File name: Pandora141s1_Calakmul_20250403_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20250404T163152.9Z 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_20250403_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: 20250403 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 20250403T124823.1Z 9224.533601 65 1 32.02 2 77.00 88.47 124.74 33.44 0.00 1 0.00 1 0 17 6.778e-02 4.862e-03 5.098e-02 2.166e-03 4.864622e-01 1.190942e-03 5.105762e-03 -6.000000e+00 4.158921e-02 228.70 -2.00 3.11 -2.00 319.93 0.00e+00 2.068208e-03 3.973853e-04 7.176813e-04 -6.000000e+00 1.879367e-03 291.76 -2.00 20.00 -2.00 319.16 0.00e+00 4.330 0.000 302.00 328.00 3 2.7537e+00 3.5166e-03 4.7456e-02 -6.0000e+00 1.0315e-01 -8.7929e-03 4.2922e-03 2.3018e-02 -6.0000e+00 1.1092e-01 3.0887e-03 3.5411e-03 1.1785e-02 -6.0000e+00 6.6415e-02 -9.2426e-03 1.8318e-03 3.8860e-03 -6.0000e+00 2.8710e-02 3.0430e-04 -5.3012e-04 6.8508e-05 4.9251e-05 -6.0000e+00 2.0946e-03 -4.8816e-02 -7.3246e-05 12 1 1 12 9 1 99.66 19.90 0.20 -0.04882 -0.05280 73 139 1 5 0 432.520 26.00 20.02 19.90 31.27 37.8 981.15 -14754 -21029 -36546 -14084 -20239 -21574 -21484 -28071 -5170 -15773 -16134 -20211 -16265 -2711 -7007 -6717 -3797 6364 12534 -9144 -3283 -3187 -6762 -410 2977 -5621 406 -4632 2210 -4164 206 -502 -384 -3249 -6580 -1961 -2630 497 -756 -461 -1396 -2009 -1336 305 -450 362 -877 -530 -524 70 515 1760 947 1577 695 -87 -92 574 -334 46 1210 2013 1946 1465 1021 444 91 880 1835 1543 578 331 317 93 -478 -711 -818 -415 -842 -713 -1241 -1580 -1670 -1505 -971 -716 -145 212 528 629 920 419 484 544 580 626 437 287 -30 -283 -935 -629 116 -317 -1005 -611 -756 -331 97 347 322 264 73 59 260 350 683 385 338 -211 -49 -131 -109 -17 -135 -24 504 608 186 233 -307 -382 -336 29 -247 -110 263 -74 -29 -53 151 -38 -149 -257 -549 -169 -244 -260 -277 -435 -72 -261 -284 -408 -377 -68 -218 -240 -147 243 482 -454 -160 -158 -361 -22 167 -359 25 -292 130 -272 14 -40 -34 -315 -652 -189 -278 60 -110 -77 -263 -408 -282 65 -98 80 -198 -121 -123 17 136 501 294 518 241 -32 -34 212 -124 17 458 815 867 704 506 217 44 426 950 885 360 215 206 58 -283 -391 -424 -215 -469 -446 -873 -1223 -1384 -1313 -889 -688 -145 216 535 621 865 376 418 475 540 640 494 351 -39 -365 -1164 -737 130 -361 -1204 -762 -984 -449 139 527 514 431 119 93 395 518 1012 587 536 -347 -80 -214 -174 -26 -206 -35 733 902 293 391 -545 -702 -636 56 -504 -230 563 -160 -63 -113 313 -77 SS 20250403T125321.9Z 9224.537059 68 1 4.16 2 75.82 88.86 124.11 34.45 0.00 1 0.00 1 0 17 2.003e-01 1.004e-02 2.037e-01 8.984e-03 4.609902e-01 4.910110e-03 5.002197e-03 -6.000000e+00 1.228811e-01 228.70 -2.00 3.11 -2.00 319.60 0.00e+00 3.725151e-03 1.466186e-03 1.476461e-03 -6.000000e+00 5.553861e-03 291.76 -2.00 20.00 -2.00 318.80 0.00e+00 3.993 0.000 302.00 328.00 3 3.7137e+00 1.4080e-02 4.4237e-02 -6.0000e+00 3.0476e-01 3.4365e-02 1.6817e-02 2.2300e-02 -6.0000e+00 3.2774e-01 -1.2981e-02 1.3150e-02 1.1922e-02 -6.0000e+00 1.9625e-01 -9.0819e-03 6.8781e-03 4.2275e-03 -6.0000e+00 8.4810e-02 1.5926e-04 -7.3377e-04 2.8346e-04 5.7127e-05 -6.0000e+00 6.1906e-03 -4.7049e-02 -6.9275e-05 12 9 9 12 9 1 99.99 19.90 0.09 -0.04705 -0.05256 4 72 1 5 0 831.730 26.11 20.00 19.90 31.36 37.7 981.15 11239 -4597 155121 -67035 77931 -511 -39348 14452 -53385 95838 -6149 -44722 21158 -8067 4420 26758 -12685 -3710 22048 -4130 222 125 -4355 -6238 -7454 11200 -12446 9064 -19223 13228 -1297 -1873 -223 3729 8202 148 -7239 -8552 -136 4656 437 -4090 -1938 -6499 -5874 7023 850 703 881 1760 6206 -1755 -3610 709 5293 -299 5976 602 2215 -56 -324 2218 1742 2563 -191 1840 416 -70 2093 2673 2055 1731 -359 -909 -2838 -3160 -969 -1037 15 -497 -2095 -2215 -3033 -1490 -506 927 -351 1310 -64 -747 908 335 499 -78 -100 -925 256 354 -521 -322 -1810 51 -13 58 662 -1490 -716 382 357 127 978 925 465 23 645 142 1023 1042 164 -19 -691 -47 -435 -37 119 100 610 717 462 -389 -1073 -835 -951 -311 393 -89 10 41 381 524 -317 24 139 -75 1359 -1998 683 -8 -890 223 -1686 840 -141 -1597 488 -295 172 974 -733 -213 1065 -267 14 8 -304 -470 -604 795 -1108 651 -1782 949 -118 -196 -25 429 895 18 -995 -1386 -24 911 98 -1019 -495 -1775 -1620 1754 227 190 244 504 1834 -603 -1354 271 2029 -124 2393 252 908 -23 -141 1017 876 1367 -107 989 220 -38 1187 1658 1375 1203 -253 -622 -1857 -1925 -547 -584 9 -332 -1578 -1824 -2679 -1365 -484 920 -365 1379 -68 -778 891 313 448 -71 -96 -983 295 441 -683 -421 -2300 61 -14 67 795 -1898 -943 522 514 194 1552 1500 751 36 969 209 1498 1569 258 -31 -1135 -77 -692 -57 179 147 876 1051 716 -645 -1872 -1503 -1761 -594 776 -181 20 85 798 1079 -639 48 SS 20250403T130320.9Z 9224.543992 71 1 1.04 2 73.46 89.64 122.80 36.39 0.00 1 0.00 1 0 17 2.273e-01 1.485e-02 1.369e-01 1.335e-02 3.968959e-01 7.223366e-03 4.172905e-03 -6.000000e+00 1.394771e-01 228.70 -2.00 3.11 -2.00 318.82 0.00e+00 1.481224e-03 1.661308e-03 2.278544e-04 -6.000000e+00 6.302097e-03 291.76 -2.00 20.00 -2.00 317.97 0.00e+00 3.455 0.000 302.00 328.00 3 3.4126e+00 1.9878e-02 3.7996e-02 -6.0000e+00 3.4592e-01 -2.6806e-03 2.2890e-02 1.8497e-02 -6.0000e+00 3.7196e-01 -1.4899e-02 1.5881e-02 9.1006e-03 -6.0000e+00 2.2273e-01 5.9741e-04 8.3377e-03 2.9165e-03 -6.0000e+00 9.6291e-02 3.9322e-04 -1.7547e-04 4.2486e-04 3.4534e-05 -6.0000e+00 7.0235e-03 -4.9108e-02 -4.9053e-05 12 9 9 12 1 1 999.00 19.90 0.50 -0.04911 -0.05043 1 116 1 5 0 517.080 26.11 20.00 19.90 31.48 37.5 981.31 -68433 -4555 -55124 -49798 -29062 -25784 218610 -24792 36109 -26922 -1341 -17704 21942 -17216 44126 39594 17860 6016 -2598 21820 2446 15216 -13000 -1269 14140 -2999 5614 -14576 27137 -5435 6473 -709 -3447 6435 -997 4943 -4472 239 -2652 1423 -2563 -2386 338 -2912 3895 -2854 2913 -2905 -1515 -443 -678 4112 -2486 6734 -3302 5925 40 3031 102 -208 3351 -937 3816 656 935 711 1627 -1241 2521 59 -243 707 -906 533 459 3313 -806 -653 -1068 -2626 365 -1953 -2045 -3234 -1330 -1344 435 -1138 -757 2737 -1344 1676 -846 -334 -3361 -497 1592 689 1655 -193 -2027 -827 1520 1290 -1288 -762 -223 -432 1768 2397 -1030 571 -939 37 732 956 -778 920 -155 -672 206 -872 1009 -66 -937 1589 -506 573 -121 647 -751 281 417 -569 662 -432 851 -261 781 -1077 -47 -729 -3786 -155 -3151 -2629 -1184 -994 2847 -1126 1024 -1466 -60 -991 978 -1310 2215 2340 1403 562 -277 1945 268 1503 -1712 -159 1641 -423 734 -2228 2779 -764 888 -116 -628 1112 -181 856 -911 54 -720 425 -866 -851 122 -1100 1403 -1095 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