File name: Pandora272s1_Lauder_20260320_L2Fit_fout2c6d20241202p1-8.txt File generation date: 20260704T071851.4Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 Local principal investigator: Richard Querel Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 272 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora272_OF_v3d20240829.txt Instrument calibration file used: Pandora272s1_CF_v6d20241202.txt Level 1 file used: Pandora272s1_Lauder_20260320_L1_smca1c6d20241202p1-8.txt Full location name: Lauder Atmospheric Research Station Short location name: Lauder Country of location: New Zealand Location latitude [deg]: -45.0380 Location longitude [deg]: 169.6840 Location altitude [m]: 370 Local noon date: 20260320 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: 196 338 Nominal wavelengths inside fitting window [nm]: 305.0455 305.1861 305.3267 305.4672 305.6077 305.7483 305.8888 306.0293 306.1697 306.3102 306.4507 306.5911 306.7315 306.8720 307.0124 307.1528 307.2931 307.4335 307.5739 307.7142 307.8545 307.9949 308.1352 308.2755 308.4158 308.5560 308.6963 308.8365 308.9768 309.1170 309.2572 309.3974 309.5376 309.6778 309.8179 309.9581 310.0982 310.2383 310.3784 310.5185 310.6586 310.7987 310.9388 311.0788 311.2189 311.3589 311.4989 311.6389 311.7789 311.9189 312.0589 312.1988 312.3388 312.4787 312.6186 312.7585 312.8984 313.0383 313.1782 313.3180 313.4579 313.5977 313.7375 313.8773 314.0171 314.1569 314.2967 314.4364 314.5762 314.7159 314.8556 314.9954 315.1351 315.2747 315.4144 315.5541 315.6937 315.8334 315.9730 316.1126 316.2522 316.3918 316.5314 316.6710 316.8105 316.9501 317.0896 317.2291 317.3686 317.5081 317.6476 317.7871 317.9265 318.0660 318.2054 318.3448 318.4842 318.6236 318.7630 318.9024 319.0417 319.1811 319.3204 319.4598 319.5991 319.7384 319.8777 320.0169 320.1562 320.2955 320.4347 320.5739 320.7131 320.8523 320.9915 321.1307 321.2699 321.4090 321.5482 321.6873 321.8264 321.9655 322.1046 322.2437 322.3828 322.5219 322.6609 322.7999 322.9390 323.0780 323.2170 323.3560 323.4949 323.6339 323.7729 323.9118 324.0507 324.1896 324.3285 324.4674 324.6063 324.7452 324.8840 --------------------------------------------------------------------------------------- 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 20260319T202250.3Z 9574.849193 420 1 50.03 2 73.43 73.13 85.00 74.84 0.00 1 0.00 1 0 17 5.855e-02 8.522e-03 6.895e-03 1.079e-03 4.041711e-01 5.487033e-04 5.016360e-03 -6.000000e+00 3.375839e-02 227.63 -2.00 3.69 -2.00 318.27 0.00e+00 7.059458e-04 1.033976e-04 3.184945e-04 -6.000000e+00 1.463391e-03 278.83 -2.00 20.00 -2.00 317.63 0.00e+00 3.452 0.000 302.00 328.00 3 3.0782e+00 1.4737e-03 3.9477e-02 -6.0000e+00 8.3966e-02 1.7900e-02 1.6694e-03 2.1877e-02 -6.0000e+00 9.1010e-02 -1.6125e-02 1.1280e-03 1.0828e-02 -6.0000e+00 5.4088e-02 5.8709e-03 5.9324e-04 3.1525e-03 -6.0000e+00 2.3100e-02 5.6788e-04 7.4025e-05 3.0538e-05 3.3609e-05 -6.0000e+00 1.6092e-03 8.7031e-03 0.0000e+00 12 9 1 12 1 1 99.82 25.36 0.24 0.00870 0.00926 77 9 2 8 0 641.300 19.99 25.36 19.30 35.25 34.00 1.0 960.53 -8132 -3797 -18886 -4149 23654 -14737 -18258 -27528 -9743 -30626 -23910 -17028 -2156 -6716 -4285 -186 -6144 1490 -4008 1936 -3049 2823 -2784 1514 1818 2963 -1014 4004 2247 -3946 -1968 2724 1760 5768 -8256 1023 -4032 -3615 -225 1288 -747 2028 -343 1206 1216 1258 1432 1186 -2247 935 1740 742 1399 796 1287 462 918 -95 -522 1365 1966 1847 1722 2551 588 -496 830 -1497 222 617 610 637 72 750 -24 -504 -712 -1963 -1339 -1149 -1539 -1067 -2013 -2637 -1561 -640 -192 63 862 485 485 -66 -297 -252 -378 -242 -89 1129 672 670 -81 -1074 -1874 -585 -483 -872 -608 -400 -309 247 662 616 295 333 22 -56 -246 305 113 495 199 138 586 400 796 601 -136 443 407 154 472 -34 -90 -273 -177 5 -161 321 188 -63 -254 -505 -868 -355 -179 -1093 -199 774 -690 -951 -1764 -588 -2458 -1829 -1294 -165 -644 -475 -21 -784 188 -568 271 -459 401 -434 243 309 524 -190 683 368 -700 -379 558 406 1357 -2133 236 -1071 -1018 -74 460 -305 854 -154 546 552 576 654 541 -1067 441 813 383 768 440 746 278 564 -59 -320 811 1190 1205 1163 1873 428 -369 578 -1059 163 481 500 551 63 629 -20 -380 -521 -1395 -991 -910 -1322 -973 -2023 -2669 -1670 -694 -219 74 1021 562 523 -69 -306 -252 -399 -271 -107 1446 901 903 -105 -1353 -2292 -700 -595 -1097 -799 -556 -437 359 999 971 463 498 31 -79 -342 437 165 768 305 209 898 593 1163 843 -192 615 580 231 728 -56 -146 -462 -306 8 -293 597 356 -118 -452 -894 -1487 SS 20260319T211246.5Z 9574.883871 458 1 3.18 2 65.26 63.02 77.13 65.62 0.00 1 0.00 1 0 17 1.615e-02 7.873e-03 8.577e-03 3.728e-03 2.821866e-01 1.900700e-03 3.555191e-03 -6.000000e+00 9.315111e-03 227.63 -2.00 3.69 -2.00 316.54 0.00e+00 8.841428e-04 2.256136e-04 6.329495e-05 -6.000000e+00 4.037057e-04 278.83 -2.00 20.00 -2.00 315.92 0.00e+00 2.374 0.000 302.00 328.00 3 3.7244e+00 4.9457e-03 2.7239e-02 -6.0000e+00 2.3169e-02 2.1492e-02 5.5205e-03 1.5174e-02 -6.0000e+00 2.5111e-02 -6.2615e-03 3.2300e-03 7.4414e-03 -6.0000e+00 1.4923e-02 2.3367e-04 1.5449e-03 2.1975e-03 -6.0000e+00 6.3757e-03 9.4641e-04 4.4827e-04 1.0622e-04 2.5001e-05 -6.0000e+00 4.4390e-04 6.6325e-03 0.0000e+00 12 9 1 12 1 1 -248.65 25.37 0.09 0.00663 0.01000 3 7 1 8 0 792.950 20.00 25.37 22.14 35.25 33.75 0.9 971.95 -2113 3169 -2756 796 -7826 -4420 -790 -5778 -842 -5579 -3359 -2243 -2633 -3332 360 1842 563 1106 1168 3151 88 139 371 595 667 3515 -35 452 860 -896 -775 404 2857 2095 -3253 -1710 -3861 -2922 -412 917 -1161 1503 -241 479 -461 -335 78 1351 -3207 -140 1447 849 786 1307 899 930 363 471 -323 608 534 87 1681 1950 1124 -361 231 -686 493 265 485 -42 369 478 212 82 -1190 -776 -1542 -450 -765 -1009 -1729 -2512 -1199 -1119 -417 524 427 750 191 693 -940 298 -188 -570 -111 992 875 437 91 -784 -2060 -240 -127 -514 -312 -37 -565 528 -19 670 344 212 -15 -522 -6 -35 196 1012 168 41 745 329 224 493 167 381 828 -252 278 -30 -478 -175 153 -40 -2 493 174 -287 -299 -674 -625 -334 525 -500 132 -1254 -657 -120 -1020 -157 -1063 -680 -424 -564 -829 99 514 168 342 377 1035 30 47 130 204 239 1272 -13 162 306 -322 -275 153 1148 886 -1369 -688 -1727 -1391 -214 523 -705 932 -157 316 -306 -222 51 852 -2084 -89 949 602 559 980 668 705 282 366 -248 458 413 72 1425 1693 998 -318 189 -577 405 234 454 -41 368 460 201 74 -1024 -626 -1285 -395 -726 -1022 -1826 -2690 -1351 -1304 -510 634 524 894 221 759 -1002 311 -196 -630 -131 1244 1143 572 118 -952 -2439 -278 -153 -665 -407 -51 -789 748 -29 1007 508 306 -20 -694 -7 -47 269 1425 246 61 1062 471 303 658 220 493 1085 -347 403 -44 -719 -261 240 -65 -4 812 292 -476 -478 -1080 -968 SS 20260319T212413.4Z 9574.891821 466 1 54.50 2 63.48 60.54 75.39 63.40 0.00 1 0.00 1 0 17 2.015e-02 8.522e-03 3.054e-03 1.228e-03 2.668175e-01 6.255581e-04 3.369270e-03 -6.000000e+00 1.161604e-02 227.63 -2.00 3.69 -2.00 316.67 0.00e+00 4.843435e-04 7.640435e-05 1.288516e-04 -6.000000e+00 5.035815e-04 278.83 -2.00 20.00 -2.00 316.03 0.00e+00 2.227 0.000 302.00 328.00 3 4.6898e+00 1.6328e-03 2.5633e-02 -6.0000e+00 2.8892e-02 3.3433e-02 1.8244e-03 1.4350e-02 -6.0000e+00 3.1316e-02 -6.9782e-03 1.0750e-03 7.0629e-03 -6.0000e+00 1.8612e-02 1.9255e-03 5.1799e-04 2.0138e-03 -6.0000e+00 7.9481e-03 4.2094e-04 5.8635e-05 3.5209e-05 2.2998e-05 -6.0000e+00 5.5375e-04 9.2396e-03 0.0000e+00 11 8 0 10 0 0 99.99 25.37 0.25 0.00924 0.00968 57 6 1 8 0 956.010 20.01 25.37 23.32 35.25 33.75 0.9 978.47 114 523 -2828 -1733 9328 -3608 -4462 -9824 -743 -7903 -6193 -5117 -769 -1480 -390 810 -3440 2273 -976 2427 -476 2345 -628 1589 415 2359 21 2358 1101 -1294 -499 1776 1342 3552 -6001 -7 -2985 -2601 -247 1005 -1114 954 -531 587 122 435 401 257 -2661 316 1589 1168 1014 611 785 160 980 -202 -679 1424 1651 1534 1130 1977 155 -568 934 -1454 416 616 565 589 13 884 7 -189 -582 -1751 -1647 -827 -1403 -885 -2015 -2866 -1567 -635 -240 337 828 243 419 -251 -263 -193 -365 -132 -1 1180 803 223 -111 -859 -1987 -415 -241 -760 -431 -330 -417 689 737 530 341 529 106 -106 -427 234 -34 636 193 -21 724 495 918 580 -235 217 132 29 448 -129 10 -304 49 92 -148 388 208 -167 -287 -651 -900 16 78 -450 -257 1208 -509 -672 -1570 -120 -1461 -1118 -936 -151 -335 -100 227 -1055 684 -290 720 -148 704 -199 519 144 831 8 792 347 -411 -167 623 512 1380 -2417 -2 -1229 -1133 -125 552 -689 606 -354 392 82 289 263 165 -1722 198 1035 819 702 449 599 125 774 -161 -535 1088 1290 1201 964 1796 137 -499 750 -1159 337 560 536 589 14 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