File name: Pandora141s1_Calakmul_20250225_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20250226T061739.7Z 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 v1.8.74 Instrument operation file used: Pandora141_OF_v2d20230802.txt Instrument calibration file used: Pandora141s1_CF_v3d20231011.txt Level 1 file used: Pandora141s1_Calakmul_20250225_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: 20250225 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 20250225T125519.3Z 9187.538417 101 1 60.33 2 82.41 102.07 63.35 130.23 0.00 1 0.00 1 0 17 6.629e-01 2.362e-02 3.992e-01 1.639e-02 7.450406e-01 1.042577e-02 7.543094e-03 -6.000000e+00 4.234024e-01 225.92 -2.00 3.11 -2.00 321.87 0.00e+00 -5.361400e-03 6.398442e-03 2.331176e-03 -6.000000e+00 2.075898e-02 290.85 -2.00 20.00 -2.00 321.35 0.00e+00 7.022 0.001 302.00 328.00 3 3.4710e+00 4.3035e-02 7.7620e-02 -6.0000e+00 1.0515e+00 2.3099e-01 6.2170e-02 4.2742e-02 -6.0000e+00 1.1453e+00 -5.1207e-01 5.6457e-02 2.0700e-02 -6.0000e+00 6.7310e-01 2.3956e-01 2.5277e-02 6.8676e-03 -6.0000e+00 2.9067e-01 1.0232e-05 -5.0193e-04 5.4718e-04 8.2044e-05 -6.0000e+00 2.2807e-02 -5.0975e-02 5.0384e-05 12 8 8 10 0 0 99.71 19.90 0.40 -0.05098 -0.05475 25 25 1 5 0 2412.900 26.00 20.02 19.90 25.62 38.9 984.62 900000 900000 900000 -97190 -89741 900000 900000 900000 -119210 -231066 -202746 -194014 56176 900000 -114992 -40197 900000 900000 121269 900000 -53665 -131942 900000 300302 -8760 -60160 273668 900000 -30079 900000 900000 -81554 900000 168724 900000 62711 900000 -20931 900000 -36817 162128 53112 7326 186372 -22322 -12217 5183 -1778 27359 55880 21050 28694 55220 -637 88123 2401 30363 16422 9423 10047 51097 11704 6704 -5721 10974 7433 17218 19901 5378 -1044 9527 1186 13513 11840 11066 7124 3833 -2066 8671 -1730 -5340 7841 3655 -3819 -5143 2118 -2025 1104 -7511 -2296 -120 -5692 5469 1059 5905 -136 1693 -593 -3013 -725 -2143 2901 1986 874 -4447 -2215 -2704 -719 -3794 1602 -1706 698 -2536 -1211 -659 987 1743 -700 -226 1559 1697 1106 953 1871 -1390 3444 2542 1164 983 47 -1064 -2108 1754 -832 1743 50 -183 118 -38 -363 -689 -787 900000 900000 900000 -1547 -1429 900000 900000 900000 -1898 -6547 -4741 -4699 894 900000 -2327 -640 900000 900000 1931 900000 -961 -5059 900000 4781 -139 -1596 4357 900000 -572 900000 900000 -3595 900000 2686 900000 999 900000 -815 900000 -2398 2581 1798 397 2967 -1620 -811 297 -112 1391 2348 1363 1935 3209 -68 4387 283 2846 1756 1051 1091 3856 1387 936 -996 1730 1224 2605 3093 1066 -249 2251 317 3198 2706 2347 1438 760 -446 1890 -489 -1822 2696 1445 -1745 -2543 1039 -1084 591 -4344 -1227 -60 -2857 2435 519 3097 -87 1233 -499 -2811 -671 -1911 2268 1470 655 -3695 -1917 -2498 -704 -4223 1902 -2305 981 -3743 -1736 -911 1313 2328 -995 -335 2338 2530 1609 1345 2549 -1899 4375 3236 1582 1492 82 -2029 -4343 3701 -1912 4154 127 -477 308 -99 -915 -1656 -1796 SS 20250225T131013.9Z 9187.548772 106 1 15.06 2 78.96 103.38 60.75 132.58 0.00 1 0.00 1 0 17 1.945e-01 5.854e-03 1.209e-01 3.179e-03 5.603470e-01 1.757703e-03 5.892269e-03 -6.000000e+00 1.181532e-01 225.92 -2.00 3.11 -2.00 320.31 0.00e+00 2.502666e-03 6.770542e-04 1.185258e-03 -6.000000e+00 5.372592e-03 290.85 -2.00 20.00 -2.00 319.60 0.00e+00 5.034 0.001 302.00 328.00 3 2.0960e+00 5.3930e-03 5.4936e-02 -6.0000e+00 2.9121e-01 4.7023e-03 6.8556e-03 2.6650e-02 -6.0000e+00 3.1377e-01 -6.0621e-03 6.1264e-03 1.4102e-02 -6.0000e+00 1.8820e-01 -5.0805e-03 3.1046e-03 4.7359e-03 -6.0000e+00 8.1780e-02 2.8366e-04 -7.1495e-04 9.7545e-05 6.4017e-05 -6.0000e+00 6.0058e-03 -5.0808e-02 -6.1679e-05 12 1 1 12 1 1 99.17 19.88 0.22 -0.05081 -0.05618 39 159 1 5 0 376.370 26.00 20.00 19.88 25.82 38.7 984.79 -86027 -67325 -66017 -57907 12740 -110743 -32076 -66098 25957 -54965 -43079 -72714 -37063 4145 -5909 9525 -15371 3591 -4628 6358 -949 -6014 -3203 -18956 7862 -9198 2715 -9414 1828 1927 165 -2194 1457 2046 -5522 1210 -9027 -2643 -1792 -6200 -2103 -499 3485 37 1015 -749 649 -24 -366 -343 -383 4038 406 2444 1607 595 441 -1310 -721 -990 2762 1410 2082 2462 1542 -28 1026 682 470 2742 361 1496 10 -279 101 -1144 -1078 -870 -844 -1418 -1009 -1854 -1664 -1276 -1214 -449 88 660 54 827 568 535 215 106 141 505 140 31 24 -329 -313 -1210 218 -254 -702 -977 -551 -550 606 790 228 72 225 -368 335 725 762 475 319 -139 -286 -43 -198 34 -48 34 184 851 261 -154 -468 -604 -282 -4 -179 -160 339 97 75 -257 248 -24 -824 -626 -651 -522 59 -1591 -226 -745 145 -681 -510 -1311 -574 54 -105 172 -403 86 -130 170 -28 -193 -105 -785 270 -397 106 -409 71 80 8 -128 93 138 -401 83 -755 -247 -185 -789 -290 -73 518 6 163 -125 109 -4 -67 -67 -82 916 105 667 469 183 140 -423 -228 -314 878 497 753 975 643 -12 419 287 218 1402 207 887 6 -160 53 -557 -493 -400 -426 -834 -635 -1329 -1303 -1065 -1010 -395 81 621 51 748 520 459 178 90 131 499 159 38 31 -425 -382 -1364 243 -287 -790 -1173 -697 -743 829 1188 354 117 364 -576 521 1085 1143 745 528 -227 -468 -69 -323 53 -73 50 263 1253 424 -264 -870 -1127 -551 -9 -375 -349 760 221 169 -567 520 -50 SS 20250225T131601.2Z 9187.552792 109 1 60.28 2 77.63 103.91 59.76 133.54 0.00 1 0.00 1 0 25 1.773e-01 5.632e-03 1.564e-01 2.988e-03 5.185541e-01 1.653644e-03 5.502001e-03 -6.000000e+00 1.076950e-01 225.92 -2.00 3.11 -2.00 320.42 0.00e+00 1.346092e-03 6.493295e-04 1.505496e-03 -6.000000e+00 4.896320e-03 290.85 -2.00 20.00 -2.00 319.71 0.00e+00 4.532 0.000 302.00 328.00 3 3.4432e+00 5.1423e-03 5.0065e-02 -6.0000e+00 2.6544e-01 -8.8650e-03 6.5347e-03 2.5647e-02 -6.0000e+00 2.8598e-01 1.7776e-02 5.7594e-03 1.2921e-02 -6.0000e+00 1.7154e-01 -1.4672e-02 2.9047e-03 3.7112e-03 -6.0000e+00 7.4547e-02 1.2199e-04 -2.7764e-04 9.5221e-05 5.5295e-05 -6.0000e+00 5.4727e-03 -5.0078e-02 6.9953e-06 11 1 0 11 8 0 99.99 19.89 0.18 -0.05008 -0.05216 90 90 1 5 0 669.650 26.00 20.00 19.89 25.84 38.7 984.96 -73871 109798 -54570 31784 -59550 -139 74034 -54012 33630 -42834 34734 -51890 -655 -2679 -14396 9084 -10885 1992 -9088 4868 -20257 17953 -6165 -7611 4493 -3978 -8634 -16630 2928 -232 7291 -2630 -2994 -1334 -7998 -651 -8474 4804 -3721 1980 -788 611 -1621 -2133 272 -555 1557 -4299 2506 8 914 -438 1138 1969 -1152 1443 -1509 721 -1107 978 1130 2198 3077 1939 1362 -464 393 789 1717 2961 704 459 -316 545 -432 790 -851 160 -752 -348 -1184 -1372 -1167 -2147 -516 -388 -210 389 271 581 617 262 -608 358 -310 1298 212 211 -33 -1081 42 -868 457 -813 -466 -1273 -661 -531 60 525 640 489 -313 143 111 267 843 491 337 -111 230 -468 169 -82 160 -14 461 534 34 132 -581 -213 -434 -115 -270 -34 284 21 151 -290 346 -125 -796 320 -603 155 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