File name: Pandora127s1_Mainz-MPIC_20250927_L2Fit_fout2c7d20250721p1-8.txt
File generation date: 20251006T142445.7Z
Data description: Level 2 spectral fitting results file
Data file version: fout2c7p1-8
Local principal investigator: Thomas Wagner
Network principal investigator: Alexander Cede
Instrument type: Pandora
Instrument number: 127
Spectrometer number: 1
Processing software version used: BlickP v1.8.75
Instrument operation file used: Pandora127_OF_v4d20210611.txt
Instrument calibration file used: Pandora127s1_CF_v7d20250721.txt
Level 1 file used: Pandora127s1_Mainz-MPIC_20250927_L1_smca1c7d20250721p1-8.txt
Full location name: Max-Planck-Institute for Chemistry, Mainz
Short location name: Mainz-MPIC
Country of location: Germany
Location latitude [deg]: 49.9910
Location longitude [deg]: 8.2280
Location altitude [m]: 125
Local noon date: 20250927
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: 223 365
Nominal wavelengths inside fitting window [nm]: 305.0738 305.2143 305.3549 305.4955 305.6360 305.7765 305.9170 306.0575 306.1980 306.3385 306.4790 306.6194 306.7599 306.9003 307.0408 307.1812 307.3216 307.4620 307.6023 307.7427 307.8830 308.0234 308.1637 308.3040 308.4443 308.5846 308.7249 308.8652 309.0054 309.1457 309.2859 309.4262 309.5664 309.7066 309.8468 309.9869 310.1271 310.2672 310.4074 310.5475 310.6876 310.8277 310.9678 311.1079 311.2480 311.3881 311.5281 311.6681 311.8082 311.9482 312.0882 312.2282 312.3681 312.5081 312.6481 312.7880 312.9279 313.0679 313.2078 313.3477 313.4875 313.6274 313.7673 313.9071 314.0470 314.1868 314.3266 314.4664 314.6062 314.7460 314.8857 315.0255 315.1652 315.3050 315.4447 315.5844 315.7241 315.8638 316.0034 316.1431 316.2828 316.4224 316.5620 316.7016 316.8412 316.9808 317.1204 317.2600 317.3995 317.5391 317.6786 317.8181 317.9576 318.0971 318.2366 318.3761 318.5155 318.6550 318.7944 318.9338 319.0733 319.2127 319.3521 319.4914 319.6308 319.7702 319.9095 320.0488 320.1881 320.3275 320.4667 320.6060 320.7453 320.8846 321.0238 321.1631 321.3023 321.4415 321.5807 321.7199 321.8591 321.9982 322.1374 322.2765 322.4157 322.5548 322.6939 322.8330 322.9721 323.1111 323.2502 323.3892 323.5283 323.6673 323.8063 323.9453 324.0843 324.2233 324.3622 324.5012 324.6401 324.7791 324.9180
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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
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SS 20250927T080646.0Z 9401.338033 130 1 48.65 2 65.95 125.79 120.55 96.27 0.00 1 0.00 1 0 17 4.098e-02 8.059e-03 4.000e-02 5.517e-03 3.267138e-01 2.739473e-03 4.168863e-03 -6.000000e+00 2.290806e-02 227.16 -2.00 3.76 -2.00 318.91 0.00e+00 3.484917e-04 6.036464e-04 4.974955e-04 -6.000000e+00 9.994085e-04 279.34 -2.00 20.00 -2.00 318.24 0.00e+00 2.436 0.000 302.00 328.00 3 5.5166e+00 7.5094e-03 3.0078e-02 -6.0000e+00 5.6949e-02 3.6040e-02 8.6246e-03 1.8201e-02 -6.0000e+00 6.1886e-02 1.0513e-02 6.0746e-03 9.0345e-03 -6.0000e+00 3.6789e-02 -1.3389e-02 3.2030e-03 2.5848e-03 -6.0000e+00 1.5781e-02 1.2810e-04 -8.1946e-05 1.5589e-04 2.6367e-05 -6.0000e+00 1.0421e-03 2.8764e-03 0.0000e+00 11 9 0 11 8 0 99.78 20.51 0.42 0.00288 0.00226 24 6 1 8 0 2026.970 19.82 20.51 22.66 25.39 25.28 0.1 961.94 4736 -7471 -2 -18162 14969 -17780 -822 20211 -1458 -7132 -14459 209 5340 -17168 -9313 -558 147 -1107 3443 826 3307 -3211 -3625 -749 -1748 2030 3147 -1535 -564 447 1374 301 2385 -3061 1791 -4782 -4722 -674 -3064 1989 -802 1609 483 284 -1621 961 435 177 -698 -47 -387 1113 180 2083 545 189 -568 500 247 -181 903 1113 2889 3954 1358 793 -879 -1170 562 177 384 429 347 224 228 -581 -714 -2684 -3137 -603 -1806 -1327 -3079 -885 -1339 -130 1469 117 870 965 428 705 -1381 -1447 -210 21 682 868 612 -420 136 -757 -1253 -831 -1335 -797 -639 -401 -275 1114 925 180 746 369 -223 -581 133 200 -225 39 232 100 703 41 499 -320 -580 976 383 83 -148 -747 -611 -538 167 264 260 679 139 87 -77 -498 -541 187 -364 0 -948 509 -803 -34 785 -78 -426 -921 12 340 -1590 -930 -57 16 -126 395 101 405 -413 -481 -104 -263 308 471 -227 -78 61 202 50 425 -593 311 -863 -929 -151 -852 614 -280 575 180 107 -621 362 163 66 -259 -18 -155 477 83 993 272 97 -301 263 127 -92 470 622 1743 2541 906 496 -517 -679 344 125 295 344 278 173 165 -380 -425 -1557 -1925 -410 -1398 -1132 -2857 -844 -1364 -140 1646 136 1010 1088 455 688 -1265 -1284 -196 22 775 1089 825 -569 174 -893 -1386 -930 -1633 -1024 -856 -558 -403 1718 1520 305 1231 578 -324 -799 180 281 -338 62 377 162 1098 62 722 -449 -772 1269 538 126 -238 -1246 -1036 -942 307 511 514 1361 284 175 -149 -929 -982
SS 20250927T090859.7Z 9401.381247 165 1 12.20 2 58.71 141.37 111.23 106.99 0.00 1 0.00 1 0 17 1.333e-02 7.324e-03 5.094e-03 1.899e-03 2.600792e-01 9.424941e-04 3.366301e-03 -6.000000e+00 7.450985e-03 227.16 -2.00 3.76 -2.00 316.88 0.00e+00 3.482264e-04 1.203437e-04 1.395722e-04 -6.000000e+00 3.250490e-04 279.34 -2.00 20.00 -2.00 316.22 0.00e+00 1.918 0.000 302.00 328.00 3 3.8660e+00 2.4648e-03 2.3693e-02 -6.0000e+00 1.8523e-02 2.8827e-02 2.7639e-03 1.4247e-02 -6.0000e+00 2.0128e-02 -3.5317e-03 1.6451e-03 7.0352e-03 -6.0000e+00 1.1966e-02 -2.8314e-03 8.0803e-04 1.9945e-03 -6.0000e+00 5.1332e-03 1.2231e-03 -9.3420e-05 5.1477e-05 2.1274e-05 -6.0000e+00 3.3893e-04 2.2880e-03 0.0000e+00 12 9 1 12 1 1 96.06 20.60 0.24 0.00229 0.00159 14 14 1 8 0 812.730 20.00 20.60 23.83 25.47 25.39 0.0 969.35 -1251 -876 -1405 -4026 -5961 -2765 -3002 -2168 -3336 -1330 -4211 -2935 143 -1408 1816 731 -52 1059 2302 2002 960 722 1307 911 932 663 -309 -1006 -1355 -849 277 770 441 -1821 -3569 -2362 -3256 -1387 420 -639 -154 -219 -60 -382 68 -328 -642 -251 -954 214 1188 1069 796 1168 19 890 554 899 610 483 1071 1748 1864 2448 710 -184 -752 -704 942 586 347 975 -28 1065 9 -562 -1301 -1690 -1099 -1135 -1648 -1623 -2685 -1832 -751 -597 407 -240 571 238 589 -110 -180 -242 -336 -16 217 1085 561 351 -195 -886 -792 -235 -815 -954 -626 -735 176 472 854 572 576 175 -87 63 -261 -305 196 83 -137 491 471 552 874 392 -434 380 273 472 330 -483 -74 -184 -105 -55 142 326 -20 -118 -135 -523 -660 -165 -125 -205 -556 -740 -318 -370 -303 -526 -214 -681 -481 26 -297 425 189 -14 294 656 594 293 218 399 296 321 238 -111 -340 -427 -261 90 270 155 -673 -1352 -856 -1192 -587 211 -350 -92 -136 -38 -246 43 -211 -405 -153 -574 127 740 718 568 811 14 652 416 668 444 348 789 1377 1600 2088 618 -159 -598 -541 758 542 330 963 -28 1012 8 -486 -1016 -1342 -837 -980 -1507 -1642 -2936 -1942 -841 -719 483 -297 702 285 691 -118 -187 -240 -353 -17 261 1353 756 470 -245 -1090 -908 -275 -1049 -1229 -838 -1030 242 692 1321 860 883 251 -121 81 -334 -406 278 120 -204 721 672 803 1201 516 -576 493 356 665 492 -706 -109 -280 -169 -90 236 554 -35 -200 -221 -823 -1061
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