File name: Pandora206s1_BuffaloNY_20230702_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T054659.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: Kang Sun Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 206 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora206_OF_v3d20211008.txt Instrument calibration file used: Pandora206s1_CF_v4d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20230702_L1_smca1c4d20220512p1-8.txt Full location name: University at Buffalo Short location name: BuffaloNY Country of location: Canada Location latitude [deg]: 43.0015 Location longitude [deg]: -78.7869 Location altitude [m]: 190 Local noon date: 20230702 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: 223 365 Nominal wavelengths inside fitting window [nm]: 305.0744 305.2154 305.3564 305.4973 305.6383 305.7792 305.9201 306.0611 306.2020 306.3428 306.4837 306.6246 306.7654 306.9063 307.0471 307.1879 307.3287 307.4695 307.6103 307.7511 307.8918 308.0326 308.1733 308.3140 308.4548 308.5955 308.7362 308.8768 309.0175 309.1582 309.2988 309.4394 309.5801 309.7207 309.8613 310.0019 310.1424 310.2830 310.4236 310.5641 310.7046 310.8451 310.9857 311.1261 311.2666 311.4071 311.5476 311.6880 311.8285 311.9689 312.1093 312.2497 312.3901 312.5305 312.6708 312.8112 312.9515 313.0919 313.2322 313.3725 313.5128 313.6531 313.7934 313.9336 314.0739 314.2141 314.3543 314.4946 314.6348 314.7750 314.9151 315.0553 315.1955 315.3356 315.4758 315.6159 315.7560 315.8961 316.0362 316.1763 316.3163 316.4564 316.5964 316.7364 316.8765 317.0165 317.1565 317.2964 317.4364 317.5764 317.7163 317.8563 317.9962 318.1361 318.2760 318.4159 318.5558 318.6956 318.8355 318.9753 319.1152 319.2550 319.3948 319.5346 319.6744 319.8141 319.9539 320.0937 320.2334 320.3731 320.5128 320.6525 320.7922 320.9319 321.0716 321.2112 321.3509 321.4905 321.6301 321.7697 321.9093 322.0489 322.1885 322.3280 322.4676 322.6071 322.7467 322.8862 323.0257 323.1652 323.3046 323.4441 323.5836 323.7230 323.8624 324.0018 324.1413 324.2806 324.4200 324.5594 324.6988 324.8381 324.9774 --------------------------------------------------------------------------------------- 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: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Temperature at electronics board 1 [°C], 999=no temperature signal Column 98: Temperature at electronics board 2 [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: 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 20230702T115917.6Z 8583.499509 171 1 28.01 2 67.42 78.95 126.90 264.09 0.00 1 0.00 1 0 25 4.535e-01 3.125e-02 2.541e-01 2.261e-02 3.586613e-01 1.162827e-02 4.700609e-03 -6.000000e+00 2.650683e-01 232.93 -2.00 3.55 -2.00 318.97 0.00e+00 7.742063e-04 2.682167e-03 2.421658e-03 -6.000000e+00 1.189144e-02 286.08 -2.00 20.00 -2.00 318.18 0.00e+00 2.583 0.000 302.00 328.00 3 7.4983e+00 3.2436e-02 3.3482e-02 -6.0000e+00 6.6601e-01 1.4600e-01 3.7709e-02 2.4911e-02 -6.0000e+00 7.2118e-01 3.8369e-02 2.7705e-02 1.0061e-02 -6.0000e+00 4.2389e-01 -3.1324e-02 1.4503e-02 3.0687e-03 -6.0000e+00 1.7764e-01 1.3476e-05 -5.5564e-04 6.4756e-04 2.6894e-05 -6.0000e+00 1.1987e-02 -2.5199e-02 2.9398e-04 12 8 8 10 0 0 -177.18 18.79 4.33 -0.02520 -0.02937 7 7 2 8 0 4000.000 14.99 18.79 29.89 22.09 22.19 17.9 1052.66 -621 324011 191591 102315 900000 900000 900000 900000 -12222 47003 31497 91412 -36277 69822 -22946 62677 282066 57455 13185 6433 72488 -25796 -1257 17605 36422 -16612 9831 -11631 -8960 6924 1058 -191 16054 54605 13759 5717 7270 13344 -3338 14931 -13299 -6618 1036 -2122 -364 1794 2751 -23545 -2056 -2488 3790 -1212 -1022 -2009 6752 7474 -355 4390 5409 -10979 -3382 4351 -437 5805 -5276 3882 -5965 506 1844 -1750 -3290 2925 1981 2742 2888 8200 9197 -335 -2084 -2401 -1708 2098 -6508 -4140 1021 -2024 2573 1598 -2158 2733 1365 -2636 2783 -552 7959 -2703 1038 3223 1340 1634 2964 96 1571 -2040 2793 -897 331 1420 331 -2146 -105 -2045 -7074 -4 -1192 -397 536 -1940 -2472 1627 -578 1495 224 2847 2592 -1176 -1246 -1670 1856 -301 2120 -271 1219 -756 180 24 -111 2649 2328 1026 1606 -3205 -3828 -19 7139 4221 2254 900000 900000 900000 900000 -572 1370 1075 2014 -2798 2283 -2165 2985 6215 3267 1198 656 4070 -3712 -145 1864 3391 -2677 1286 -1738 -1248 817 145 -29 2328 5783 2054 882 1209 2419 -839 3753 -4945 -2420 365 -786 -132 642 968 -10619 -745 -943 1441 -512 -458 -971 3124 3505 -185 2179 2672 -6093 -1837 2353 -264 3593 -3731 2400 -3807 297 1122 -1227 -2596 2272 1555 2115 2065 4966 4975 -189 -1255 -1659 -1330 1758 -6215 -4019 1007 -2211 2821 1826 -2578 2998 1443 -2653 2439 -483 6800 -2868 1187 3928 1791 2146 3714 113 1680 -2295 3278 -1150 437 1954 470 -3359 -172 -3516 -12425 -7 -1755 -542 719 -2776 -3800 2557 -943 2334 346 4089 3525 -1588 -1592 -2214 2497 -447 3272 -446 2012 -1319 331 45 -213 5076 4511 2006 2986 -5991 -6968 SS 20230702T132119.2Z 8583.556472 212 1 28.01 2 52.51 92.36 141.08 277.68 0.00 1 0.00 1 0 17 3.417e-02 1.273e-02 2.533e-02 7.825e-03 2.320597e-01 3.943082e-03 2.754998e-03 -6.000000e+00 1.953173e-02 232.93 -2.00 3.55 -2.00 317.36 0.00e+00 -3.059772e-04 5.697327e-04 1.362095e-04 -6.000000e+00 8.573576e-04 286.09 -2.00 20.00 -2.00 316.55 0.00e+00 1.639 0.000 302.00 328.00 3 7.3596e+00 1.0547e-02 2.0339e-02 -6.0000e+00 4.9112e-02 2.3106e-02 1.1848e-02 1.2293e-02 -6.0000e+00 5.3128e-02 3.0332e-02 7.0860e-03 5.9212e-03 -6.0000e+00 3.1574e-02 -1.9625e-02 3.4754e-03 1.6471e-03 -6.0000e+00 1.3358e-02 5.0515e-05 9.7275e-05 2.1817e-04 1.6962e-05 -6.0000e+00 8.7161e-04 -2.4908e-02 2.0255e-04 12 8 8 10 0 0 89.83 18.80 0.74 -0.02491 -0.02418 7 7 2 8 0 4000.000 15.00 18.80 32.26 22.19 22.19 17.9 1065.85 -20244 9309 -4196 3062 567 10668 6176 10557 989 3556 819 9825 -9891 6813 -8518 1820 9661 -1723 -979 1893 6627 -4269 4829 2082 -1117 819 2209 36 32 -4332 882 -3033 4210 -888 -2030 324 -1448 -620 2094 -863 -1543 -499 1593 -1953 -1625 619 -1509 -7438 -877 -1850 57 766 23 71 1448 1988 25 964 865 -1029 -1337 406 651 3812 59 482 375 -629 1037 1171 181 920 792 910 1031 3 1340 -2589 -1749 3658 -1200 359 -2732 -1455 -245 -664 2139 503 659 1515 -638 -359 -91 -5098 -293 -696 83 1224 900 755 646 -1257 -690 -1377 -459 -1474 -1540 271 299 -253 850 67 -975 285 -835 -283 -1391 -889 -334 146 735 847 848 861 1962 237 -413 40 1073 13 1175 -374 479 -504 -436 -252 -254 886 858 304 586 -2136 -914 -2636 995 -531 352 58 931 598 1095 127 479 111 1214 -1656 1097 -1759 388 1972 -406 -238 464 1591 -1126 1183 559 -325 244 656 10 8 -1139 232 -884 1237 -288 -614 95 -457 -224 886 -432 -855 -285 918 -1178 -968 361 -879 -4448 -479 -1041 32 460 15 47 992 1374 18 687 603 -724 -968 309 521 3165 51 388 278 -454 771 994 166 877 758 841 915 3 982 -1846 -1274 2848 -1066 348 -2828 -1544 -276 -785 2592 641 846 1858 -757 -387 -91 -5126 -295 -752 99 1555 1221 1004 807 -1519 -775 -1607 -584 -1939 -2114 383 429 -388 1358 106 -1537 412 -1144 -370 -1827 -1211 -473 222 1105 1290 1265 1227 2685 315 -522 50 1422 19 1690 -560 722 -791 -709 -431 -445 1574 1500 533 989 -3581 -1516 SS 20230702T133229.0Z 8583.564224 217 1 30.17 2 50.47 94.36 142.99 279.87 0.00 1 0.00 1 0 17 8.232e-03 5.549e-03 2.651e-03 1.237e-03 2.086543e-01 6.261858e-04 2.519173e-03 -6.000000e+00 4.704109e-03 232.93 -2.00 3.55 -2.00 316.42 0.00e+00 2.575819e-04 7.182936e-05 3.410215e-05 -6.000000e+00 2.065673e-04 286.09 -2.00 20.00 -2.00 315.64 0.00e+00 1.568 0.000 302.00 328.00 3 4.4584e+00 1.6507e-03 1.9020e-02 -6.0000e+00 1.1828e-02 -1.3114e-02 1.8423e-03 1.1064e-02 -6.0000e+00 1.2797e-02 1.9520e-03 1.0637e-03 5.3447e-03 -6.0000e+00 7.6051e-03 -2.2391e-03 4.9490e-04 1.4689e-03 -6.0000e+00 3.2162e-03 1.0548e-03 -8.5526e-06 3.3946e-05 1.6209e-05 -6.0000e+00 2.1002e-04 -2.3583e-02 1.5566e-04 10 0 0 10 0 0 91.48 18.80 0.32 -0.02358 -0.02365 45 45 2 8 0 667.720 15.00 18.80 32.31 22.19 22.19 18.0 1067.73 -1066 -774 -214 -2456 -3130 -2072 -821 676 843 -195 -2066 -1036 -1085 474 -237 471 -232 382 273 1264 935 128 702 1370 -44 856 123 332 -466 250 1259 1008 2026 443 -1993 -2038 -1462 -1381 -110 -242 -860 -775 -633 -879 -521 -591 -620 -567 -659 -265 711 521 807 1146 478 997 558 679 414 618 967 1057 1124 1422 497 -254 -280 -825 278 334 359 222 307 333 353 -166 -247 -597 -321 -358 -1123 -863 -1911 -1584 -858 -904 -126 -35 434 247 387 287 323 397 457 223 367 740 154 -248 -1 -626 -707 -35 -593 -830 -840 -636 -461 238 265 257 51 -13 -87 57 -37 161 150 215 -137 46 338 227 647 412 540 839 651 460 344 90 -163 76 73 -127 -31 213 -71 -299 -229 -485 -672 -199 -157 -44 -491 -544 -335 -138 125 174 -43 -454 -224 -259 126 -65 142 -72 122 90 427 324 44 243 498 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