File name: Pandora25s1_HoustonTX_20220823_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20250922T154558.3Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 Local principal investigator: Jimmy Flynn Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 25 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora25_OF_v7d20190903.txt Instrument calibration file used: Pandora25s1_CF_v6d20220503.txt Level 1 file used: Pandora25s1_HoustonTX_20220823_L1_smca1c6d20220503p1-8.txt Full location name: University Of Houston Short location name: HoustonTX Country of location: United States Location latitude [deg]: 29.7200 Location longitude [deg]: -95.3400 Location altitude [m]: 19 Local noon date: 20220823 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: Update session 4 for SO2 First and last pixel inside fitting window: 281 423 Nominal wavelengths inside fitting window [nm]: 305.1116 305.2524 305.3931 305.5338 305.6745 305.8152 305.9558 306.0965 306.2371 306.3777 306.5183 306.6589 306.7995 306.9401 307.0806 307.2212 307.3617 307.5022 307.6427 307.7832 307.9236 308.0641 308.2045 308.3449 308.4853 308.6257 308.7661 308.9065 309.0468 309.1872 309.3275 309.4678 309.6081 309.7484 309.8886 310.0289 310.1691 310.3093 310.4495 310.5897 310.7299 310.8701 311.0102 311.1504 311.2905 311.4306 311.5707 311.7108 311.8509 311.9909 312.1310 312.2710 312.4110 312.5510 312.6910 312.8310 312.9709 313.1109 313.2508 313.3907 313.5306 313.6705 313.8104 313.9503 314.0901 314.2300 314.3698 314.5096 314.6494 314.7892 314.9290 315.0687 315.2085 315.3482 315.4879 315.6276 315.7673 315.9070 316.0466 316.1863 316.3259 316.4656 316.6052 316.7448 316.8843 317.0239 317.1635 317.3030 317.4425 317.5821 317.7216 317.8611 318.0005 318.1400 318.2794 318.4189 318.5583 318.6977 318.8371 318.9765 319.1159 319.2552 319.3946 319.5339 319.6732 319.8125 319.9518 320.0911 320.2304 320.3696 320.5089 320.6481 320.7873 320.9265 321.0657 321.2049 321.3441 321.4832 321.6223 321.7615 321.9006 322.0397 322.1788 322.3178 322.4569 322.5960 322.7350 322.8740 323.0130 323.1520 323.2910 323.4300 323.5689 323.7079 323.8468 323.9857 324.1246 324.2635 324.4024 324.5413 324.6801 324.8190 324.9578 --------------------------------------------------------------------------------------- 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 20220823T132221.3Z 8270.557191 179 1 49.66 2 71.83 87.10 29.86 87.94 0.00 1 0.00 1 0 25 4.218e-01 5.052e-02 2.872e-02 2.726e-03 3.595553e-01 1.370101e-03 4.470360e-03 -6.000000e+00 2.424461e-01 229.24 -2.00 3.24 -2.00 318.84 0.00e+00 1.994922e-02 3.157367e-04 1.995790e-03 -6.000000e+00 1.119289e-02 294.37 -2.00 20.00 -2.00 317.93 0.00e+00 3.164 0.000 302.00 328.00 3 4.5379e+00 3.8357e-03 3.5935e-02 -6.0000e+00 6.0198e-01 1.7573e-01 4.4159e-03 2.0016e-02 -6.0000e+00 6.5186e-01 -3.6258e-01 2.6685e-03 1.3074e-02 -6.0000e+00 3.9062e-01 2.0232e-01 1.3617e-03 1.3180e-02 -6.0000e+00 1.6723e-01 1.4997e-04 -2.2812e-04 7.7766e-05 1.6225e-04 -6.0000e+00 1.1491e-02 -3.4209e-03 9.1959e-05 12 8 8 10 0 0 96.48 24.65 0.41 -0.00342 -0.00514 22 5 1 5 0 2256.880 27.15 20.01 24.65 32.96 26.7 994.29 -120699 161228 107934 165086 108381 84528 168663 73336 173874 23122 46992 74317 43508 72455 65075 78758 73078 87617 66367 82553 70304 63061 45636 40549 24344 26451 13977 20521 25055 14384 53343 44061 42633 32764 24467 30758 33917 32486 15243 6081 1513 6799 9119 10209 12005 17969 11280 13258 16364 11079 11685 8827 8270 6169 4039 710 -1640 -8752 -3171 -2897 1211 1675 3416 3398 2315 2821 1602 259 852 -2406 -2738 -2633 -4739 -4796 -3544 -3714 -7465 -4094 -2961 -2209 -3240 -3959 -5407 -2615 -4767 -5279 -3324 -3563 -2494 -1676 -1497 -2379 -3084 -3407 -3312 -1648 -1280 -324 321 -502 418 -1884 -1025 -1541 215 -195 21 -356 2241 1752 1528 1292 1021 190 -280 500 1070 1157 1602 1894 2018 2990 3196 2236 2708 2714 1975 2974 1789 2496 1849 1062 -50 838 -912 -978 -1044 -830 -1777 -1725 -1212 -2616 -2572 -39834 4325 4782 3917 3800 3373 2971 3134 2912 1513 2384 3225 3105 4887 5604 6665 6957 7675 7314 7960 7431 6773 5533 4962 3358 3541 2066 2792 3304 2266 6665 6713 7151 5998 4480 5227 6004 6540 4064 1934 528 2356 3234 3696 4398 6391 4286 4958 5957 4314 4785 3929 3862 3026 2027 364 -852 -4758 -1629 -1515 648 974 2138 2262 1553 1784 978 159 557 -1778 -2153 -2114 -3816 -3711 -2544 -2456 -4784 -2545 -1974 -1642 -2686 -3570 -5168 -2540 -4947 -5773 -3719 -4087 -2843 -1846 -1559 -2340 -2898 -3210 -3330 -1794 -1526 -416 429 -667 526 -2266 -1178 -1821 265 -251 28 -497 3223 2673 2437 2091 1625 292 -409 705 1512 1694 2452 3005 3226 4693 4914 3366 3935 3820 2716 4121 2642 3881 3007 1776 -85 1468 -1677 -1854 -2006 -1614 -3478 -3312 -2254 -4772 -4609 SS 20220823T132848.2Z 8270.561669 183 1 9.05 2 70.44 87.88 28.49 88.65 0.00 1 0.00 1 0 17 1.860e-02 5.051e-03 8.881e-03 1.736e-03 3.649865e-01 8.799518e-04 3.995979e-03 -6.000000e+00 1.069074e-02 229.24 -2.00 3.24 -2.00 318.06 0.00e+00 2.983802e-04 1.635106e-04 1.138651e-04 -6.000000e+00 4.937388e-04 294.37 -2.00 20.00 -2.00 317.11 0.00e+00 2.952 0.000 302.00 328.00 3 2.4268e+00 2.3777e-03 3.4211e-02 -6.0000e+00 2.6544e-02 6.4639e-03 2.7116e-03 1.7584e-02 -6.0000e+00 2.8746e-02 -6.8811e-04 1.7171e-03 8.5012e-03 -6.0000e+00 1.7226e-02 -2.0643e-03 8.8655e-04 2.3344e-03 -6.0000e+00 7.3726e-03 1.6050e-03 -2.2997e-04 4.9474e-05 2.5771e-05 -6.0000e+00 5.0693e-04 -2.8087e-03 3.8464e-05 12 1 1 12 1 1 94.47 24.66 0.34 -0.00281 -0.00454 25 31 1 5 0 341.350 27.15 20.00 24.66 33.21 26.9 995.96 2020 -3669 -1238 -7166 -5359 -8079 -4148 -4631 -577 -5733 -8789 1812 -6377 327 -2598 -3762 -1286 2643 -1617 2418 -474 994 -322 -1014 470 677 958 -2235 1451 -1540 2240 1301 2788 -2081 -1861 -1778 -1034 84 -1296 -303 -669 -21 -579 -295 -628 290 -841 -311 -261 -103 686 328 1347 806 743 680 1226 268 891 -5 1017 813 1744 1492 593 -125 -163 -182 484 487 393 509 140 273 -224 74 -569 -647 -203 -902 -1069 -1206 -1591 -1244 -528 -790 -297 -181 487 181 581 -46 97 465 248 325 28 499 242 -157 -564 -670 -404 -145 -332 -735 -645 -517 -27 319 465 345 356 36 13 30 19 32 19 -53 -459 -171 237 295 477 346 621 743 308 680 180 117 -211 126 -79 -40 -121 124 35 -305 -217 -390 -343 113 -237 -79 -449 -300 -466 -253 -325 -43 -472 -754 152 -631 36 -342 -555 -197 413 -277 415 -85 176 -61 -192 93 139 194 -440 284 -321 463 302 701 -555 -467 -452 -293 26 -497 -125 -302 -10 -283 -145 -311 143 -415 -152 -128 -52 351 183 794 479 458 431 788 172 558 -3 663 549 1283 1119 445 -93 -116 -130 376 409 341 457 125 231 -185 58 -409 -458 -155 -756 -969 -1159 -1642 -1290 -584 -897 -352 -212 564 210 646 -47 98 463 257 361 33 639 328 -209 -705 -798 -475 -176 -421 -948 -873 -709 -39 481 720 545 545 54 18 40 26 46 28 -80 -702 -265 356 424 676 487 835 1018 443 1019 277 187 -336 211 -136 -70 -218 227 65 -545 -384 -662 -587 SS 20220823T133802.0Z 8270.568079 189 1 49.22 2 68.43 89.00 26.53 89.72 0.00 1 0.00 1 0 17 7.294e-02 9.417e-03 1.204e-02 2.142e-03 3.352423e-01 1.083846e-03 3.665079e-03 -6.000000e+00 4.192581e-02 229.24 -2.00 3.24 -2.00 318.36 0.00e+00 6.248849e-04 2.167643e-04 9.181089e-05 -6.000000e+00 1.935295e-03 294.37 -2.00 20.00 -2.00 317.41 0.00e+00 2.695 0.000 302.00 328.00 3 4.5668e+00 2.9564e-03 3.1294e-02 -6.0000e+00 1.0410e-01 1.2528e-02 3.3941e-03 1.6185e-02 -6.0000e+00 1.1272e-01 1.7599e-03 2.1737e-03 7.8370e-03 -6.0000e+00 6.7548e-02 -1.9805e-03 1.1221e-03 2.2368e-03 -6.0000e+00 2.8921e-02 2.5010e-04 1.1064e-04 6.2140e-05 2.4248e-05 -6.0000e+00 1.9868e-03 -3.3642e-03 1.1998e-04 12 8 8 10 0 0 99.90 24.66 0.21 -0.00336 -0.00253 52 11 1 5 0 946.330 27.15 20.00 24.66 33.47 26.7 996.90 -67264 14070 -5270 6336 -4805 -1822 23118 -7060 24729 -16131 -11917 13344 -10238 -1168 -3196 6170 -411 7896 -1291 6538 4249 1561 773 1306 -15 1910 1026 -2024 871 -8265 8986 4664 3657 863 -2057 4647 972 7849 -1617 -1062 -2560 407 839 32 229 1652 -2431 -1528 1592 -1098 1351 -727 872 1083 784 480 1960 -1282 766 -554 1298 420 752 1516 -106 264 -701 -361 804 667 -107 639 -157 181 1205 879 -1929 -775 -229 -545 -927 -1286 -2473 147 -828 -1539 -213 -264 283 395 675 530 563 -100 -73 458 -190 737 143 -283 73 -1294 -889 -545 211 -669 -466 -859 726 241 402 359 384 25 -304 219 115 -212 -8 -207 -326 190 69 329 356 671 182 999 163 688 545 -191 -118 580 -89 15 -142 59 -266 -175 -107 -777 -210 -6864 740 -335 337 -259 -95 1048 -474 1367 -1344 -959 916 -1005 -122 -391 757 -57 1060 -197 964 647 244 127 227 -3 360 193 -370 149 -1572 1592 942 809 197 -457 983 236 2093 -554 -411 -1078 174 367 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