File name: Pandora55s1_QueensNY_20201116_L2Fit_fout2c10d20200414p1-8.txt File generation date: 20260625T172825.1Z Data description: Level 2 spectral fitting results file Data file version: fout2c10p1-8 Local principal investigator: James Szykman Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora55_OF_v3d20190723.txt Instrument calibration file used: Pandora55s1_CF_v10d20200414.txt Level 1 file used: Pandora55s1_QueensNY_20201116_L1_smca1c10d20200414p1-8.txt Full location name: Queens College NYSDEC (USEPA AQS ID 36-081-0124) Short location name: QueensNY Country of location: USA Location latitude [deg]: 40.7361 Location longitude [deg]: -73.8215 Location altitude [m]: 25 Local noon date: 20201116 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: None First and last pixel inside fitting window: 262 404 Nominal wavelengths inside fitting window [nm]: 305.1379 305.2779 305.4179 305.5579 305.6978 305.8378 305.9778 306.1177 306.2576 306.3976 306.5375 306.6774 306.8172 306.9571 307.0970 307.2369 307.3767 307.5165 307.6564 307.7962 307.9360 308.0758 308.2156 308.3553 308.4951 308.6349 308.7746 308.9143 309.0541 309.1938 309.3335 309.4732 309.6128 309.7525 309.8922 310.0318 310.1715 310.3111 310.4507 310.5903 310.7299 310.8695 311.0091 311.1486 311.2882 311.4277 311.5673 311.7068 311.8463 311.9858 312.1253 312.2648 312.4043 312.5437 312.6832 312.8226 312.9621 313.1015 313.2409 313.3803 313.5197 313.6591 313.7984 313.9378 314.0771 314.2165 314.3558 314.4951 314.6344 314.7737 314.9130 315.0523 315.1915 315.3308 315.4700 315.6092 315.7485 315.8877 316.0269 316.1661 316.3052 316.4444 316.5836 316.7227 316.8618 317.0010 317.1401 317.2792 317.4183 317.5574 317.6964 317.8355 317.9745 318.1136 318.2526 318.3916 318.5306 318.6696 318.8086 318.9476 319.0866 319.2255 319.3645 319.5034 319.6423 319.7812 319.9201 320.0590 320.1979 320.3368 320.4756 320.6145 320.7533 320.8922 321.0310 321.1698 321.3086 321.4474 321.5861 321.7249 321.8636 322.0024 322.1411 322.2798 322.4185 322.5572 322.6959 322.8346 322.9733 323.1119 323.2506 323.3892 323.5278 323.6665 323.8051 323.9436 324.0822 324.2208 324.3594 324.4979 324.6364 324.7750 324.9135 --------------------------------------------------------------------------------------- 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 20201116T124618.1Z 7625.532154 71 1 50.21 2 80.61 125.19 96.35 114.13 0.00 1 0.00 1 0 25 4.274e-01 8.934e-03 1.476e-01 1.801e-03 7.069813e-01 9.778064e-04 8.084966e-03 -6.000000e+00 2.495899e-01 223.24 -2.00 3.51 -2.00 321.00 0.00e+00 4.581711e-03 4.574537e-04 2.512930e-03 -6.000000e+00 1.128661e-02 280.32 -2.00 20.00 -2.00 320.47 0.00e+00 5.833 0.004 302.00 328.00 3 6.4592e-02 3.1961e-03 7.0426e-02 -6.0000e+00 6.1368e-01 8.3245e-02 4.4157e-03 4.3556e-02 -6.0000e+00 6.6738e-01 -6.4172e-02 4.6073e-03 1.9846e-02 -6.0000e+00 3.9874e-01 1.5488e-02 2.2121e-03 9.1398e-03 -6.0000e+00 1.7079e-01 7.4916e-04 -1.1969e-03 5.1591e-05 8.3474e-05 -6.0000e+00 1.2823e-02 8.5350e-03 4.0861e-05 11 8 0 10 0 0 8.30 23.04 0.22 0.00853 -0.00046 194 37 1 5 0 255.960 25.90 20.00 23.04 14.85 26.5 961.77 -56746 900000 -215011 -41602 -171603 -138622 58212 -126005 -142689 -149038 -109012 -159202 -65240 62336 -79348 -68336 -51843 62317 76201 -13737 3009 -42234 -42075 -41913 -29514 45335 -33933 -15307 -50869 2152 -3785 -11660 -30434 -3631 35202 -20079 -14515 11761 8194 -8262 -665 -7844 2734 -1943 7622 -4913 8019 3949 7386 273 1376 -1932 5540 9032 1000 5121 1869 3924 42 2677 3750 2003 -424 3826 409 3290 -147 2824 3951 -548 1160 652 -1266 385 -284 271 2352 1535 -271 -288 994 -1316 -1171 -1816 -1229 -1216 -755 -1122 -447 -15 367 738 1843 1055 1007 188 758 -23 -766 -581 -306 602 753 388 -1609 -882 -1175 -269 318 -484 -869 -96 -35 -91 642 981 1336 140 -358 -1208 -434 -24 451 -278 323 326 1235 1002 -7 346 238 836 341 364 -365 -217 -30 -455 -838 -181 16 61 364 -142 900000 -2917 -103 -1454 -889 102 -909 -1337 -1611 -907 -2613 -574 209 -1296 -1188 -880 396 459 -205 39 -872 -922 -998 -674 537 -851 -326 -1580 47 -105 -416 -1445 -141 952 -934 -722 551 475 -643 -54 -726 242 -185 685 -511 771 413 802 34 191 -308 906 1547 194 1003 385 790 9 538 784 470 -114 1099 127 997 -46 912 1396 -225 507 295 -574 163 -113 98 808 552 -111 -137 534 -805 -773 -1277 -906 -943 -607 -922 -364 -12 276 526 1284 768 809 172 771 -26 -927 -707 -355 647 759 392 -1718 -983 -1368 -329 416 -692 -1345 -154 -57 -146 990 1472 2006 217 -579 -2016 -718 -40 707 -426 483 476 1763 1473 -12 600 443 1631 693 770 -810 -497 -71 -1074 -1984 -419 36 130 762 SS 20201116T130458.7Z 7625.545124 85 1 49.37 2 77.78 128.65 93.32 116.98 0.00 1 0.00 1 0 25 1.398e-01 6.601e-03 2.192e-02 8.272e-04 5.733565e-01 4.341613e-04 6.729456e-03 -6.000000e+00 8.166342e-02 223.24 -2.00 3.51 -2.00 320.03 0.00e+00 1.679453e-03 1.490427e-04 1.125942e-03 -6.000000e+00 3.645393e-03 280.32 -2.00 20.00 -2.00 319.44 0.00e+00 4.588 0.002 302.00 328.00 3 -4.8073e-03 1.2704e-03 5.4492e-02 -6.0000e+00 2.0079e-01 3.9474e-02 1.5621e-03 3.0885e-02 -6.0000e+00 2.1836e-01 -1.3762e-02 1.4072e-03 1.5030e-02 -6.0000e+00 1.3037e-01 -4.8594e-03 7.2262e-04 4.9931e-03 -6.0000e+00 5.5565e-02 2.9909e-03 -8.9156e-04 2.4484e-05 5.5033e-05 -6.0000e+00 4.1950e-03 8.3149e-03 4.1474e-05 11 8 0 10 0 0 4.94 23.05 0.20 0.00831 0.00162 400 76 1 5 0 122.160 25.90 20.00 23.05 15.72 26.6 964.91 -40624 -6187 -67388 -33883 -57562 -56689 -33428 -46930 -42503 -49860 -36529 -45267 -16245 -9273 -16817 -11802 -14148 2325 -1785 -3331 -5064 -8661 -11586 -8921 -8915 -1158 -4669 -5612 -8638 -2680 -796 116 -5294 -1774 4245 -3598 -3188 1837 -878 -2377 -1642 -2625 -1263 -506 794 -713 1334 580 1852 1392 444 594 1861 2255 614 1547 287 776 560 1543 1991 1873 918 406 520 1366 996 1955 1394 196 -177 -274 -727 -675 -146 108 969 1364 168 -100 -350 -1485 -1532 -1272 -1172 -1122 -774 -519 -484 -3 647 806 1577 1549 1259 796 881 -242 -579 -278 -520 246 988 51 -1088 -668 -899 -134 -70 -194 -491 -258 -43 84 660 939 920 383 -356 -1001 -714 -289 -276 -115 179 431 1468 1105 254 412 118 530 220 203 -341 -238 103 -383 -515 -200 -101 16 271 -400 -48 -894 -339 -701 -709 -372 -623 -598 -812 -571 -913 -307 -205 -487 -376 -514 78 -67 -133 -211 -384 -564 -463 -499 -62 -260 -311 -502 -161 -51 8 -457 -152 339 -321 -321 213 -126 -374 -285 -491 -243 -99 156 -145 272 123 406 329 117 174 545 706 206 536 103 275 195 533 717 746 414 188 248 633 457 923 734 118 -109 -175 -460 -430 -85 57 478 682 94 -66 -250 -1136 -1277 -1128 -1046 -1064 -769 -526 -487 -2 617 718 1340 1351 1214 831 997 -295 -762 -367 -646 291 1082 57 -1296 -841 -1138 -179 -96 -283 -785 -413 -69 136 998 1421 1388 576 -569 -1603 -1146 -470 -434 -174 272 629 2058 1593 386 696 209 951 415 389 -698 -493 218 -832 -1119 -424 -203 31 517 SS 20201116T131057.5Z 7625.549276 88 1 48.97 2 76.91 129.78 92.37 117.91 0.00 1 0.00 1 0 25 1.025e-01 6.565e-03 1.407e-02 6.876e-04 5.410548e-01 3.587724e-04 6.373131e-03 -6.000000e+00 5.988084e-02 223.24 -2.00 3.51 -2.00 319.75 0.00e+00 1.377256e-03 1.120241e-04 7.933197e-04 -6.000000e+00 2.672951e-03 280.32 -2.00 20.00 -2.00 319.14 0.00e+00 4.302 0.001 302.00 328.00 3 -4.0420e-02 1.0276e-03 5.1015e-02 -6.0000e+00 1.4723e-01 3.5528e-02 1.2367e-03 2.8530e-02 -6.0000e+00 1.6011e-01 -1.5054e-02 1.0589e-03 1.4024e-02 -6.0000e+00 9.5597e-02 -2.7327e-03 5.5016e-04 4.4678e-03 -6.0000e+00 4.0745e-02 4.2125e-03 -7.8753e-04 2.0522e-05 5.2603e-05 -6.0000e+00 3.0760e-03 8.1819e-03 4.5206e-05 11 8 0 10 0 0 11.56 23.04 0.21 0.00818 0.00226 483 91 1 5 0 100.320 25.90 20.01 23.04 15.60 26.4 964.06 -37683 -7814 -36642 -34708 -36243 -45928 -19234 -37935 -23601 -43604 -20400 -32221 -9486 -5289 -11645 -7166 -19595 4610 -3934 1886 -4009 -2523 -7950 -5215 -6822 -488 -5551 -7091 -5521 -1909 862 -1025 -2058 -2186 3442 -3681 -482 810 -302 -1740 -2113 -2188 -1812 238 -51 -242 92 778 979 1568 1089 1178 2016 1532 1191 1245 418 292 749 1276 2041 1607 766 452 392 1259 772 2044 1038 111 -475 -533 -633 -587 -221 330 1000 1339 236 -176 -393 -1555 -1397 -1391 -1104 -921 -634 -509 -527 74 467 804 1470 1526 1176 917 851 -341 -702 -405 -417 107 942 -1 -1084 -665 -819 -285 -103 -135 -330 -131 -29 103 626 972 876 546 -324 -960 -692 -368 -370 42 141 333 1460 1052 317 441 118 344 218 260 -237 -253 79 -386 -604 -194 -98 8 225 -528 -90 -518 -505 -513 -739 -266 -657 -391 -944 -381 -792 -230 -153 -431 -291 -995 200 -198 94 -216 -137 -486 -338 -443 -31 -368 -468 -395 -132 67 -94 -211 -231 338 -400 -57 115 -52 -328 -443 -490 -420 55 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