File name: Pandora257s1_AustinTX_20240612_L2Fit_fout2c2d20230110p1-8.txt File generation date: 20240613T063933.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Paul Walter Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 257 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora257_OF_v3d20221216.txt Instrument calibration file used: Pandora257s1_CF_v2d20230110.txt Level 1 file used: Pandora257s1_AustinTX_20240612_L1_smca1c2d20230110p1-8.txt Full location name: St. Edward's University Short location name: AustinTX Country of location: United States Location latitude [deg]: 30.2285 Location longitude [deg]: -97.7544 Location altitude [m]: 205 Local noon date: 20240612 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 on clearance session 1 First and last pixel inside fitting window: 228 370 Nominal wavelengths inside fitting window [nm]: 305.0779 305.2183 305.3587 305.4991 305.6395 305.7799 305.9203 306.0607 306.2010 306.3413 306.4817 306.6220 306.7623 306.9026 307.0429 307.1832 307.3234 307.4637 307.6039 307.7442 307.8844 308.0246 308.1648 308.3050 308.4452 308.5854 308.7255 308.8657 309.0058 309.1459 309.2860 309.4261 309.5662 309.7063 309.8464 309.9865 310.1265 310.2665 310.4066 310.5466 310.6866 310.8266 310.9666 311.1065 311.2465 311.3865 311.5264 311.6663 311.8062 311.9461 312.0860 312.2259 312.3658 312.5057 312.6455 312.7854 312.9252 313.0650 313.2048 313.3446 313.4844 313.6242 313.7639 313.9037 314.0434 314.1832 314.3229 314.4626 314.6023 314.7420 314.8816 315.0213 315.1610 315.3006 315.4402 315.5799 315.7195 315.8591 315.9986 316.1382 316.2778 316.4173 316.5569 316.6964 316.8359 316.9754 317.1149 317.2544 317.3939 317.5334 317.6728 317.8123 317.9517 318.0911 318.2305 318.3699 318.5093 318.6487 318.7880 318.9274 319.0667 319.2061 319.3454 319.4847 319.6240 319.7633 319.9025 320.0418 320.1810 320.3203 320.4595 320.5987 320.7379 320.8771 321.0163 321.1555 321.2946 321.4338 321.5729 321.7121 321.8512 321.9903 322.1294 322.2685 322.4075 322.5466 322.6856 322.8247 322.9637 323.1027 323.2417 323.3807 323.5197 323.6587 323.7976 323.9366 324.0755 324.2144 324.3533 324.4922 324.6311 324.7700 324.9089 --------------------------------------------------------------------------------------- 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 20240612T135453.8Z 8929.579790 120 1 54.85 2 61.16 78.49 125.92 43.34 0.00 1 0.00 1 0 17 2.960e-02 9.266e-03 6.027e-03 1.848e-03 2.670573e-01 1.021785e-03 2.903668e-03 -6.000000e+00 1.902840e-02 230.97 -2.00 3.25 -2.00 317.34 0.00e+00 1.687033e-04 1.580974e-04 6.788461e-05 -6.000000e+00 8.821492e-04 291.28 -2.00 20.00 -2.00 316.45 0.00e+00 2.063 0.000 302.00 328.00 3 5.3080e+00 2.7177e-03 2.3934e-02 -6.0000e+00 4.7413e-02 -3.1672e-03 3.0534e-03 1.2891e-02 -6.0000e+00 5.1103e-02 2.2174e-02 1.7988e-03 6.2037e-03 -6.0000e+00 3.0540e-02 -1.2683e-02 8.5465e-04 1.7068e-03 -6.0000e+00 1.2647e-02 2.5290e-04 6.2917e-04 6.5939e-05 2.5113e-05 -6.0000e+00 1.0702e-03 2.5195e-02 1.2471e-05 11 9 0 11 8 0 99.83 28.06 0.40 0.02520 0.02992 23 2 1 5 0 2384.490 36.00 20.00 28.06 33.10 0.0 993.35 -4077 -9297 -5356 6464 -14334 -11408 -8928 -6455 -286 -4417 280 -5288 96 6579 2814 -2319 -173 6521 1947 2808 11290 -748 6760 1307 225 -3457 -2261 1291 -2725 -1686 1794 -1685 -3163 -1569 -5481 3646 -5852 -2030 -888 214 830 137 1328 -229 -1142 -1819 -1124 936 78 565 1851 3654 421 2264 -18 267 192 -118 1040 642 618 1090 3065 632 -1591 -1320 1573 376 461 693 -262 803 -611 573 -517 348 585 -2878 -975 -1044 -1693 -1489 -2922 -1415 -110 -559 175 495 661 226 -22 -258 423 494 763 1189 473 778 -339 -515 -537 -693 -236 214 398 -965 -1294 -83 -39 696 580 211 194 455 -149 -279 47 -284 -10 -123 -287 -775 749 1080 -336 674 325 328 1289 -344 -330 -23 125 66 -83 155 -196 283 775 -55 -523 -694 -632 -409 -1041 -577 595 -1555 -1199 -969 -745 -33 -564 35 -761 15 1053 520 -489 -38 1395 453 667 2515 -191 1656 354 64 -1039 -663 353 -753 -464 499 -516 -1031 -510 -1851 1159 -2047 -788 -396 107 447 78 771 -137 -688 -1097 -663 534 45 329 1114 2292 264 1459 -12 185 135 -83 723 453 453 844 2472 541 -1380 -1093 1213 294 381 574 -235 740 -570 509 -470 288 448 -2226 -773 -907 -1514 -1454 -3108 -1578 -120 -650 211 611 811 268 -24 -288 439 504 811 1370 561 998 -428 -692 -688 -841 -276 253 496 -1290 -1705 -114 -57 1050 853 315 300 660 -203 -389 65 -379 -14 -181 -435 -1176 1094 1512 -455 925 434 440 1790 -480 -482 -34 194 106 -133 257 -338 495 1355 -96 -884 -1140 -1023 SS 20240612T140017.8Z 8929.583540 123 1 53.50 2 60.01 79.04 125.15 44.58 0.00 1 0.00 1 0 17 4.746e-02 1.312e-02 9.568e-03 2.758e-03 2.524485e-01 1.516241e-03 2.732492e-03 -6.000000e+00 3.050574e-02 230.97 -2.00 3.25 -2.00 317.54 0.00e+00 3.491081e-04 2.497879e-04 6.158365e-05 -6.000000e+00 1.414548e-03 291.28 -2.00 20.00 -2.00 316.65 0.00e+00 1.992 0.000 302.00 328.00 3 5.9439e+00 4.0563e-03 2.2962e-02 -6.0000e+00 7.6011e-02 -5.7310e-03 4.5755e-03 1.2196e-02 -6.0000e+00 8.1931e-02 4.1781e-02 2.7037e-03 5.8706e-03 -6.0000e+00 4.8963e-02 -2.1864e-02 1.2869e-03 1.6432e-03 -6.0000e+00 2.0273e-02 1.4597e-04 7.5215e-04 9.9033e-05 2.3981e-05 -6.0000e+00 1.7161e-03 2.5463e-02 -2.2727e-05 12 9 8 11 8 0 99.91 28.07 0.44 0.02546 0.03112 21 2 1 5 0 2547.160 36.00 20.01 28.07 33.34 0.0 994.84 -6942 -8300 -7996 21792 -20860 -19617 -10123 -6618 3149 -6098 1008 -5457 1221 6983 7571 -4883 1510 8570 7842 8114 18410 -1388 11276 -1581 2307 -6144 -3949 2210 -4964 -3043 2664 -2767 -3885 668 -8205 7806 -9331 -3510 -374 1211 2603 1650 1502 -1644 -1570 -2748 -2965 2470 -305 652 3364 4028 298 3435 -400 -547 -275 -434 1311 1019 1124 539 4319 -40 -2969 -1491 2243 665 491 1705 -890 1413 -922 658 -425 1242 1202 -4213 -1481 -429 -1828 -1763 -3065 -1718 570 -474 -30 945 663 509 -470 -370 814 -6 948 1775 339 296 -1051 -376 -291 -1146 150 -68 271 -1089 -1376 471 -89 1632 708 5 10 889 -398 -295 -185 -487 66 -536 -77 -1235 814 2192 -1040 784 -122 191 1204 -720 -232 -195 -25 435 -100 60 -87 208 1196 568 -566 -918 -723 -684 -875 -841 1636 -2295 -2127 -1057 -726 337 -750 120 -743 172 1048 1255 -992 304 1681 1607 1709 3571 -334 2466 -411 600 -1767 -1095 557 -1305 -788 681 -793 -1178 196 -2622 2194 -3429 -1403 -168 550 1266 852 798 -912 -871 -1533 -1632 1268 -160 346 1816 2288 185 2165 -270 -379 -191 -303 897 707 810 415 3395 -34 -2566 -1212 1681 506 396 1478 -779 1253 -835 616 -376 992 891 -3213 -1146 -360 -1718 -1659 -3133 -1842 637 -567 -38 1198 839 621 -541 -394 804 -6 957 1932 412 389 -1345 -474 -378 -1420 177 -82 346 -1488 -1829 646 -130 2449 1112 8 15 1279 -541 -413 -258 -649 92 -793 -117 -1878 1184 3024 -1411 1081 -165 258 1680 -999 -335 -292 -39 691 -167 106 -147 356 2031 954 -1005 -1591 -1235 SS 20240612T163241.1Z 8929.689364 232 1 54.54 2 27.27 97.76 98.51 70.88 0.00 1 0.00 1 0 17 8.200e-03 6.432e-03 1.225e-03 8.898e-04 1.511575e-01 5.059484e-04 1.663404e-03 -6.000000e+00 5.271444e-03 230.97 -2.00 3.25 -2.00 314.65 0.00e+00 1.972259e-04 4.304278e-05 1.666585e-05 -6.000000e+00 2.444031e-04 291.29 -2.00 20.00 -2.00 313.96 0.00e+00 1.125 0.000 302.00 328.00 3 5.1717e+00 1.2988e-03 1.3165e-02 -6.0000e+00 1.3135e-02 1.9674e-02 1.4335e-03 7.1959e-03 -6.0000e+00 1.4157e-02 7.6402e-03 8.1857e-04 3.4808e-03 -6.0000e+00 8.4606e-03 -6.1092e-03 3.4496e-04 9.5839e-04 -6.0000e+00 3.5036e-03 8.7928e-04 4.3706e-04 3.1619e-05 1.6945e-05 -6.0000e+00 2.9649e-04 2.4795e-02 -9.3824e-06 11 8 0 10 0 0 99.99 28.46 0.40 0.02480 0.02808 72 7 1 5 0 757.440 36.25 20.00 28.46 31.82 0.0 984.45 -222 -1393 -2801 -1723 -2172 -453 326 908 487 -955 -1178 -477 -136 725 732 -443 53 508 976 1104 1955 452 1790 1022 750 -384 -298 -425 -342 1171 1802 294 623 -672 -2753 -1 -1369 -593 -73 -251 -866 -761 -353 -1040 -758 -749 -960 -326 -191 76 1157 1101 598 1384 183 480 942 354 616 728 904 1144 1545 808 -292 -930 145 -1 439 1031 -128 361 -166 247 -110 -160 11 -1195 -346 -459 -1398 -1317 -2073 -1495 -712 -641 -207 170 317 285 -187 243 202 292 594 555 299 602 86 -405 -389 -645 -399 136 208 -908 -902 -319 -151 521 549 194 74 168 -160 -17 198 128 339 296 -13 -202 539 619 153 596 309 753 948 142 -49 -116 -191 30 -57 77 -218 190 285 -256 -459 -412 -796 -80 -527 -1056 -607 -723 -158 118 320 183 -374 -469 -196 -59 343 345 -223 27 268 523 601 1068 253 1004 595 450 -234 -177 -241 -184 608 941 161 349 -380 -1568 0 -854 -388 -54 -196 -688 -630 -297 -884 -639 -620 -775 -270 -154 61 947 942 502 1193 163 433 851 321 555 661 848 1060 1496 804 -287 -918 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