File name: Pandora141s1_Calakmul_20250725_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20250726T061031.0Z 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_20250725_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: 20250725 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 20250725T134352.1Z 9337.572131 116 1 29.96 2 61.14 77.47 72.02 74.62 0.00 1 0.00 1 0 25 1.058e-02 5.781e-03 4.726e-03 1.519e-03 2.571982e-01 8.179809e-04 2.790968e-03 -6.000000e+00 6.483645e-03 227.45 -2.00 3.11 -2.00 317.22 0.00e+00 3.529829e-04 1.193675e-04 1.277674e-04 -6.000000e+00 2.960051e-04 293.74 -2.00 20.00 -2.00 316.33 0.00e+00 2.062 0.000 302.00 328.00 3 4.4735e+00 2.1473e-03 2.3096e-02 -6.0000e+00 1.6022e-02 -4.9181e-03 2.4039e-03 1.1888e-02 -6.0000e+00 1.7218e-02 9.3206e-03 1.4360e-03 5.8168e-03 -6.0000e+00 1.0336e-02 -7.7016e-03 7.1276e-04 1.6354e-03 -6.0000e+00 4.5072e-03 6.0746e-04 -5.4726e-04 4.8779e-05 2.1650e-05 -6.0000e+00 3.2671e-04 -6.9883e-02 5.6568e-05 10 0 0 10 0 0 99.99 19.91 0.14 -0.06988 -0.07400 49 49 1 5 0 611.190 26.11 19.99 19.91 30.17 41.0 985.38 -2088 -1851 -2073 -1260 -5204 -3072 -3318 69 771 -179 -2148 -2175 -271 -1188 -862 -400 255 -420 -293 1506 1154 907 -419 1063 723 1103 646 -141 859 1212 1592 1740 2783 -698 -1624 -1707 -2129 -633 -324 -605 -1182 -1160 -1003 -919 -696 -270 -673 -534 112 -20 324 297 929 532 602 614 761 323 548 764 741 1381 1639 1253 101 77 -163 334 1013 785 745 296 534 139 125 -75 -512 -302 -454 -756 -884 -1527 -1976 -1957 -1234 -1140 -289 270 -110 276 652 580 502 456 401 691 491 400 -7 -371 -605 -825 -125 -96 -307 -770 -935 -425 27 552 378 257 90 -57 -114 312 551 578 531 64 -164 -173 -208 325 213 35 426 482 606 276 40 -236 -85 24 -18 116 106 75 -34 -421 -243 -447 -224 -218 -253 -147 -585 -321 -359 8 98 -24 -301 -313 -42 -209 -170 -86 58 -99 -72 375 295 234 -111 290 208 328 193 -41 237 326 440 515 870 -231 -531 -551 -728 -242 -143 -302 -643 -662 -588 -545 -413 -160 -395 -309 64 -11 191 184 602 359 418 436 547 233 392 545 540 1049 1318 1054 86 64 -128 256 800 669 679 281 509 130 112 -63 -403 -228 -351 -630 -801 -1492 -2040 -2103 -1379 -1332 -349 333 -136 335 757 637 521 462 418 763 583 505 -9 -491 -777 -1012 -148 -115 -384 -1006 -1264 -591 38 820 579 398 137 -85 -160 421 737 790 755 94 -248 -261 -311 472 301 48 569 642 832 396 60 -359 -131 39 -30 195 183 132 -59 -735 -417 -750 SS 20250725T135634.4Z 9337.580954 125 1 28.98 2 58.20 78.11 69.20 75.37 0.00 1 0.00 1 0 17 1.343e-02 6.439e-03 7.394e-03 2.639e-03 2.415098e-01 1.421559e-03 2.642226e-03 -6.000000e+00 8.230670e-03 227.45 -2.00 3.11 -2.00 316.99 0.00e+00 2.952202e-04 1.958044e-04 1.991432e-04 -6.000000e+00 3.757219e-04 293.74 -2.00 20.00 -2.00 316.11 0.00e+00 1.890 0.000 302.00 328.00 3 5.6399e+00 3.7150e-03 2.1324e-02 -6.0000e+00 2.0340e-02 1.8613e-02 4.1491e-03 1.1173e-02 -6.0000e+00 2.1854e-02 1.2823e-03 2.4544e-03 5.4626e-03 -6.0000e+00 1.3119e-02 -5.3381e-03 1.2052e-03 1.5374e-03 -6.0000e+00 5.7234e-03 2.2629e-04 -6.9482e-04 8.4933e-05 2.0809e-05 -6.0000e+00 4.1456e-04 -7.0808e-02 1.2047e-04 11 8 0 10 0 0 99.95 19.90 0.15 -0.07081 -0.07603 12 12 1 5 0 2414.060 26.11 20.01 19.90 30.80 40.7 985.23 1192 -3700 610 -1984 -680 -4116 -1894 2359 -2146 3088 -5865 809 1270 -277 -1680 -255 843 1209 -456 -525 2855 -281 456 700 641 685 309 1420 -866 2370 2194 2389 1570 -827 -1632 -7254 -595 -1483 347 -2448 -715 -1323 -52 -455 511 -664 -1050 -693 -601 878 -421 356 1084 561 1672 855 480 -129 378 199 711 894 1461 1464 397 509 -444 241 700 1504 536 352 592 692 781 -234 -772 -1149 153 -669 -940 -2168 -1929 -1524 -1369 -143 -332 8 69 372 298 153 -24 -50 -118 394 302 314 4 -399 -575 -323 -253 -350 -538 -631 -700 -387 546 831 476 114 307 86 -92 189 296 742 601 34 -65 -40 -292 170 -62 -24 585 190 702 225 -187 -227 -124 -166 62 -54 194 231 -120 -298 -135 -445 144 -514 84 -271 -85 -499 -231 303 -318 460 -964 128 216 -54 -370 -61 210 310 -123 -146 788 -80 131 209 200 221 100 440 -261 677 643 746 525 -291 -565 -2591 -211 -598 159 -1301 -407 -795 -32 -282 315 -413 -647 -418 -357 516 -258 228 723 391 1187 623 356 -96 278 146 532 698 1206 1259 347 427 -355 187 561 1291 495 339 574 656 708 -200 -616 -881 118 -558 -854 -2135 -2001 -1641 -1540 -168 -404 10 86 456 350 170 -25 -51 -123 433 357 396 5 -529 -738 -394 -299 -418 -671 -822 -944 -537 780 1230 729 177 467 125 -128 252 392 1001 844 50 -97 -61 -433 245 -87 -33 769 250 948 318 -275 -340 -190 -259 100 -91 330 398 -208 -513 -228 -738 SS 20250725T140603.8Z 9337.587545 128 1 2.10 2 55.99 78.58 67.09 75.91 0.00 1 0.00 1 0 17 1.754e-02 9.113e-03 1.400e-02 7.116e-03 2.259232e-01 3.859487e-03 2.469245e-03 -6.000000e+00 1.075449e-02 227.45 -2.00 3.11 -2.00 316.00 0.00e+00 5.924303e-04 4.227326e-04 4.431124e-05 -6.000000e+00 4.909069e-04 293.74 -2.00 20.00 -2.00 315.19 0.00e+00 1.782 0.000 302.00 328.00 3 4.7522e+00 9.9444e-03 2.0046e-02 -6.0000e+00 2.6577e-02 1.9666e-02 1.1021e-02 1.0418e-02 -6.0000e+00 2.8551e-02 -7.3685e-04 6.3756e-03 5.0969e-03 -6.0000e+00 1.7140e-02 -5.4517e-03 2.9937e-03 1.4782e-03 -6.0000e+00 7.4811e-03 6.2592e-04 -1.8145e-05 2.2605e-04 2.0571e-05 -6.0000e+00 5.4142e-04 -7.1968e-02 2.1372e-04 12 9 1 12 1 1 999.00 19.90 0.14 -0.07197 -0.07210 1 29 1 5 0 1044.980 26.11 20.00 19.90 31.31 40.5 985.29 2808 2926 -726 1015 -3030 -3643 -5172 8187 3999 -1620 -1772 -6871 1078 -2609 4994 -1730 972 -916 -1671 -276 -797 3215 -2039 2239 1488 1912 -761 639 3047 308 3527 520 3449 -2066 -3072 -1902 -385 -1241 -2864 -540 -423 -1202 -1096 -1113 51 -889 -668 92 -965 -183 -150 939 710 1055 2619 -301 -1635 1168 621 1137 1231 367 2659 1615 227 578 -983 -1245 1432 719 406 173 1012 888 831 -522 -1164 -2277 -1740 -195 -1999 -1204 -2668 -1165 -895 -578 166 837 137 175 -162 721 775 -40 341 1035 1052 666 890 -438 -404 -614 -90 -1257 -110 -1269 -558 -1533 673 328 1155 626 123 -175 17 -95 -359 82 182 -567 121 -88 697 115 317 107 -23 52 315 448 -90 268 -3 138 -207 42 56 777 -180 -703 -150 -460 538 608 -160 213 -611 -700 -1026 1576 870 -386 -428 -1755 276 -760 1510 -594 341 -336 -632 -106 -313 1231 -818 897 623 819 -332 268 1205 121 1382 220 1497 -953 -1399 -846 -176 -633 -1660 -340 -285 -845 -787 -807 37 -642 -477 64 -671 -126 -106 685 539 824 2069 -246 -1361 956 507 924 1016 316 2366 1495 212 523 -858 -1065 1237 663 396 174 1021 883 797 -478 -1008 -1916 -1476 -174 -1923 -1223 -2852 -1276 -1016 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