File name: Pandora38s1_BayonneNJ_20240210_L2Fit_fout2c5d20230101p1-8.txt File generation date: 20240211T051746.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c5p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 38 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora38_OF_v4d20201028.txt Instrument calibration file used: Pandora38s1_CF_v5d20230101.txt Level 1 file used: Pandora38s1_BayonneNJ_20240210_L1_smca1c5d20230101p1-8.txt Full location name: Bayonne NJDEP (USEPA AQS ID 34-017-0006) Short location name: BayonneNJ Country of location: USA Location latitude [deg]: 40.6703 Location longitude [deg]: -74.1261 Location altitude [m]: 3 Local noon date: 20240210 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: 259 401 Nominal wavelengths inside fitting window [nm]: 305.1040 305.2447 305.3854 305.5261 305.6667 305.8074 305.9480 306.0886 306.2292 306.3698 306.5104 306.6510 306.7916 306.9321 307.0727 307.2132 307.3537 307.4942 307.6347 307.7752 307.9157 308.0561 308.1966 308.3370 308.4775 308.6179 308.7583 308.8987 309.0391 309.1794 309.3198 309.4601 309.6005 309.7408 309.8811 310.0214 310.1617 310.3020 310.4423 310.5825 310.7228 310.8630 311.0032 311.1434 311.2836 311.4238 311.5640 311.7042 311.8443 311.9844 312.1246 312.2647 312.4048 312.5449 312.6850 312.8250 312.9651 313.1052 313.2452 313.3852 313.5252 313.6652 313.8052 313.9452 314.0852 314.2251 314.3651 314.5050 314.6449 314.7848 314.9247 315.0646 315.2045 315.3443 315.4842 315.6240 315.7639 315.9037 316.0435 316.1833 316.3231 316.4628 316.6026 316.7423 316.8821 317.0218 317.1615 317.3012 317.4409 317.5806 317.7202 317.8599 317.9995 318.1391 318.2788 318.4184 318.5580 318.6975 318.8371 318.9767 319.1162 319.2558 319.3953 319.5348 319.6743 319.8138 319.9533 320.0927 320.2322 320.3716 320.5110 320.6505 320.7899 320.9293 321.0686 321.2080 321.3474 321.4867 321.6261 321.7654 321.9047 322.0440 322.1833 322.3226 322.4618 322.6011 322.7403 322.8795 323.0188 323.1580 323.2972 323.4363 323.5755 323.7147 323.8538 323.9930 324.1321 324.2712 324.4103 324.5494 324.6884 324.8275 324.9666 --------------------------------------------------------------------------------------- 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 20240210T132924.1Z 8806.562085 87 1 47.64 2 75.18 124.51 82.89 117.90 0.00 1 0.00 1 0 17 3.969e-01 1.457e-02 2.835e-01 1.020e-02 5.622621e-01 5.516861e-03 6.323371e-03 -6.000000e+00 2.328610e-01 224.73 -2.00 3.51 -2.00 320.81 0.00e+00 7.135249e-04 2.202786e-03 4.257625e-04 -6.000000e+00 1.095980e-02 275.45 -2.00 20.00 -2.00 320.28 0.00e+00 3.832 0.001 302.00 328.00 3 4.7763e+00 1.6996e-02 4.7989e-02 -6.0000e+00 5.7634e-01 1.0882e-01 2.1550e-02 2.9374e-02 -6.0000e+00 6.2883e-01 -9.9008e-02 2.0683e-02 1.5090e-02 -6.0000e+00 3.7095e-01 3.5401e-02 1.0322e-02 4.7043e-03 -6.0000e+00 1.5530e-01 4.9899e-05 -4.1631e-04 3.2199e-04 6.2322e-05 -6.0000e+00 1.1911e-02 -9.2218e-04 -9.3702e-06 12 8 8 10 0 0 98.79 21.50 0.29 -0.00092 -0.00405 18 4 1 5 0 2646.380 26.62 20.00 21.50 14.55 34.7 1007.38 -63642 -52223 46577 -134129 900000 -33331 900000 11703 35973 900000 -132433 900000 -83277 189490 -3547 -31155 -12891 -22856 86385 -60491 293972 6457 -18755 -16312 -34307 46998 -27349 68971 -8777 57035 34490 31790 -13700 -21301 23379 -14582 3571 -9473 19783 421 8711 9206 -11186 21649 -1005 7395 -4541 16759 6591 6607 2113 -7281 781 503 2353 863 11103 2371 -1547 9189 -904 6305 -1155 8109 -1518 -1663 -1279 2981 6969 -5541 5703 -772 4828 -2003 -539 2829 -4384 -2451 -2975 1876 -1772 -1576 -2071 112 238 -2231 1654 -980 19 -2071 1794 766 -814 -31 -582 1408 -1677 1901 1249 -220 -362 -1791 1531 -1479 -425 -2228 -226 -1040 157 1186 -972 415 -1180 -215 -15 1202 431 -883 768 -948 1135 -668 1524 191 -39 1003 283 2165 -336 1048 -153 759 -675 -736 864 -1052 443 -706 937 17 358 -628 -722 -685 -562 463 -2974 900000 -331 900000 116 358 900000 -4354 900000 -2552 1884 -73 -981 -374 -795 1073 -3145 2922 193 -761 -703 -1758 1207 -1473 1371 -378 1370 1200 1317 -999 -1596 1181 -1099 251 -840 1588 48 1012 1133 -1753 2483 -146 1001 -701 2140 968 1036 381 -1592 171 119 574 222 2623 606 -401 2129 -242 1726 -381 2654 -559 -596 -450 1042 2590 -2635 2630 -392 2274 -951 -230 1058 -1659 -928 -1260 881 -993 -989 -1416 79 180 -1837 1371 -851 16 -1722 1338 539 -561 -22 -458 1241 -1739 2128 1493 -263 -404 -1849 1438 -1459 -442 -2492 -262 -1297 211 1734 -1571 686 -1957 -338 -22 1686 613 -1329 1199 -1559 1816 -1056 2274 277 -54 1331 369 2895 -510 1731 -277 1432 -1352 -1558 1910 -2478 1051 -1718 2225 40 777 -1309 -1477 SS 20240210T135633.9Z 8806.580948 107 1 13.37 2 71.07 129.88 78.50 122.54 0.00 1 0.00 1 0 17 1.354e-01 1.120e-02 1.537e-01 8.873e-03 4.456834e-01 4.562968e-03 5.171808e-03 -6.000000e+00 7.858041e-02 224.73 -2.00 3.51 -2.00 319.58 0.00e+00 -1.125152e-04 1.296783e-03 4.346027e-04 -6.000000e+00 3.421802e-03 275.45 -2.00 20.00 -2.00 319.01 0.00e+00 3.046 0.000 302.00 328.00 3 4.9820e+00 1.2852e-02 3.7960e-02 -6.0000e+00 1.9418e-01 3.4961e-02 1.5182e-02 2.2927e-02 -6.0000e+00 2.1158e-01 2.1510e-03 1.2305e-02 1.1505e-02 -6.0000e+00 1.2584e-01 -1.0074e-02 6.3982e-03 3.3266e-03 -6.0000e+00 5.2765e-02 1.0032e-04 -1.0171e-04 2.7387e-04 4.0581e-05 -6.0000e+00 3.9897e-03 -1.5296e-03 -5.3148e-05 12 9 9 12 9 1 97.93 21.62 0.49 -0.00153 -0.00229 4 4 1 5 0 2673.660 26.73 20.00 21.62 15.33 34.7 1011.82 -37892 -33471 59075 -31176 40364 47712 -43067 -59069 -61849 153 -19720 -38670 -22812 -4150 -6407 6984 -13572 -4539 14173 -6246 13600 10932 -6895 15254 7297 -4622 -1822 -6037 1734 -7642 11795 9447 11405 587 14745 -11442 1861 -2718 417 -5386 -1789 2860 -3347 -1381 -2118 -3287 -4529 -1879 3095 6493 -1484 3101 5041 1400 3926 790 5323 4984 -422 4392 -2273 3884 -151 1278 -406 -554 1424 1919 -693 -485 670 -610 -983 -336 -1522 1855 -2401 -1434 305 -2864 -2444 -2490 -1320 -1817 -2715 -1060 797 891 499 1000 -232 3067 350 1318 492 1526 1985 777 97 -4 -255 -1364 692 -2942 243 -1071 -1443 1627 -683 355 246 206 -597 362 -94 -579 436 -7 1048 -426 -588 -509 511 271 -494 700 1148 1022 3 255 -317 183 219 245 -29 -866 570 -76 -204 -542 20 243 -196 -883 -824 590 -726 466 516 -1175 -2162 -2594 4 -604 -1596 -957 -174 -324 349 -903 -296 811 -457 833 699 -555 1066 593 -440 -167 -555 144 -732 1044 968 1260 74 1561 -1607 256 -468 84 -1242 -438 707 -910 -373 -580 -916 -1279 -520 896 1774 -477 1039 1785 548 1565 336 2201 2052 -180 1781 -1028 1803 -80 720 -234 -306 745 1022 -416 -327 484 -430 -685 -236 -993 1058 -1333 -789 181 -2007 -1941 -2053 -1158 -1697 -2733 -1116 863 985 548 1045 -228 2703 301 1142 468 1621 2220 975 128 -6 -312 -1547 779 -3534 283 -1336 -1901 2203 -1017 535 396 339 -968 550 -142 -844 632 -10 1673 -677 -938 -792 810 413 -725 972 1540 1418 4 424 -532 319 395 466 -55 -1740 1158 -158 -421 -1087 39 467 -372 SS 20240210T140028.7Z 8806.583666 110 1 3.28 2 70.50 130.68 77.89 123.23 0.00 1 0.00 1 0 17 1.282e-01 1.125e-02 1.065e-01 8.940e-03 4.453540e-01 4.563404e-03 5.216305e-03 -6.000000e+00 7.440162e-02 224.73 -2.00 3.51 -2.00 319.03 0.00e+00 -3.966083e-04 1.086542e-03 1.886683e-04 -6.000000e+00 3.238832e-03 275.45 -2.00 20.00 -2.00 318.45 0.00e+00 2.963 0.000 302.00 328.00 3 3.9269e+00 1.2491e-02 3.7219e-02 -6.0000e+00 1.8385e-01 4.5371e-02 1.4417e-02 2.2632e-02 -6.0000e+00 2.0032e-01 -3.3517e-02 1.0746e-02 1.1311e-02 -6.0000e+00 1.1914e-01 9.2197e-03 5.6579e-03 3.2452e-03 -6.0000e+00 4.9969e-02 3.1300e-04 -9.1862e-05 2.6962e-04 3.9060e-05 -6.0000e+00 3.7765e-03 -2.7695e-03 -3.3480e-05 12 9 9 12 1 1 999.00 21.63 0.23 -0.00277 -0.00346 2 10 1 5 0 1090.840 26.73 19.99 21.63 15.30 34.7 1011.78 -49114 80897 -44010 4952 -34289 -1719 5063 -32325 63044 -40981 205 -13162 9561 -2836 -1949 11722 -18981 20705 -19198 12557 -11148 4833 -450 -7499 14953 -11980 11821 -18323 3641 186 -2166 5793 -1783 9837 -9229 10900 -7059 5620 -286 712 2671 -1463 6518 -1438 5010 -2208 2917 2041 -5666 4731 -2845 1693 -1559 3628 420 1951 1195 -1000 184 -4300 2438 -53 3795 1236 478 780 -1417 3829 -420 2059 48 -659 764 1402 -460 -2946 158 -1850 -202 -153 -1225 -943 -1995 -1396 -1291 -1027 -1077 283 130 608 610 431 1026 -1077 1281 -1427 2155 -1045 539 605 -1155 615 -1593 420 -270 -80 -932 -279 362 -8 111 -261 337 350 162 680 -148 762 -504 39 -775 -421 941 -326 48 805 1211 661 500 5 546 393 -1225 159 -187 259 440 -415 -230 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