File name: Pandora141s1_Calakmul_20250704_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20250705T061036.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 141 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora141_OF_v2d20230802.txt Instrument calibration file used: Pandora141s1_CF_v3d20231011.txt Level 1 file used: Pandora141s1_Calakmul_20250704_L1_smca1c3d20231011p1-8.txt Full location name: Calakmul Atmospheric Observatory Short location name: Calakmul Country of location: Mexico Location latitude [deg]: 18.5956 Location longitude [deg]: -89.4137 Location altitude [m]: 275 Local noon date: 20250704 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: OoB session based on session 2 First and last pixel inside fitting window: 238 379 Nominal wavelengths inside fitting window [nm]: 305.1074 305.2483 305.3892 305.5302 305.6711 305.8120 305.9528 306.0937 306.2346 306.3754 306.5163 306.6571 306.7979 306.9387 307.0795 307.2203 307.3611 307.5018 307.6426 307.7833 307.9240 308.0647 308.2054 308.3461 308.4868 308.6275 308.7681 308.9088 309.0494 309.1900 309.3306 309.4712 309.6118 309.7524 309.8930 310.0335 310.1741 310.3146 310.4551 310.5956 310.7361 310.8766 311.0171 311.1575 311.2980 311.4384 311.5788 311.7192 311.8596 312.0000 312.1404 312.2808 312.4211 312.5615 312.7018 312.8421 312.9824 313.1227 313.2630 313.4033 313.5435 313.6838 313.8240 313.9643 314.1045 314.2447 314.3849 314.5251 314.6652 314.8054 314.9455 315.0857 315.2258 315.3659 315.5060 315.6461 315.7862 315.9262 316.0663 316.2063 316.3463 316.4864 316.6264 316.7664 316.9063 317.0463 317.1863 317.3262 317.4662 317.6061 317.7460 317.8859 318.0258 318.1657 318.3055 318.4454 318.5852 318.7250 318.8649 319.0047 319.1445 319.2842 319.4240 319.5638 319.7035 319.8433 319.9830 320.1227 320.2624 320.4021 320.5418 320.6814 320.8211 320.9607 321.1003 321.2400 321.3796 321.5192 321.6588 321.7983 321.9379 322.0774 322.2170 322.3565 322.4960 322.6355 322.7750 322.9145 323.0539 323.1934 323.3328 323.4723 323.6117 323.7511 323.8905 324.0299 324.1692 324.3086 324.4479 324.5873 324.7266 324.8659 --------------------------------------------------------------------------------------- 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 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: 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 20250704T124848.1Z 9316.533890 99 1 31.05 2 72.54 71.15 175.76 323.48 0.00 1 0.00 1 0 25 2.810e-01 1.685e-02 2.718e-01 1.617e-02 4.131249e-01 8.899372e-03 4.478915e-03 -6.000000e+00 1.719094e-01 227.94 -2.00 3.11 -2.00 319.83 0.00e+00 2.229358e-04 2.729872e-03 7.288496e-04 -6.000000e+00 7.900482e-03 293.78 -2.00 20.00 -2.00 318.99 0.00e+00 3.284 0.000 302.00 328.00 3 6.5754e+00 2.6014e-02 3.7171e-02 -6.0000e+00 4.2522e-01 3.8315e-02 3.1212e-02 2.0100e-02 -6.0000e+00 4.5753e-01 -4.3057e-02 2.3537e-02 9.6113e-03 -6.0000e+00 2.7444e-01 1.8503e-02 1.2253e-02 2.9004e-03 -6.0000e+00 1.1969e-01 1.8699e-05 -1.8634e-03 5.3720e-04 3.6341e-05 -6.0000e+00 8.7357e-03 -4.8777e-02 -1.9172e-04 12 9 8 11 8 0 99.99 19.87 0.61 -0.04878 -0.06278 8 8 1 5 0 3880.120 26.00 19.97 19.87 32.70 40.7 985.64 900000 114475 101212 55919 -62579 -51875 -71523 -55415 59549 49406 78883 187671 35862 69498 42623 9837 -14835 -9708 7721 -10693 7649 20512 34292 -26391 31741 -26079 -10050 9562 18908 6742 35997 4095 -14958 17212 -17656 19514 16768 11953 -15859 -1483 400 -6618 -4136 -1974 135 -5050 -2198 7336 -4994 -1077 4054 4950 -5533 4973 -2595 9207 -3880 2479 5395 6071 6557 3358 1750 -1732 2560 1375 728 4228 3181 3635 4269 -682 -2050 -690 -1255 -599 5168 -668 -914 -1820 -2262 -2750 -1816 -1209 -1246 -620 -302 -673 -1542 -1500 -3036 1034 3790 6739 2086 -954 -277 1514 1011 -1757 -1132 361 -1653 1836 -2438 306 -2657 1032 -703 886 -478 -1188 1040 710 -701 1358 1447 -685 -235 -456 464 522 229 1465 215 -858 849 -113 531 1303 357 -610 1256 -1020 -129 -638 222 720 -1828 -42 799 -178 900000 1805 1596 882 -2226 -1625 -2856 -2135 939 846 1244 2959 893 1492 1372 485 -1001 -666 474 -815 505 1216 1842 -2676 1991 -2945 -979 750 1322 537 2360 406 -1947 1719 -2413 1880 1794 1564 -3218 -305 89 -1685 -1069 -509 34 -1359 -576 1757 -1363 -293 1123 1475 -1962 1694 -994 3263 -1589 957 2002 2230 2477 1403 813 -890 1289 678 347 1961 1603 2029 2574 -450 -1371 -439 -749 -325 2469 -331 -483 -1094 -1541 -2085 -1472 -1034 -1133 -595 -303 -699 -1611 -1521 -2944 902 3045 5269 1815 -947 -304 1801 1281 -2281 -1391 407 -1815 1980 -2889 374 -3502 1386 -1019 1360 -785 -2016 1707 1118 -1057 1929 2052 -1026 -368 -747 765 850 365 2231 319 -1237 1173 -161 801 2103 616 -1105 2316 -2004 -264 -1368 484 1589 -4129 -91 1668 -361 SS 20250704T131724.3Z 9316.553754 114 1 29.89 2 66.10 72.64 174.76 51.17 0.00 1 0.00 1 0 17 2.912e-01 2.608e-02 1.984e-01 2.082e-02 3.190612e-01 1.127406e-02 3.416605e-03 -6.000000e+00 1.780655e-01 227.94 -2.00 3.11 -2.00 318.88 0.00e+00 -9.407678e-05 2.539332e-03 1.258784e-04 -6.000000e+00 8.185505e-03 293.78 -2.00 20.00 -2.00 317.96 0.00e+00 2.450 0.000 302.00 328.00 3 7.6538e+00 3.0964e-02 2.7837e-02 -6.0000e+00 4.4045e-01 4.2692e-02 3.5712e-02 1.4874e-02 -6.0000e+00 4.7397e-01 1.7085e-03 2.4089e-02 7.2891e-03 -6.0000e+00 2.8430e-01 -4.8471e-03 1.2592e-02 2.1216e-03 -6.0000e+00 1.2395e-01 1.5485e-05 -1.7293e-03 6.9142e-04 2.7145e-05 -6.0000e+00 9.0527e-03 -4.7757e-02 -2.4384e-04 12 8 8 10 0 0 99.96 19.87 0.78 -0.04776 -0.06075 8 8 1 5 0 3735.320 26.11 20.00 19.87 32.92 40.2 985.81 900000 21577 142485 -24225 247707 22546 69597 1123 27851 208 -28413 -21840 3465 112018 39982 43121 -6908 -24161 -9536 1242 -1371 1698 24230 3292 -996 14608 -27352 42616 12456 28996 11643 6647 5516 -244 20088 5068 -16125 -9610 -2738 -7023 2929 883 6039 45 -2112 3393 6523 13402 -15221 -2756 -6561 -1187 4425 6843 2584 -5377 6945 1706 1344 -4127 7178 -594 -1870 -3078 -1543 6924 -3217 6899 1762 -1617 -2779 -94 -3422 -618 2951 -5703 982 227 7702 2190 2136 -561 -1402 2117 -3394 -142 -3083 562 303 3475 -2457 -1094 5290 -3304 1976 -1748 6160 -510 1966 -1351 -1396 -309 -414 3468 54 391 -3725 -74 296 1490 -878 -1139 1091 -1525 1301 852 -52 4793 -3701 1759 -2148 250 -1520 3986 652 1211 -2332 2438 -842 -327 -70 -2276 -1614 391 -1348 1133 2301 -1699 208 1841 -531 -332 900000 869 2892 -1477 5028 803 1692 57 1229 13 -2289 -1739 244 3317 2629 3041 -830 -3590 -1289 158 -183 222 2632 461 -154 2023 -5617 4351 1623 3224 1614 1057 957 -46 3047 885 -3716 -2425 -766 -2354 981 319 2147 17 -825 1257 2324 4420 -6579 -1080 -2812 -518 1954 3108 1268 -2929 3423 883 690 -2231 3596 -342 -1180 -2074 -1032 4079 -1977 3826 1094 -1148 -2159 -75 -2792 -474 2049 -3932 586 132 4389 1463 1595 -472 -1275 1969 -3531 -152 -3567 646 349 3764 -2641 -1077 4588 -3067 1838 -1847 6687 -643 2553 -1799 -1766 -360 -466 3840 65 499 -5167 -103 438 2317 -1461 -1928 1767 -2395 1869 1173 -72 6580 -5796 2747 -3548 400 -2412 5812 942 1665 -3212 3248 -1222 -505 -114 -3884 -2816 697 -2564 2199 4544 -3534 427 3648 -1042 -630 SS 20250704T132551.4Z 9316.559622 120 1 30.30 2 64.18 73.04 173.17 62.03 0.00 1 0.00 1 0 25 3.266e-01 4.458e-02 2.164e-01 4.100e-02 2.770488e-01 2.204316e-02 2.955740e-03 -6.000000e+00 2.004867e-01 227.94 -2.00 3.11 -2.00 318.50 0.00e+00 -2.187993e-03 4.345809e-03 2.091646e-04 -6.000000e+00 9.221766e-03 293.78 -2.00 20.00 -2.00 317.55 0.00e+00 2.282 0.000 302.00 328.00 3 8.5127e+00 5.9709e-02 2.5376e-02 -6.0000e+00 4.9551e-01 1.8532e-02 6.8184e-02 1.2869e-02 -6.0000e+00 5.3340e-01 -2.6884e-02 4.2449e-02 6.4253e-03 -6.0000e+00 3.1934e-01 1.9285e-02 2.1475e-02 2.5058e-03 -6.0000e+00 1.3792e-01 8.4510e-06 -9.2029e-04 1.3773e-03 2.9125e-05 -6.0000e+00 1.0105e-02 -4.3561e-02 -4.5904e-04 12 9 8 11 8 0 99.69 19.87 2.19 -0.04356 -0.05048 14 14 1 5 0 2163.520 26.00 19.97 19.87 32.90 40.7 985.92 -52310 31549 2299 196688 -37922 900000 -15702 -51556 28953 -49830 2831 46582 262553 -26498 71380 14624 -5839 -6476 -15635 19902 -7450 38597 35904 16012 13364 -9643 8076 17010 54927 -33716 16003 6188 15564 12334 -13769 28297 -279 10108 -17667 39576 -5383 -4380 -1631 14087 10312 8759 22759 -14175 17471 -5123 16133 -12433 904 668 -2106 12089 -5817 1708 -3467 9972 2219 6328 8730 -6763 3057 -5180 5890 -621 1886 -3817 1169 -1831 3397 1301 -6125 5413 -2900 5293 -813 1225 472 2204 562 -4233 -6503 -9179 933 -4676 426 572 -3461 3596 -5008 14132 4161 3330 -2028 -1418 -446 -558 219 896 9569 3295 2601 -6226 3752 -2405 2125 172 -656 2911 1751 727 -3714 -891 -362 -1570 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