File name: Pandora89s1_PaloDuroTX_20250722_L2Fit_fout2c2d20241101p1-8.txt File generation date: 20250723T065856.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Kevin Mishoe Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 89 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora89_OF_v3d20240314.txt Instrument calibration file used: Pandora89s1_CF_v2d20241101.txt Level 1 file used: Pandora89s1_PaloDuroTX_20250722_L1_smca1c2d20241101p1-8.txt Full location name: Palo Duro, TX Short location name: PaloDuroTX Country of location: United States Location latitude [deg]: 34.8806 Location longitude [deg]: -101.6647 Location altitude [m]: 1056 Local noon date: 20250722 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: OOB session based clearance session 1 First and last pixel inside fitting window: 194 335 Nominal wavelengths inside fitting window [nm]: 305.1224 305.2633 305.4042 305.5451 305.6860 305.8269 305.9677 306.1085 306.2494 306.3902 306.5310 306.6718 306.8126 306.9533 307.0941 307.2349 307.3756 307.5163 307.6570 307.7977 307.9384 308.0791 308.2198 308.3604 308.5011 308.6417 308.7823 308.9230 309.0636 309.2041 309.3447 309.4853 309.6258 309.7664 309.9069 310.0474 310.1879 310.3284 310.4689 310.6094 310.7499 310.8903 311.0307 311.1712 311.3116 311.4520 311.5924 311.7328 311.8731 312.0135 312.1538 312.2942 312.4345 312.5748 312.7151 312.8554 312.9957 313.1359 313.2762 313.4164 313.5566 313.6969 313.8371 313.9773 314.1174 314.2576 314.3978 314.5379 314.6781 314.8182 314.9583 315.0984 315.2385 315.3786 315.5186 315.6587 315.7987 315.9388 316.0788 316.2188 316.3588 316.4988 316.6387 316.7787 316.9186 317.0586 317.1985 317.3384 317.4783 317.6182 317.7581 317.8979 318.0378 318.1776 318.3175 318.4573 318.5971 318.7369 318.8767 319.0164 319.1562 319.2959 319.4357 319.5754 319.7151 319.8548 319.9945 320.1342 320.2738 320.4135 320.5531 320.6928 320.8324 320.9720 321.1116 321.2512 321.3907 321.5303 321.6698 321.8094 321.9489 322.0884 322.2279 322.3674 322.5068 322.6463 322.7857 322.9252 323.0646 323.2040 323.3434 323.4828 323.6222 323.7616 323.9009 324.0403 324.1796 324.3189 324.4582 324.5975 324.7368 324.8761 --------------------------------------------------------------------------------------- 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 20250722T131139.4Z 9334.549762 151 1 17.09 2 74.99 75.65 46.33 82.50 0.00 1 0.00 1 0 17 3.216e-01 1.264e-02 1.566e-01 7.630e-03 4.797980e-01 4.017484e-03 5.431630e-03 -6.000000e+00 1.867959e-01 231.27 -2.00 3.36 -2.00 320.03 0.00e+00 1.020504e-03 1.322672e-03 1.430440e-03 -6.000000e+00 8.585286e-03 287.32 -2.00 20.00 -2.00 319.30 0.00e+00 3.787 0.001 302.00 328.00 3 4.4387e+00 1.1924e-02 4.1964e-02 -6.0000e+00 4.6748e-01 5.8189e-03 1.4469e-02 2.5731e-02 -6.0000e+00 5.0700e-01 -5.0738e-02 1.2192e-02 1.2363e-02 -6.0000e+00 3.0110e-01 2.3935e-02 6.2950e-03 3.3226e-03 -6.0000e+00 1.2855e-01 1.2417e-04 -1.0058e-03 2.2000e-04 4.1249e-05 -6.0000e+00 8.6705e-03 6.9789e-02 0.0000e+00 12 9 9 12 9 1 77.47 26.45 0.67 0.06979 0.06223 4 2 1 5 0 3417.450 34.00 19.97 26.45 30.54 5.9 985.85 900000 -82717 -74480 -20752 900000 -17273 -65157 -39486 -20501 -83222 315125 33166 -10754 38954 410 -17260 -4676 900000 -30921 -15798 -687 4368 12324 -13479 53020 21232 21597 -21095 691 13940 -16099 -4381 2290 -6141 -8467 22832 -16235 9500 -2495 -1177 5664 -1318 -5896 10638 4982 14061 4445 1075 712 -3163 -2180 -1932 -2039 3023 5177 777 -1689 -491 136 3753 479 -3202 6956 488 835 2151 -2959 2133 -1563 1103 2646 4701 -250 1552 -2006 -1063 91 -4975 -508 -1387 -1276 -2509 379 -2282 1852 2435 858 -2815 635 -550 -127 -2638 -1092 -1598 -42 -216 1305 187 452 659 -644 -1500 -984 -775 -1686 211 -209 113 1570 934 581 898 -4 -1714 194 -1284 -252 -225 534 -185 690 1403 809 -12 777 -634 -268 -71 78 140 -799 -803 -377 245 477 -64 745 413 310 -403 -827 -436 900000 -2125 -1712 -253 900000 -210 -1454 -774 -396 -2813 2343 493 -304 811 15 -809 -209 900000 -2023 -916 -34 214 605 -922 1971 1105 1076 -1537 42 829 -1484 -407 213 -594 -818 1766 -2185 1208 -429 -224 1074 -280 -1342 2065 1037 2687 942 240 166 -833 -627 -601 -684 1016 1763 285 -635 -178 48 1323 189 -1467 3181 247 401 977 -1419 1050 -917 635 1576 2739 -146 907 -1090 -524 43 -2686 -304 -968 -913 -1981 307 -2030 1697 2339 865 -2959 623 -508 -108 -2152 -872 -1393 -40 -240 1618 234 560 835 -753 -1629 -1076 -918 -2136 275 -266 153 2310 1504 979 1489 -6 -2582 272 -1818 -369 -351 875 -308 1108 2170 1212 -17 1065 -919 -360 -104 126 245 -1488 -1427 -701 483 990 -137 1610 900 653 -813 -1594 -810 SS 20250722T132143.5Z 9334.556753 154 1 54.16 2 72.99 76.95 44.34 83.64 0.00 1 0.00 1 0 17 4.439e-02 7.529e-03 3.328e-03 4.937e-04 4.369238e-01 2.512510e-04 4.842520e-03 -6.000000e+00 2.558022e-02 231.27 -2.00 3.36 -2.00 318.47 0.00e+00 1.143746e-03 5.155155e-05 3.837399e-04 -6.000000e+00 1.143245e-03 287.32 -2.00 20.00 -2.00 317.66 0.00e+00 3.367 0.001 302.00 328.00 3 1.4051e+00 6.8653e-04 3.7045e-02 -6.0000e+00 6.3998e-02 -1.5442e-02 7.8339e-04 2.1758e-02 -6.0000e+00 6.9263e-02 -3.1978e-02 5.3077e-04 1.0647e-02 -6.0000e+00 4.1244e-02 1.5991e-02 2.7856e-04 3.1465e-03 -6.0000e+00 1.7614e-02 3.9414e-03 6.2859e-04 1.3538e-05 3.0970e-05 -6.0000e+00 1.1943e-03 6.1037e-02 0.0000e+00 11 8 0 10 0 0 68.85 26.41 0.40 0.06104 0.06576 412 44 1 5 0 131.440 34.00 20.00 26.41 31.02 6.0 991.22 -11001 -10200 -11007 -17183 -22368 -17315 -17249 -13054 -12530 -14112 -13131 -8840 -2261 -1113 247 285 1395 2854 1753 1383 674 1655 1221 1075 782 341 -1034 -2574 -887 540 376 1625 -277 -3463 -3123 -2368 -2239 -641 182 4 116 320 126 1149 376 419 -66 -917 -101 450 554 942 992 639 1197 453 180 -34 -369 852 1225 2153 2298 680 116 -647 -1214 304 281 563 955 621 755 86 -711 -1581 -2486 -1785 -1767 -1266 -1133 -1977 -1208 -658 122 666 1068 1433 1246 852 159 -541 -726 -759 -538 399 948 477 -95 -471 -1222 -1164 -575 -1149 -991 -733 -440 260 839 1023 629 474 39 -592 -492 -404 -131 158 254 181 711 748 406 489 -355 -283 440 9 -10 -149 -284 -228 0 -15 143 472 753 382 -43 -244 -756 -890 -471 -459 -482 -723 -956 -753 -849 -697 -717 -837 -822 -626 -182 -106 27 31 159 342 223 182 89 224 179 169 130 58 -170 -408 -141 95 75 360 -61 -815 -716 -541 -600 -206 64 2 45 129 52 471 157 175 -28 -394 -45 213 269 491 554 353 678 266 106 -20 -211 495 769 1401 1640 479 83 -441 -831 221 221 462 819 534 621 69 -520 -1129 -1741 -1332 -1438 -1116 -1066 -1937 -1237 -685 135 741 1224 1643 1381 921 167 -534 -710 -803 -586 467 1198 628 -125 -607 -1508 -1386 -693 -1451 -1270 -983 -599 361 1220 1550 991 734 59 -875 -687 -563 -191 235 387 279 1101 1125 611 700 -511 -388 607 13 -16 -240 -461 -382 1 -26 264 862 1401 716 -79 -437 -1342 -1535 SS 20250722T132812.4Z 9334.561254 158 1 54.17 2 71.69 77.79 43.06 84.38 0.00 1 0.00 1 0 17 2.932e-02 7.462e-03 1.561e-03 3.163e-04 4.080383e-01 1.608071e-04 4.539208e-03 -6.000000e+00 1.689691e-02 231.27 -2.00 3.36 -2.00 318.07 0.00e+00 1.083011e-03 2.895460e-05 2.451423e-04 -6.000000e+00 7.552310e-04 287.32 -2.00 20.00 -2.00 317.24 0.00e+00 3.143 0.000 302.00 328.00 3 7.6677e-01 4.3463e-04 3.4559e-02 -6.0000e+00 4.2274e-02 -1.6748e-02 4.9182e-04 2.0254e-02 -6.0000e+00 4.5752e-02 -2.4211e-02 3.1433e-04 9.8446e-03 -6.0000e+00 2.7244e-02 1.2672e-02 1.6222e-04 2.8809e-03 -6.0000e+00 1.1634e-02 9.3524e-03 5.9221e-04 8.7133e-06 2.8724e-05 -6.0000e+00 7.8894e-04 6.1506e-02 0.0000e+00 11 9 0 11 8 0 54.65 26.40 0.39 0.06151 0.06596 855 92 1 5 0 63.350 34.00 20.00 26.40 31.65 6.0 996.80 -6174 -6396 -7887 -11409 -13912 -12459 -9040 -8456 -7245 -9807 -8065 -6007 -1953 78 1244 1414 1424 2103 2321 1663 1342 1834 1720 1429 1163 235 -711 -1720 -512 319 1152 1504 -737 -2787 -3250 -2626 -2055 -624 -80 -136 42 73 19 892 262 237 -296 -1004 -377 484 437 945 919 705 1113 619 134 -200 -361 623 1217 1875 2253 584 72 -753 -1128 295 256 582 1016 765 848 112 -577 -1401 -2340 -1675 -1701 -1255 -1112 -1925 -1277 -653 15 567 1060 1469 1166 816 114 -466 -659 -674 -477 381 972 408 -93 -502 -1220 -1092 -534 -1154 -957 -765 -559 244 842 1003 685 530 33 -574 -509 -484 -104 151 199 159 626 733 344 486 -288 -255 409 135 42 -115 -219 -240 -25 -11 163 445 712 369 0 -249 -814 -881 -378 -414 -499 -673 -810 -762 -604 -634 -577 -814 -695 -594 -203 9 171 210 226 352 406 301 243 341 315 280 240 50 -145 -336 -100 68 276 402 -197 -781 -893 -724 -661 -223 -31 -60 20 33 9 412 123 111 -139 -478 -183 252 234 541 564 428 694 398 87 -127 -226 399 796 1348 1676 452 53 -556 -830 219 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