File name: Pandora272s1_Lauder_20260203_L2Fit_fout2c6d20241202p1-8.txt File generation date: 20260704T070413.4Z 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_20260203_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: 20260203 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 20260202T225601.8Z 9529.955576 680 1 54.57 2 37.81 50.86 132.35 243.07 0.00 1 0.00 1 0 17 8.943e-03 7.527e-03 1.124e-03 8.273e-04 1.638235e-01 4.349609e-04 2.076412e-03 -6.000000e+00 5.230461e-03 231.36 -2.00 3.69 -2.00 314.53 0.00e+00 2.444806e-04 3.333878e-05 3.434379e-05 -6.000000e+00 2.240044e-04 279.34 -2.00 20.00 -2.00 314.03 0.00e+00 1.265 0.000 302.00 328.00 3 5.0760e+00 1.1187e-03 1.5059e-02 -6.0000e+00 1.3125e-02 3.8558e-02 1.2336e-03 8.9012e-03 -6.0000e+00 1.4182e-02 -4.0482e-03 7.0635e-04 4.3282e-03 -6.0000e+00 8.4058e-03 -6.6671e-04 3.0785e-04 1.1993e-03 -6.0000e+00 3.5660e-03 8.4513e-04 1.9264e-04 2.3407e-05 1.6512e-05 -6.0000e+00 2.4598e-04 4.4533e-03 0.0000e+00 11 8 0 10 0 0 99.40 25.37 0.27 0.00445 0.00590 74 8 1 8 0 737.380 20.01 25.37 20.18 35.25 33.75 1.0 964.48 -219 -246 -73 -832 468 -1002 -1773 -1193 701 -1461 -1692 -987 -482 -37 285 503 -678 766 259 968 687 686 1143 954 505 1445 105 435 -37 218 184 1784 1269 952 -3416 -1383 -2636 -2162 -226 29 -960 -85 -884 113 -627 230 -178 -510 -1518 -434 754 586 988 952 546 654 815 436 183 653 1220 1170 1318 1814 563 -306 120 -1403 59 580 664 726 368 769 271 -254 -549 -1200 -1458 -983 -1384 -1216 -1852 -2717 -1208 -538 -205 212 563 350 365 -185 -209 -331 -282 -62 351 1147 701 672 9 -806 -1688 -444 -93 -779 -636 -107 -351 271 687 474 237 394 83 -90 -368 132 128 586 197 200 635 374 695 493 -110 259 482 118 493 -5 -186 -453 52 75 -59 264 183 -37 -338 -597 -962 -84 -102 -28 -326 159 -326 -606 -444 282 -631 -716 -412 -201 -17 145 257 -360 407 142 541 391 385 646 563 290 847 63 258 -20 114 98 978 740 573 -2006 -764 -1589 -1386 -158 22 -775 -71 -759 97 -537 194 -147 -428 -1239 -343 607 500 831 838 497 601 720 386 168 592 1125 1087 1312 1810 568 -301 113 -1271 54 556 670 773 397 806 269 -241 -492 -1054 -1281 -892 -1333 -1224 -2012 -2961 -1381 -629 -253 259 697 423 427 -208 -222 -345 -297 -67 396 1359 856 818 11 -963 -1902 -495 -112 -969 -789 -138 -472 363 963 652 329 530 107 -107 -444 163 160 760 269 273 852 486 886 597 -133 302 582 144 629 -6 -239 -594 72 105 -85 374 266 -53 -489 -843 -1327 SS 20260202T230223.2Z 9529.959991 689 1 47.99 2 36.96 48.79 133.28 241.50 0.00 1 0.00 1 0 17 1.718e-02 1.147e-02 2.761e-03 1.868e-03 1.653938e-01 9.747184e-04 2.069677e-03 -6.000000e+00 1.004666e-02 231.36 -2.00 3.69 -2.00 314.96 0.00e+00 -2.156340e-04 8.078100e-05 7.409300e-05 -6.000000e+00 4.302926e-04 279.34 -2.00 20.00 -2.00 314.40 0.00e+00 1.250 0.000 302.00 328.00 3 6.4017e+00 2.5157e-03 1.4971e-02 -6.0000e+00 2.5210e-02 4.5373e-02 2.7830e-03 8.9164e-03 -6.0000e+00 2.7242e-02 -8.2310e-03 1.5923e-03 4.3417e-03 -6.0000e+00 1.6146e-02 4.5064e-03 7.0225e-04 1.2290e-03 -6.0000e+00 6.8492e-03 2.2673e-04 5.1934e-04 5.3027e-05 1.5666e-05 -6.0000e+00 4.7252e-04 4.9019e-03 0.0000e+00 12 8 8 10 0 0 99.47 25.36 0.37 0.00490 0.00880 12 1 1 8 0 3998.720 20.00 25.36 20.47 35.25 33.75 0.9 965.61 2377 -442 1590 564 6143 -1430 -3332 -6301 423 -5858 -4056 -934 1941 1011 -1217 1067 -4035 1995 -1228 989 842 2084 -232 2171 1373 2314 -962 1858 1529 -364 -1843 2584 529 2440 -6970 1204 -1829 -3273 688 1064 -1053 1478 -1149 116 -166 390 -145 -122 -3021 450 780 318 462 1215 52 313 1212 -374 -1198 1614 2275 1615 1574 1692 241 -1080 1063 -2328 959 666 696 955 288 1485 205 -633 -542 -1607 -2628 -1295 -2338 -594 -1965 -3159 -1885 -151 212 421 1095 -180 144 -671 -231 -646 -237 -518 -200 1287 670 2204 75 -926 -2576 -164 518 -909 -217 553 -312 280 1013 362 -85 871 710 -234 -900 37 -499 813 -183 123 942 29 1571 609 -850 -100 2 -175 662 -270 292 -691 -170 99 -64 297 481 227 -53 -780 -1054 770 -158 561 187 1684 -400 -994 -2127 147 -2280 -1514 -335 731 425 -531 491 -2000 945 -617 498 430 1038 -120 1144 756 1299 -559 980 737 -171 -903 1262 279 1296 -3792 581 -982 -2035 449 810 -831 1179 -964 97 -137 318 -116 -94 -2295 348 622 250 379 1035 46 280 1089 -341 -1081 1404 2012 1522 1486 1687 243 -1013 953 -2055 838 651 701 1012 310 1540 203 -611 -468 -1395 -2303 -1140 -2314 -593 -2130 -3612 -2125 -181 265 516 1352 -219 173 -786 -244 -638 -237 -561 -237 1557 872 2811 93 -1079 -3045 -190 608 -1154 -285 710 -420 392 1476 509 -124 1164 921 -283 -1063 44 -643 1052 -251 168 1256 37 2011 747 -1002 -121 2 -218 855 -363 395 -960 -232 143 -95 427 706 329 -79 -1140 -1502 SS 20260202T230713.6Z 9529.963352 692 1 9.06 2 36.32 47.16 133.98 240.29 0.00 1 0.00 1 0 17 8.544e-03 7.259e-03 2.340e-03 1.794e-03 1.624170e-01 9.456129e-04 2.060887e-03 -6.000000e+00 4.997464e-03 231.36 -2.00 3.69 -2.00 314.30 0.00e+00 1.757893e-04 6.945700e-05 2.838596e-05 -6.000000e+00 2.140072e-04 279.34 -2.00 20.00 -2.00 313.82 0.00e+00 1.240 0.000 302.00 328.00 3 4.7663e+00 2.4288e-03 1.4829e-02 -6.0000e+00 1.2540e-02 3.8993e-02 2.6758e-03 8.8220e-03 -6.0000e+00 1.3550e-02 -6.0812e-03 1.5324e-03 4.2925e-03 -6.0000e+00 8.0311e-03 2.7184e-04 6.6508e-04 1.1868e-03 -6.0000e+00 3.4075e-03 1.1829e-03 2.1615e-04 5.0757e-05 1.6191e-05 -6.0000e+00 2.3499e-04 3.7442e-03 0.0000e+00 12 9 1 12 1 1 87.66 25.37 0.26 0.00374 0.00537 7 5 1 8 0 1131.960 20.01 25.37 20.75 35.25 33.75 0.9 966.61 369 -948 277 -1066 258 -1663 -644 -371 145 -1598 -2270 -1141 280 -113 254 223 -319 287 700 1054 686 1226 1588 910 564 1398 65 112 -533 -95 54 1125 1287 609 -3168 -1331 -2477 -1794 -522 4 -648 -169 -685 450 -168 237 -647 -330 -1144 -461 585 238 530 1130 650 689 788 494 -43 1101 899 898 1375 1485 494 -77 -71 -1131 -226 757 398 797 322 809 53 -80 -573 -1165 -1001 -1230 -1541 -1283 -1617 -2579 -1169 -459 -74 334 689 480 164 -244 -319 -464 110 201 280 1162 520 495 86 -686 -1467 -709 -279 -627 -818 -307 -266 403 715 447 28 447 -70 -126 -544 336 333 509 136 337 448 211 1043 547 322 256 270 156 207 221 -62 -270 -63 65 -201 545 -95 -155 -356 -706 -760 148 -414 121 -440 99 -610 -244 -154 61 -724 -1011 -499 130 -55 128 122 -179 162 405 624 391 725 946 538 346 875 41 66 -309 -52 30 655 791 366 -1957 -775 -1483 -1152 -372 3 -538 -145 -605 396 -148 205 -552 -270 -950 -372 482 198 460 1019 580 622 719 452 -39 976 817 864 1354 1483 498 -75 -66 -1047 -202 716 401 844 346 845 55 -79 -526 -1040 -890 -1143 -1531 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