -1234 2493 -2123 4779 230 -2855 -10016 4845 -3646 -197 -1311 -1820 -3125 -2703 4234 -3924 5475 -1305 2632 2554 10606 -2213 15524 -1485 8357 -3073 591 5371 -5877 -1074 -3001 4184 -1100 651 -2711 1540 -742 -1673 3827 5466 -2074 -3352 3886 -984 1592 -343 5041 -611 2154 -5229 2171 -1413 362 436 -484 -843 696 -1745 -4334 -842 -482 2992 -3130 -537 3241 1118 -390 -34 -420 1582 2244 -1443 263 -1455 2438 -113 3225 -432 1000 -3929 -135 -222 -1680 4585 53 199 400 -2046 -269 -4747 900000 -951 900000 3879 900000 900000 900000 3023 3861 6205 2278 359 1486 2061 930 6329 2085 2326 1031 3400 1672 2576 2497 1099 -4688 -2050 1901 -1060 2638 -4047 1602 946 3653 2059 398 1086 1748 5805 -2042 3992 -943 2430 -4736 144 -2432 -2694 -6263 893 -390 3331 1650 -975 -701 -545 1085 -995 2106 104 -1311 -5049 2266 -2049 -117 -799 -1079 -1751 -1473 2241 -2581 3675 -961 1940 1819 6525 -1391 7595 -815 4301 -1964 416 4048 -5243 -953 -2900 4060 -1189 718 -3134 1661 -759 -1632 3254 4374 -1888 -3453 4180 -1215 2089 -459 6017 -711 2296 -6003 2533 -1762 462 587 -695 -1306 1111 -2958 -7391 -1345 -707 4062 -4325 -750 4654 1755 -637 -55 -658 2339 3210 -2051 348 -1939 3378 -175 4990 -724 1690 -7205 -253 -430 -3386 9130 109 396 782 -3942 -490 SS 20240928T131039.3Z 9037.549065 208 1 6.31 2 69.44 114.18 28.65 144.75 0.00 1 0.00 1 0 17 2.130e-02 5.173e-03 5.865e-03 9.372e-04 3.407440e-01 4.664327e-04 4.101415e-03 -6.000000e+00 1.195530e-02 227.43 -2.00 3.55 -2.00 318.51 0.00e+00 5.601638e-04 9.389657e-05 1.154513e-04 -6.000000e+00 5.295847e-04 283.68 -2.00 20.00 -2.00 317.75 0.00e+00 2.819 0.000 302.00 328.00 3 5.9160e-01 1.2677e-03 3.2774e-02 -6.0000e+00 2.9690e-02 -9.9338e-03 1.4487e-03 1.7849e-02 -6.0000e+00 3.2237e-02 -1.2642e-02 9.7524e-04 8.7958e-03 -6.0000e+00 1.9219e-02 1.9065e-03 5.1168e-04 2.5482e-03 -6.0000e+00 8.2312e-03 1.2639e-02 1.2656e-06 2.6203e-05 2.5979e-05 -6.0000e+00 5.4254e-04 -1.6148e-02 -2.0219e-05 12 1 1 12 1 1 40.03 17.96 0.25 -0.01615 -0.01614 155 357 2 8 0 39.660 15.00 17.96 24.48 20.96 20.77 24.3 969.52 -5526 -4906 -6431 -6334 -8134 -7123 -7367 -4277 -3536 -4396 -8677 -7525 -5624 -3938 -280 -339 -323 -286 867 -129 1237 923 2088 -208 -206 390 -191 -976 -2250 -888 -65 -109 1263 109 -2328 -2626 -2921 -1479 -904 -167 -895 -835 -339 -359 -106 -271 -288 -304 -336 -233 1212 775 839 1036 1147 1044 1011 633 536 652 743 1169 1541 1987 718 107 -58 -715 217 511 230 526 163 240 78 -145 -209 -816 -193 -625 -967 -932 -1847 -1620 -1059 -740 -295 -206 320 390 531 428 214 505 377 194 305 763 135 -196 -208 -620 -662 -65 -617 -878 -734 -759 -293 100 345 280 96 74 83 165 141 236 92 66 -380 -154 287 180 566 456 325 1153 609 374 221 -46 -37 -30 -84 1 -211 241 -56 -247 -122 -368 -423 -256 -257 -363 -347 -399 -324 -355 -224 -208 -285 -589 -512 -429 -349 -28 -39 -40 -37 117 -18 180 133 302 -33 -35 69 -35 -171 -369 -141 -11 -21 261 24 -507 -543 -659 -380 -254 -56 -339 -333 -140 -152 -44 -115 -121 -126 -139 -97 528 370 426 561 651 606 604 381 316 378 439 741 981 1377 519 73 -37 -446 141 378 191 458 143 204 62 -103 -147 -546 -134 -456 -805 -870 -1744 -1593 -1109 -834 -324 -235 368 435 588 436 201 493 361 208 367 954 184 -267 -266 -734 -777 -76 -747 -1130 -985 -1077 -408 149 552 463 155 112 117 232 197 341 133 103 -608 -241 439 265 841 650 441 1543 889 553 350 -76 -63 -53 -147 1 -403 469 -104 -476 -226 -653 -728 SS 20240928T131515.3Z 9037.552260 210 1 27.20 2 68.68 115.10 28.20 146.79 0.00 1 0.00 1 0 17 1.657e-02 5.040e-03 1.147e-02 1.806e-03 3.288109e-01 9.022468e-04 3.988057e-03 -6.000000e+00 9.298623e-03 227.43 -2.00 3.55 -2.00 318.61 0.00e+00 3.832245e-04 1.861096e-04 1.033724e-04 -6.000000e+00 4.119011e-04 283.68 -2.00 20.00 -2.00 317.87 0.00e+00 2.724 0.000 302.00 328.00 3 3.2660e+00 2.4583e-03 3.1711e-02 -6.0000e+00 2.3092e-02 3.4723e-03 2.8073e-03 1.7328e-02 -6.0000e+00 2.5074e-02 -1.5565e-03 1.8949e-03 8.5354e-03 -6.0000e+00 1.4948e-02 -4.9616e-03 9.9439e-04 2.4416e-03 -6.0000e+00 6.4019e-03 9.5870e-04 -1.8228e-04 5.0731e-05 2.5833e-05 -6.0000e+00 4.2201e-04 -1.6258e-02 -4.0446e-05 10 0 0 10 0 0 95.52 17.95 0.32 -0.01626 -0.01763 79 79 2 8 0 344.200 15.00 17.95 25.10 20.96 20.77 24.6 974.73 -2992 -4471 -6452 -6692 -6044 -4718 -3379 -1776 1701 -2687 -7036 -5001 -3249 -1976 -2495 -158 2514 752 -492 1144 4 -858 -948 213 -557 10 -277 -1151 -1209 -1000 703 220 2496 -185 -1076 -3680 -1526 -1515 105 -275 -939 -748 -503 -675 -403 -221 -517 -692 -933 -143 704 554 1036 1283 605 793 1090 676 613 195 955 927 1510 1465 803 -348 92 -464 565 426 459 246 192 473 378 191 -200 -280 -583 -453 -989 -553 -1964 -1701 -1208 -671 -285 -136 528 211 595 426 331 232 568 146 617 732 300 -131 -99 -629 -627 -51 -624 -857 -882 -647 -457 -34 278 161 40 128 42 -80 65 295 93 119 -207 -158 275 98 808 284 395 904 648 380 378 8 -59 -77 -94 116 -303 300 -200 -210 -155 -424 -209 -136 -235 -367 -371 -293 -211 -158 -91 96 -173 -473 -333 -242 -171 -253 -18 297 95 -66 158 1 -124 -139 33 -93 2 -50 -198 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