File name: Pandora64s1_NewHavenCT_20240412_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240413T045946.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 64 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora64_OF_v3d20190516.txt Instrument calibration file used: Pandora64s1_CF_v4d20190911.txt Level 1 file used: Pandora64s1_NewHavenCT_20240412_L1_smca1c4d20190911p1-8.txt Full location name: New Haven - Criscuolo Park CTDEEP (USEPA AQS ID 34-017-0006) Short location name: NewHavenCT Country of location: USA Location latitude [deg]: 41.3014 Location longitude [deg]: -72.9029 Location altitude [m]: 4 Local noon date: 20240412 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: Mod WL cal slit func 9 First and last pixel inside fitting window: 249 390 Nominal wavelengths inside fitting window [nm]: 305.1279 305.2688 305.4097 305.5506 305.6915 305.8324 305.9732 306.1141 306.2549 306.3958 306.5366 306.6774 306.8182 306.9590 307.0997 307.2405 307.3812 307.5220 307.6627 307.8034 307.9441 308.0848 308.2255 308.3662 308.5068 308.6475 308.7881 308.9287 309.0693 309.2099 309.3505 309.4911 309.6316 309.7722 309.9127 310.0533 310.1938 310.3343 310.4748 310.6153 310.7557 310.8962 311.0366 311.1771 311.3175 311.4579 311.5983 311.7387 311.8791 312.0195 312.1598 312.3002 312.4405 312.5808 312.7211 312.8614 313.0017 313.1420 313.2822 313.4225 313.5627 313.7030 313.8432 313.9834 314.1236 314.2638 314.4039 314.5441 314.6842 314.8244 314.9645 315.1046 315.2447 315.3848 315.5249 315.6649 315.8050 315.9450 316.0851 316.2251 316.3651 316.5051 316.6451 316.7850 316.9250 317.0649 317.2049 317.3448 317.4847 317.6246 317.7645 317.9044 318.0442 318.1841 318.3239 318.4638 318.6036 318.7434 318.8832 319.0230 319.1628 319.3025 319.4423 319.5820 319.7217 319.8614 320.0011 320.1408 320.2805 320.4202 320.5598 320.6995 320.8391 320.9787 321.1183 321.2579 321.3975 321.5371 321.6766 321.8162 321.9557 322.0953 322.2348 322.3743 322.5138 322.6532 322.7927 322.9322 323.0716 323.2110 323.3504 323.4899 323.6292 323.7686 323.9080 324.0474 324.1867 324.3260 324.4654 324.6047 324.7440 324.8833 --------------------------------------------------------------------------------------- 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 20240412T191159.6Z 8868.799995 365 1 48.38 2 44.59 233.68 21.34 125.03 0.00 1 0.00 1 0 17 1.129e-02 7.950e-03 7.333e-04 3.620e-04 2.378254e-01 1.946531e-04 2.893121e-03 -6.000000e+00 6.845437e-03 228.41 -2.00 3.52 -2.00 316.10 0.00e+00 3.444579e-04 2.088106e-05 5.699902e-05 -6.000000e+00 2.976664e-04 279.91 -2.00 20.00 -2.00 315.48 0.00e+00 1.402 0.000 302.00 328.00 3 2.5641e+00 5.0406e-04 1.8778e-02 -6.0000e+00 1.7045e-02 1.6959e-02 5.6041e-04 1.2240e-02 -6.0000e+00 1.8424e-02 4.6525e-03 3.2375e-04 6.0271e-03 -6.0000e+00 1.0950e-02 -5.4062e-03 1.4904e-04 1.7010e-03 -6.0000e+00 4.6406e-03 7.3867e-03 6.0703e-05 1.1173e-05 2.2716e-05 -6.0000e+00 3.3563e-04 -7.2764e-03 4.9792e-05 11 8 0 10 0 0 99.99 21.56 0.16 -0.00728 -0.00682 560 135 1 5 0 86.390 26.00 20.00 21.56 18.05 38.2 1002.83 961 -916 507 -3190 -5160 -1509 -383 1085 1429 240 -3313 -1608 -28 -87 898 780 -819 933 332 1617 1027 -336 758 1010 487 1088 463 -812 -822 -119 1673 109 2335 -39 -4296 -2423 -1696 -1182 53 111 -1037 -1161 -399 -869 -443 103 -670 -101 -757 -356 1086 485 705 1410 253 796 1182 615 206 353 436 1282 1280 2263 716 -1319 -484 -1527 571 1663 386 450 -169 636 208 -751 -780 -1873 -555 -268 -1071 -772 -1952 -2018 -528 -417 108 171 910 443 349 373 -787 -72 855 372 -42 1203 749 -414 -428 -1503 -1744 151 520 -1324 -283 -727 -303 383 906 418 254 68 -320 -233 398 -223 499 414 -106 -286 609 6 900 878 -879 459 975 441 559 -443 -676 -395 484 -80 -491 384 218 -473 -11 -737 184 -186 102 -604 -912 -258 -70 216 308 54 -759 -387 -8 -26 277 258 -282 331 122 606 389 -128 298 416 209 475 198 -327 -316 -46 675 47 1062 -18 -1931 -1116 -805 -652 32 70 -709 -824 -288 -629 -319 73 -466 -69 -508 -242 776 368 560 1098 202 646 967 500 166 287 370 1161 1165 2121 653 -1197 -417 -1326 503 1610 380 454 -168 633 191 -665 -642 -1525 -482 -245 -1087 -808 -2172 -2254 -626 -498 133 215 1120 544 395 409 -811 -74 938 427 -51 1554 992 -534 -518 -1801 -2054 186 652 -1753 -373 -1003 -419 555 1349 615 356 93 -425 -298 515 -304 691 598 -148 -410 844 8 1182 1101 -1134 577 1297 592 782 -637 -955 -583 750 -124 -777 615 347 -734 -17 -1128 SS 20240412T192027.7Z 8868.805876 368 1 48.62 2 45.88 235.99 20.09 128.82 0.00 1 0.00 1 0 17 1.136e-02 7.957e-03 2.086e-04 1.107e-04 2.433374e-01 5.971969e-05 2.970719e-03 -6.000000e+00 6.885059e-03 228.41 -2.00 3.52 -2.00 315.92 0.00e+00 3.083508e-04 6.153413e-06 5.251437e-05 -6.000000e+00 2.994202e-04 279.91 -2.00 20.00 -2.00 315.31 0.00e+00 1.434 0.000 302.00 328.00 3 2.5016e-01 1.5449e-04 1.9217e-02 -6.0000e+00 1.7143e-02 4.9417e-03 1.7153e-04 1.2533e-02 -6.0000e+00 1.8533e-02 2.8342e-03 9.8768e-05 6.1730e-03 -6.0000e+00 1.1015e-02 -3.6572e-03 4.4982e-05 1.7352e-03 -6.0000e+00 4.6664e-03 7.2087e-02 -3.1014e-04 3.4081e-06 2.3560e-05 -6.0000e+00 3.3778e-04 -6.4598e-03 -1.3298e-05 11 8 0 10 0 0 88.99 21.55 0.24 -0.00646 -0.00879 3309 796 1 5 0 14.600 26.00 20.00 21.55 18.90 38.4 1008.71 526 -1212 -58 -3582 -4776 -2127 -834 593 1057 -93 -3400 -1891 -73 1 1046 711 -658 896 497 1718 1133 -424 805 1002 542 1209 666 -958 -768 218 1759 174 2317 31 -4431 -2370 -1646 -1001 222 139 -951 -1045 -273 -883 -398 86 -617 -84 -668 -263 1157 992 674 1347 200 795 1123 613 104 391 518 1325 1192 2158 631 -1365 -380 -1514 550 1582 253 378 -213 549 164 -664 -726 -1865 -505 -244 -1163 -718 -1996 -2108 -599 -530 -54 39 793 447 326 458 -700 34 917 384 -55 1152 712 -415 -390 -1429 -1685 213 518 -1323 -288 -794 -328 270 796 373 217 99 -175 -115 521 -210 575 432 -91 -270 629 85 973 1026 -772 585 1064 444 589 -438 -671 -385 444 -127 -556 287 146 -481 -28 -762 113 -276 -13 -761 -941 -411 -171 133 257 -24 -877 -475 -20 0 365 248 -239 335 192 679 453 -171 335 437 230 521 301 -411 -314 89 756 80 1050 14 -1990 -1090 -841 -557 136 91 -668 -762 -202 -657 -295 63 -442 -59 -462 -185 855 736 527 1096 167 676 913 521 88 333 438 1193 1091 2035 580 -1237 -327 -1315 514 1549 254 388 -216 552 153 -589 -631 -1606 -441 -226 -1146 -770 -2179 -2331 -703 -631 -67 49 976 543 366 493 -742 36 991 439 -67 1439 912 -517 -476 -1707 -1978 261 652 -1694 -385 -1069 -463 386 1171 543 312 132 -225 -149 681 -278 781 613 -130 -381 856 114 1294 1302 -961 744 1381 611 812 -622 -980 -565 664 -197 -856 446 226 -749 -42 -1163 SS 20240412T192637.7Z 8868.810159 372 1 48.60 2 46.85 237.62 19.22 131.84 0.00 1 0.00 1 0 17 1.133e-02 7.920e-03 2.068e-04 1.072e-04 2.473225e-01 5.778690e-05 3.013503e-03 -6.000000e+00 6.866923e-03 228.41 -2.00 3.52 -2.00 315.99 0.00e+00 2.841031e-04 6.027331e-06 5.419260e-05 -6.000000e+00 2.986380e-04 279.91 -2.00 20.00 -2.00 315.37 0.00e+00 1.460 0.000 302.00 328.00 3 1.5065e-01 1.4956e-04 1.9538e-02 -6.0000e+00 1.7098e-02 4.2784e-03 1.6618e-04 1.2725e-02 -6.0000e+00 1.8484e-02 2.8453e-03 9.5877e-05 6.2696e-03 -6.0000e+00 1.0986e-02 -3.6016e-03 4.3773e-05 1.7623e-03 -6.0000e+00 4.6539e-03 7.7144e-02 -3.3370e-04 3.3022e-06 2.3695e-05 -6.0000e+00 3.3691e-04 -6.3130e-03 -1.9416e-05 11 8 0 10 0 0 71.61 21.54 0.23 -0.00631 -0.00882 3616 870 1 5 0 13.360 26.00 20.00 21.54 19.39 38.7 1010.23 592 -1348 6 -3689 -4599 -2240 -832 358 1031 -224 -3432 -1964 26 -130 1076 642 -705 836 511 1650 1178 -427 832 962 554 1220 611 -985 -735 268 1747 189 2348 57 -4362 -2321 -1704 -956 179 180 -983 -1011 -244 -794 -369 137 -716 -65 -726 -252 1159 994 661 1386 164 791 1071 592 69 376 494 1293 1163 2170 585 -1349 -385 -1516 558 1587 244 388 -205 527 187 -683 -721 -1861 -486 -217 -1114 -710 -2016 -2103 -582 -530 -19 63 809 436 355 455 -670 46 956 366 -47 1148 712 -436 -375 -1450 -1700 202 522 -1318 -259 -807 -328 271 799 373 230 104 -173 -150 525 -217 564 427 -61 -267 648 74 955 990 -767 567 1059 447 595 -419 -663 -383 430 -130 -569 288 130 -473 -32 -758 122 -296 1 -754 -870 -417 -164 78 242 -55 -856 -518 7 -40 364 217 -249 304 192 635 458 -168 337 409 246 514 270 -412 -293 107 735 85 1044 26 -1922 -1048 -856 -522 108 122 -679 -725 -178 -581 -269 99 -506 -45 -496 -175 847 770 511 1115 136 665 908 499 58 317 413 1154 1056 2028 534 -1213 -329 -1309 519 1545 243 396 -207 527 172 -602 -623 -1595 -423 -201 -1094 -759 -2196 -2421 -681 -630 -23 78 993 529 397 488 -708 49 1033 418 -57 1434 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