File name: Pandora21s1_Bremen_20220502_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T104536.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Tom Hanisco Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 21 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora21_OF_v4d20190904.txt Instrument calibration file used: Pandora21s1_CF_v1d20201116.txt Level 1 file used: Pandora21s1_Bremen_20220502_L1_smca1c1d20201116p1-8.txt Full location name: Bremen University Short location name: Bremen Country of location: Germany Location latitude [deg]: 53.0813 Location longitude [deg]: 8.8126 Location altitude [m]: 50 Local noon date: 20220502 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: None First and last pixel inside fitting window: 286 428 Nominal wavelengths inside fitting window [nm]: 305.0633 305.2039 305.3445 305.4851 305.6257 305.7662 305.9068 306.0473 306.1878 306.3283 306.4688 306.6093 306.7497 306.8902 307.0306 307.1711 307.3115 307.4519 307.5923 307.7326 307.8730 308.0134 308.1537 308.2940 308.4343 308.5747 308.7149 308.8552 308.9955 309.1357 309.2760 309.4162 309.5564 309.6966 309.8368 309.9770 310.1172 310.2573 310.3975 310.5376 310.6777 310.8178 310.9579 311.0980 311.2380 311.3781 311.5181 311.6582 311.7982 311.9382 312.0782 312.2182 312.3581 312.4981 312.6380 312.7779 312.9179 313.0578 313.1976 313.3375 313.4774 313.6172 313.7571 313.8969 314.0367 314.1765 314.3163 314.4561 314.5959 314.7356 314.8754 315.0151 315.1548 315.2945 315.4342 315.5739 315.7135 315.8532 315.9928 316.1325 316.2721 316.4117 316.5513 316.6908 316.8304 316.9700 317.1095 317.2490 317.3885 317.5280 317.6675 317.8070 317.9465 318.0859 318.2254 318.3648 318.5042 318.6436 318.7830 318.9224 319.0617 319.2011 319.3404 319.4798 319.6191 319.7584 319.8977 320.0369 320.1762 320.3155 320.4547 320.5939 320.7331 320.8723 321.0115 321.1507 321.2899 321.4290 321.5682 321.7073 321.8464 321.9855 322.1246 322.2637 322.4028 322.5418 322.6808 322.8199 322.9589 323.0979 323.2369 323.3759 323.5148 323.6538 323.7927 323.9317 324.0706 324.2095 324.3484 324.4872 324.6261 324.7650 324.9038 --------------------------------------------------------------------------------------- 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 20220502T062636.5Z 8157.268478 142 1 1.83 2 68.05 93.44 74.75 77.71 0.00 1 0.00 1 0 17 9.961e-02 1.066e-02 7.619e-02 9.157e-03 4.197765e-01 4.807614e-03 5.495660e-03 -6.000000e+00 5.984882e-02 229.56 -2.00 3.88 -2.00 318.40 0.00e+00 1.702194e-03 8.659748e-04 1.580769e-04 -6.000000e+00 2.386189e-03 274.40 -2.00 20.00 -2.00 318.11 0.00e+00 2.652 0.000 302.00 328.00 3 3.0060e+00 1.2918e-02 3.6001e-02 -6.0000e+00 1.5036e-01 4.2583e-02 1.4484e-02 2.4032e-02 -6.0000e+00 1.6307e-01 -1.5838e-02 1.0209e-02 1.2014e-02 -6.0000e+00 9.5734e-02 -3.2723e-03 5.4164e-03 3.4798e-03 -6.0000e+00 3.9679e-02 1.0765e-03 -5.3122e-04 2.7838e-04 4.1113e-05 -6.0000e+00 2.9902e-03 -1.9299e-02 2.5319e-05 12 9 9 12 1 1 999.00 22.25 0.20 -0.01930 -0.02329 1 12 2 5 0 823.812 25.28 20.00 22.25 16.90 28.8 1022.58 57781 -33974 50964 -7629 -13868 -40311 35488 -4220 -22641 -6533 -31341 2990 -11858 10231 -11800 13314 7468 -6847 1268 -9181 10409 -8293 6420 -1785 14154 -4184 366 -2305 8956 7523 -6626 1602 -3441 -5117 -1491 7245 -269 2808 2928 -3953 -1629 -3833 1520 -1734 4130 -4715 3466 -157 6022 2018 -309 2113 -1521 1472 -1063 -3 2976 -100 999 1310 2188 104 1848 -372 1170 -1926 538 -360 255 522 243 -1218 55 1129 -23 -160 549 1390 -739 425 669 -2249 -2323 -814 -434 -83 -1574 -1827 -124 599 412 441 -618 2160 831 1237 -387 -133 -123 -472 -616 662 1290 -153 -177 -887 -1618 -845 1291 916 -475 -541 -582 304 -201 943 114 174 577 261 -128 18 -161 -110 728 -882 1137 -297 982 150 693 -22 497 -38 -147 794 -398 176 -885 -79 -154 -1231 667 1228 -1839 1367 -338 -610 -2176 1018 -190 -1331 -355 -2205 165 -854 715 -1178 1205 777 -864 158 -1306 1282 -1217 847 -267 1949 -707 60 -379 1299 1118 -1201 300 -740 -1173 -327 1460 -61 706 858 -1402 -623 -1576 621 -742 1703 -2099 1455 -68 2502 885 -145 1036 -813 808 -616 -2 1750 -60 592 770 1298 66 1235 -267 856 -1413 376 -250 184 405 202 -1064 48 956 -18 -123 394 964 -536 331 569 -2104 -2301 -832 -460 -91 -1814 -2159 -146 691 459 468 -631 2128 851 1349 -459 -169 -164 -639 -814 827 1535 -182 -218 -1140 -2153 -1155 1806 1343 -732 -858 -922 468 -299 1345 161 250 852 399 -200 27 -246 -164 1058 -1261 1567 -410 1393 225 1082 -36 818 -65 -255 1419 -732 326 -1660 -146 -279 -2193 1153 SS 20220502T080215.8Z 8157.334905 202 1 49.67 2 54.16 114.57 60.64 95.81 0.00 1 0.00 1 0 25 8.892e-03 4.999e-03 5.958e-03 1.631e-03 2.752330e-01 8.530955e-04 3.679979e-03 -6.000000e+00 5.342521e-03 229.56 -2.00 3.88 -2.00 317.57 0.00e+00 1.009426e-04 1.197174e-04 7.189513e-05 -6.000000e+00 2.130076e-04 274.40 -2.00 20.00 -2.00 317.26 0.00e+00 1.703 0.000 302.00 328.00 3 4.8618e+00 2.2597e-03 2.3378e-02 -6.0000e+00 1.3422e-02 4.0210e-02 2.5198e-03 1.5780e-02 -6.0000e+00 1.4557e-02 -2.5815e-03 1.5655e-03 7.8365e-03 -6.0000e+00 8.5461e-03 -3.1255e-03 7.8141e-04 2.2403e-03 -6.0000e+00 3.5418e-03 5.2113e-04 -1.8515e-04 5.0930e-05 2.8001e-05 -6.0000e+00 2.6693e-04 -1.8226e-02 5.8823e-05 10 0 0 10 0 0 99.97 22.25 0.26 -0.01823 -0.01962 39 8 1 5 0 1273.231 25.28 20.00 22.25 20.66 29.2 1042.02 -1534 -2187 -2534 -3399 -849 -1378 2467 1780 -1577 -1445 -2384 2655 -1243 -778 -1830 219 -711 1706 527 112 629 -173 -93 286 136 -564 808 359 105 901 984 1007 -163 -275 -1110 -711 -786 -693 -399 -772 -1002 -1194 -267 -1262 -724 -913 -217 -255 -823 -40 895 890 886 682 458 965 617 966 695 713 1103 1060 1274 602 316 -348 -193 494 1000 177 170 94 -60 12 -405 -69 27 511 205 -344 -348 -1010 -1607 -1215 -744 -993 -236 -313 23 2 236 548 581 864 651 757 569 557 27 -472 -205 -440 36 140 -605 -656 -612 -445 -210 34 -23 -95 -278 -151 35 485 361 377 31 -211 -366 -269 -100 -28 566 355 784 1030 897 465 331 45 175 282 85 -92 35 265 -486 -276 -389 -328 -258 -137 -216 -259 -337 -76 -118 211 170 -171 -166 -281 308 -164 -116 -314 41 -141 344 112 25 141 -39 -21 69 35 -150 212 91 25 211 239 264 -46 -81 -320 -201 -235 -236 -159 -354 -506 -636 -145 -703 -402 -507 -119 -137 -438 -21 488 514 540 436 303 651 425 664 473 483 757 766 982 492 262 -279 -146 360 751 146 152 88 -57 11 -358 -56 20 362 148 -270 -301 -955 -1626 -1281 -820 -1157 -286 -390 29 2 277 600 594 849 654 812 663 702 36 -638 -268 -544 43 164 -746 -851 -824 -619 -303 51 -36 -152 -441 -229 50 658 481 510 44 -313 -561 -413 -150 -41 800 484 1028 1329 1193 653 487 68 269 445 139 -157 61 470 -873 -491 -678 -557 -428 SS 20220502T080702.5Z 8157.338223 205 1 8.00 2 53.51 115.75 59.94 96.77 0.00 1 0.00 1 0 25 1.085e-02 5.751e-03 9.140e-03 3.521e-03 2.696188e-01 1.853941e-03 3.618896e-03 -6.000000e+00 6.513555e-03 229.56 -2.00 3.88 -2.00 316.71 0.00e+00 2.106078e-04 2.110946e-04 5.510048e-05 -6.000000e+00 2.597655e-04 274.40 -2.00 20.00 -2.00 316.41 0.00e+00 1.677 0.000 302.00 328.00 3 4.8955e+00 4.8607e-03 2.2928e-02 -6.0000e+00 1.6364e-02 3.6337e-02 5.4030e-03 1.5406e-02 -6.0000e+00 1.7750e-02 9.8443e-04 3.1941e-03 7.6214e-03 -6.0000e+00 1.0420e-02 -3.3456e-03 1.5223e-03 2.1575e-03 -6.0000e+00 4.3170e-03 5.2168e-04 -5.8374e-04 1.0815e-04 2.8041e-05 -6.0000e+00 3.2562e-04 -1.8020e-02 -4.8138e-05 12 1 1 12 1 1 95.84 22.25 0.12 -0.01802 -0.02241 4 6 1 5 0 1563.793 25.28 20.00 22.25 21.01 29.2 1043.32 -1150 -3554 -2103 -2180 -1608 -2247 598 326 -5 5793 -4177 -819 -50 413 -1810 635 -2580 745 547 -2689 427 771 2135 223 609 809 -972 1531 -228 1322 55 815 -9 597 -102 -880 1766 -1338 -853 -768 -675 -1480 31 -1440 -194 -735 -531 -27 -194 753 890 1184 462 942 944 1231 412 55 546 354 1520 859 1298 553 -114 -1020 -187 35 1007 640 221 -228 -131 71 -244 -490 17 773 -61 289 -447 -1128 -1430 -988 -1116 -547 -467 -198 -561 66 -100 317 797 887 414 584 192 567 -459 -99 -704 -271 471 451 -427 -800 -437 -589 -271 229 -127 -59 -49 338 -99 334 753 -219 410 13 -794 -31 204 150 248 337 783 940 731 782 391 -502 548 291 -198 134 -72 -171 -323 -169 -145 -603 -366 -153 -527 -316 -315 -214 -288 77 47 -1 911 -727 -142 -9 87 -437 163 -719 209 159 -828 131 236 657 72 207 284 -346 516 -75 418 18 285 -3 229 -38 -328 676 -588 -428 -433 -410 -943 20 -951 -127 -483 -345 -17 -122 473 576 801 328 692 712 943 322 43 423 273 1181 698 1109 495 -103 -903 -157 29 841 574 212 -227 -131 70 -232 -438 14 614 -49 248 -417 -1131 -1509 -1078 -1265 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