File name: Pandora55s1_QueensNY_20220504_L2Fit_fout2c19d20211111p1-8.txt File generation date: 20250606T121228.8Z Data description: Level 2 spectral fitting results file Data file version: fout2c19p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora55_OF_v4d20190723.txt Instrument calibration file used: Pandora55s1_CF_v19d20211111.txt Level 1 file used: Pandora55s1_QueensNY_20220504_L1_smca1c19d20211111p1-8.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: 20220504 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: 261 404 Nominal wavelengths inside fitting window [nm]: 305.0379 305.1778 305.3178 305.4578 305.5977 305.7376 305.8776 306.0175 306.1574 306.2973 306.4372 306.5770 306.7169 306.8567 306.9966 307.1364 307.2762 307.4160 307.5558 307.6956 307.8354 307.9752 308.1149 308.2547 308.3944 308.5341 308.6738 308.8135 308.9532 309.0929 309.2326 309.3723 309.5119 309.6515 309.7912 309.9308 310.0704 310.2100 310.3496 310.4892 310.6287 310.7683 310.9079 311.0474 311.1869 311.3264 311.4659 311.6054 311.7449 311.8844 312.0239 312.1633 312.3028 312.4422 312.5816 312.7210 312.8604 312.9998 313.1392 313.2786 313.4179 313.5573 313.6966 313.8360 313.9753 314.1146 314.2539 314.3932 314.5324 314.6717 314.8110 314.9502 315.0895 315.2287 315.3679 315.5071 315.6463 315.7855 315.9246 316.0638 316.2030 316.3421 316.4812 316.6204 316.7595 316.8986 317.0377 317.1767 317.3158 317.4549 317.5939 317.7329 317.8720 318.0110 318.1500 318.2890 318.4280 318.5669 318.7059 318.8449 318.9838 319.1227 319.2617 319.4006 319.5395 319.6784 319.8172 319.9561 320.0950 320.2338 320.3726 320.5115 320.6503 320.7891 320.9279 321.0667 321.2054 321.3442 321.4830 321.6217 321.7604 321.8991 322.0379 322.1766 322.3152 322.4539 322.5926 322.7312 322.8699 323.0085 323.1471 323.2857 323.4243 323.5629 323.7015 323.8401 323.9786 324.1172 324.2557 324.3943 324.5328 324.6713 324.8098 324.9483 --------------------------------------------------------------------------------------- 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 100-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-387: 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 20220504T175739.0Z 8159.748369 328 1 1.89 2 28.42 214.73 28.26 111.81 0.00 1 0.00 1 0 17 1.084e-02 8.071e-03 6.824e-03 4.998e-03 1.728952e-01 2.667956e-03 2.133036e-03 -6.000000e+00 6.472496e-03 230.20 -2.00 3.51 -2.00 314.58 0.00e+00 4.196443e-04 2.118696e-04 7.856186e-05 -6.000000e+00 2.841417e-04 282.47 -2.00 20.00 -2.00 314.03 0.00e+00 1.137 0.000 302.00 328.00 3 3.6882e+00 6.8451e-03 1.4568e-02 -6.0000e+00 1.6161e-02 3.0260e-02 7.5724e-03 8.9962e-03 -6.0000e+00 1.7494e-02 -3.7387e-03 4.3293e-03 4.4048e-03 -6.0000e+00 1.0408e-02 -2.0751e-03 1.8506e-03 1.2851e-03 -6.0000e+00 4.3396e-03 3.5491e-03 -8.9579e-04 1.5253e-04 1.9237e-05 -6.0000e+00 3.2395e-04 -2.7198e-03 -7.7270e-06 12 9 1 12 1 1 999.00 22.49 0.22 -0.00272 -0.00945 1 11 1 5 0 855.570 25.68 20.00 22.49 20.66 31.9 1100.00 -988 -542 -2249 -3487 -2709 1769 -2008 1398 1856 533 -2771 1245 1002 128 764 -568 196 1347 1718 730 58 -316 3159 -811 1053 2402 779 -1459 -969 1342 1446 1969 -939 -345 -1822 2237 745 -310 1029 -936 -1294 -1261 -1727 -1114 -860 -856 -1591 -1064 -900 1293 669 190 1189 926 -134 1193 540 -476 667 1289 610 1735 1270 56 -269 -532 768 -92 510 549 117 -691 -1158 -351 -762 -652 192 1818 1020 -35 -3 -618 -2027 -654 -1111 -1129 38 -269 -238 36 -646 504 426 1518 1284 1176 1523 222 -244 366 -942 215 -320 954 487 -865 -971 -120 -859 -555 -125 -138 -327 -245 -47 337 325 751 639 -111 -499 -103 -418 -189 569 65 870 1426 892 291 172 -383 381 88 313 -689 527 127 -706 -377 9 -322 -127 -157 -366 -212 -900 -1363 -985 592 -697 504 716 214 -1143 498 419 58 368 -291 102 711 919 400 32 -177 1733 -464 613 1417 464 -859 -546 721 775 1084 -546 -204 -1070 1245 427 -192 699 -704 -1037 -1046 -1461 -948 -730 -725 -1339 -876 -726 1018 532 156 1001 800 -119 1063 488 -433 601 1151 549 1592 1213 56 -272 -526 720 -83 458 516 116 -719 -1226 -369 -784 -643 178 1587 877 -31 -3 -618 -2136 -705 -1237 -1301 45 -329 -294 44 -779 580 465 1574 1318 1241 1680 260 -298 456 -1170 257 -369 1078 565 -1047 -1214 -152 -1122 -741 -171 -192 -455 -333 -61 419 393 902 786 -142 -661 -138 -562 -251 734 81 1064 1696 1062 355 217 -495 495 116 418 -952 741 182 -1029 -551 13 -461 -179 -219 SS 20220504T181713.1Z 8159.761958 343 1 1.10 2 30.75 223.02 24.96 117.94 0.00 1 0.00 1 0 25 1.123e-02 8.411e-03 6.602e-03 4.829e-03 1.751191e-01 2.582511e-03 2.145288e-03 -6.000000e+00 6.706525e-03 230.21 -2.00 3.51 -2.00 314.59 0.00e+00 1.115806e-04 2.046170e-04 2.136389e-05 -6.000000e+00 2.944058e-04 282.47 -2.00 20.00 -2.00 314.04 0.00e+00 1.163 0.000 302.00 328.00 3 2.9925e+00 6.6265e-03 1.4827e-02 -6.0000e+00 1.6745e-02 1.6897e-02 7.3292e-03 9.0682e-03 -6.0000e+00 1.8126e-02 7.0823e-04 4.1886e-03 4.4404e-03 -6.0000e+00 1.0784e-02 -4.5112e-04 1.7908e-03 1.2291e-03 -6.0000e+00 4.4967e-03 6.9255e-03 -1.1136e-03 1.4713e-04 1.8664e-05 -6.0000e+00 3.3564e-04 -3.0230e-03 -1.9143e-06 12 9 1 12 1 1 999.00 22.51 0.22 -0.00302 -0.01139 1 20 1 5 0 460.740 25.68 20.00 22.51 22.78 32.0 1100.00 -252 -806 -2630 -2986 -3057 983 566 2595 -343 -422 -241 1927 3102 1285 2108 23 805 -1565 -484 -265 505 -1030 1869 1594 584 704 -2890 -1498 -261 1475 2487 3074 1245 -1773 144 327 1799 213 -474 479 -2102 -736 -1203 -1173 -1226 -1514 -1387 273 -736 234 -308 1979 1327 129 597 1176 1262 -524 257 560 1793 551 1327 -314 -1240 -337 283 -91 1886 145 390 -248 -1104 -9 102 -123 -168 1038 1125 491 -665 -391 -1654 -757 -1225 -834 -1210 -1176 360 -588 41 376 278 1526 1081 2001 957 873 -562 -29 -334 -712 -9 684 -679 -660 -138 -613 236 -360 250 -550 -337 -272 485 316 649 649 1203 -263 -104 -502 -54 -639 742 481 372 1370 603 -861 -184 426 312 -433 195 -342 32 -200 -99 -831 109 -107 -546 761 -93 -315 -1051 -1160 -1115 332 194 931 -134 -171 -98 773 1279 574 1005 12 419 -838 -261 -146 279 -578 1029 896 341 419 -1759 -882 -147 793 1325 1679 715 -1055 83 185 1024 131 -324 355 -1684 -606 -1011 -994 -1039 -1283 -1160 222 -592 185 -246 1600 1113 111 526 1044 1133 -476 232 501 1603 508 1265 -312 -1254 -332 266 -82 1684 137 387 -256 -1167 -10 104 -121 -156 913 970 436 -630 -391 -1738 -816 -1362 -959 -1446 -1442 443 -726 50 434 305 1587 1113 2104 1060 1019 -690 -36 -414 -854 -11 775 -793 -798 -171 -783 307 -479 341 -767 -468 -370 631 395 784 782 1478 -338 -138 -678 -73 -851 959 607 457 1632 720 -1062 -233 549 407 -572 262 -471 45 -287 -144 -1218 157 -153 -768 1056 SS 20220504T195747.2Z 8159.831797 408 1 40.28 2 46.92 252.35 14.41 180.19 0.00 1 0.00 1 0 25 9.021e-03 6.741e-03 3.008e-04 1.786e-04 2.269862e-01 9.453216e-05 2.757995e-03 -6.000000e+00 5.388336e-03 230.21 -2.00 3.51 -2.00 315.58 0.00e+00 7.828968e-05 9.092875e-06 4.823944e-05 -6.000000e+00 2.364774e-04 282.47 -2.00 20.00 -2.00 314.93 0.00e+00 1.462 0.000 302.00 328.00 3 4.5413e-01 2.4465e-04 1.8864e-02 -6.0000e+00 1.3454e-02 1.1429e-02 2.7200e-04 1.1740e-02 -6.0000e+00 1.4562e-02 -6.0246e-03 1.5528e-04 5.7447e-03 -6.0000e+00 8.6637e-03 -4.1668e-04 6.8464e-05 1.5900e-03 -6.0000e+00 3.6140e-03 5.9374e-02 -4.6493e-04 5.4793e-06 2.2300e-05 -6.0000e+00 2.6952e-04 -3.9666e-03 7.9210e-05 11 8 0 10 0 0 97.23 22.51 0.23 -0.00397 -0.00746 1267 240 1 5 0 31.310 25.68 19.99 22.51 26.05 32.2 1100.00 -1092 -1969 -3270 -3414 -2027 -141 853 1228 607 -976 -265 835 1024 807 477 -416 -247 26 473 478 61 1109 1360 1016 619 69 -825 -738 505 1668 1426 1937 1463 -933 -587 342 485 650 615 -694 -1252 -1085 -1255 -1138 -853 -804 -1099 -886 -650 474 748 623 899 672 616 587 779 319 614 898 1488 1198 1083 253 -860 -215 -101 561 1380 848 125 -356 -668 -532 -767 -196 208 674 1373 362 19 -855 -1514 -1218 -1073 -1038 -708 -545 -509 -627 -141 251 487 1335 1482 1271 839 654 -455 -517 -427 -471 171 826 -29 -687 -355 -721 -130 -98 -175 -405 -306 -157 -8 633 855 854 625 -130 -594 -345 -253 -222 362 283 736 1504 973 406 436 -61 240 145 225 -330 -214 65 -513 -442 -230 -272 -205 -26 -270 -540 -932 -934 -499 -34 209 306 169 -292 -79 250 307 272 171 -165 -103 11 197 205 27 487 599 464 299 33 -399 -363 231 720 622 893 726 -465 -286 168 246 350 371 -450 -870 -804 -964 -848 -635 -623 -842 -660 -470 334 537 473 691 544 517 484 653 270 514 740 1231 1039 970 234 -830 -200 -90 486 1187 764 121 -357 -693 -544 -780 -190 190 584 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