File name: Pandora141s1_Calakmul_20250605_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20250606T194957.5Z 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_20250605_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: 20250605 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 20250605T133619.4Z 9287.566891 177 1 15.51 2 60.49 74.00 167.67 353.55 0.00 1 0.00 1 0 17 2.102e-02 8.967e-03 1.668e-02 5.509e-03 2.540853e-01 2.973928e-03 2.787832e-03 -6.000000e+00 1.292555e-02 229.06 -2.00 3.11 -2.00 317.16 0.00e+00 -1.430725e-04 4.251022e-04 3.068261e-04 -6.000000e+00 5.874034e-04 293.56 -2.00 20.00 -2.00 316.26 0.00e+00 2.021 0.000 302.00 328.00 3 6.0621e+00 7.8212e-03 2.2793e-02 -6.0000e+00 3.2064e-02 2.9050e-02 8.7456e-03 1.1960e-02 -6.0000e+00 3.4448e-02 4.7338e-03 5.1997e-03 5.7616e-03 -6.0000e+00 2.0647e-02 -7.2300e-03 2.5619e-03 1.7104e-03 -6.0000e+00 8.9446e-03 1.2774e-04 -1.1163e-03 1.7669e-04 2.2857e-05 -6.0000e+00 6.4951e-04 -5.4823e-02 -7.7396e-05 12 9 1 12 9 1 99.91 19.87 0.17 -0.05482 -0.06321 3 8 1 5 0 3875.090 26.11 19.99 19.87 33.81 38.1 981.81 -232 3184 -2484 -3069 -9913 -3611 -2292 10927 -2162 -1703 5031 4871 -717 306 -902 -5227 -755 1340 -1103 4048 -144 3380 3779 4340 444 -292 -985 3653 163 -2184 154 518 -427 239 -1482 -422 -4769 -2651 -4751 -1276 -3311 -1401 278 -762 -345 -1789 -756 -1683 1261 1710 395 -24 937 1138 1708 1125 1122 1180 -70 2202 1703 2235 2377 1944 552 -1239 -56 505 2306 1022 689 -694 1438 145 596 717 -2089 -1601 -1100 72 -1818 -899 -2605 -1895 -714 -1191 -53 -215 142 -379 186 180 283 256 -693 1093 511 740 -97 -837 -1419 -776 726 -741 -72 -948 -351 -494 89 677 397 330 -88 832 -36 283 521 634 -14 245 172 -682 683 -200 700 579 163 25 795 74 -109 -8 -611 253 -236 686 -65 304 -32 -774 -125 -651 -26 375 -317 -376 -1196 -393 -257 1201 -296 -244 688 687 -116 56 -186 -1220 -178 322 -280 1015 -38 877 995 1190 132 -91 -306 1047 46 -617 44 158 -140 79 -489 -137 -1709 -1064 -2244 -660 -1884 -822 165 -461 -208 -1087 -450 -992 718 976 236 -15 617 777 1193 806 814 856 -51 1570 1249 1713 1931 1646 473 -1032 -44 388 1824 883 636 -670 1370 137 532 597 -1655 -1221 -858 60 -1672 -882 -2722 -2051 -802 -1406 -64 -268 177 -463 216 197 292 260 -729 1209 610 939 -128 -1111 -1824 -945 852 -892 -91 -1245 -475 -689 128 1009 611 511 -134 1209 -50 379 693 864 -19 363 260 -1031 1006 -290 977 783 215 34 1084 106 -162 -12 -943 399 -385 1150 -112 528 -55 -1343 -212 -1085 SS 20250605T134531.5Z 9287.573281 183 1 29.77 2 58.39 74.38 167.75 3.86 0.00 1 0.00 1 0 17 1.790e-02 6.707e-03 1.302e-02 4.193e-03 2.393219e-01 2.260918e-03 2.596294e-03 -6.000000e+00 1.101475e-02 229.06 -2.00 3.11 -2.00 317.31 0.00e+00 2.996722e-04 3.332943e-04 2.278743e-04 -6.000000e+00 5.002333e-04 293.56 -2.00 20.00 -2.00 316.41 0.00e+00 1.901 0.000 302.00 328.00 3 6.3055e+00 5.9614e-03 2.1419e-02 -6.0000e+00 2.7324e-02 2.6254e-02 6.6734e-03 1.1145e-02 -6.0000e+00 2.9352e-02 3.6906e-03 3.9791e-03 5.4159e-03 -6.0000e+00 1.7592e-02 -5.2200e-03 1.9638e-03 1.5106e-03 -6.0000e+00 7.6251e-03 1.1500e-04 -3.4415e-04 1.3589e-04 1.9996e-05 -6.0000e+00 5.5307e-04 -5.6163e-02 1.0372e-05 11 8 0 10 0 0 99.90 19.87 0.38 -0.05616 -0.05875 11 11 1 5 0 2705.780 26.11 20.01 19.87 34.45 38.1 981.82 -7886 2953 3086 -3037 3 -5438 6145 -3673 6515 -2172 1473 -3739 -1094 3395 -1430 4553 -3965 668 -2670 -1060 583 3311 3565 1954 1879 -707 -1767 -1193 -152 378 1776 3530 -454 -503 -3607 -504 -3954 -167 -435 -1170 -1470 -1680 125 92 322 -1024 -88 -1922 -1074 106 675 625 812 1319 216 774 1008 534 539 54 1434 1905 2123 737 589 -1227 547 501 -207 1627 405 314 209 464 -348 -590 -653 -155 -843 -986 -435 -1519 -1881 -1181 -857 -422 366 -282 128 608 190 -223 -352 1051 96 692 841 -246 90 -286 -566 -848 -35 -81 -463 -925 -1385 -363 215 657 167 616 39 45 396 197 481 186 286 184 123 -80 -541 581 752 -48 200 1114 208 -250 -345 102 -8 -142 -138 -76 -121 137 -36 -401 165 -336 -941 346 370 -368 0 -592 624 -452 802 -304 202 -553 -172 580 -286 940 -932 156 -665 -268 149 827 903 525 530 -211 -529 -341 -41 99 476 997 -142 -160 -1147 -154 -1333 -62 -190 -582 -797 -957 72 53 188 -600 -50 -1097 -600 59 387 379 517 871 148 539 709 377 377 38 1023 1427 1691 619 494 -997 413 372 -161 1362 367 296 198 427 -306 -481 -493 -112 -631 -803 -385 -1467 -1927 -1258 -957 -495 445 -354 159 738 220 -242 -359 1036 98 757 994 -315 120 -380 -722 -1026 -41 -96 -580 -1219 -1900 -512 313 996 261 971 60 66 551 264 638 254 409 275 189 -122 -813 842 1053 -65 264 1459 285 -359 -514 155 -12 -227 -228 -131 -212 244 -64 -710 286 -569 SS 20250605T142010.0Z 9287.597338 202 1 19.81 2 50.47 75.62 164.99 37.50 0.00 1 0.00 1 0 17 9.046e-03 6.693e-03 6.613e-03 3.267e-03 1.986296e-01 1.774509e-03 2.141642e-03 -6.000000e+00 5.565669e-03 229.06 -2.00 3.11 -2.00 316.13 0.00e+00 1.590630e-04 1.983452e-04 1.443464e-04 -6.000000e+00 2.527596e-04 293.56 -2.00 20.00 -2.00 315.29 0.00e+00 1.568 0.000 302.00 328.00 3 5.9824e+00 4.5990e-03 1.7643e-02 -6.0000e+00 1.3807e-02 4.2872e-02 5.1008e-03 9.1189e-03 -6.0000e+00 1.4831e-02 6.8385e-03 2.9473e-03 4.4330e-03 -6.0000e+00 8.8894e-03 -7.1831e-03 1.3773e-03 1.2425e-03 -6.0000e+00 3.8529e-03 2.3309e-04 -5.6180e-05 1.0450e-04 1.7610e-05 -6.0000e+00 2.7946e-04 -5.5606e-02 3.0851e-05 12 9 1 12 9 1 100.00 19.87 0.22 -0.05561 -0.05603 10 17 1 5 0 1800.470 26.11 20.00 19.87 34.87 38.4 981.97 510 530 -2463 -308 -1640 1 1800 1300 -220 -694 -1122 -629 1084 -428 827 -409 620 1043 -1033 970 424 23 1124 817 1847 360 77 421 -81 430 2172 1438 1270 -2561 -1832 -2139 -1914 -1046 -86 -892 -1371 -813 -237 -887 -1102 -731 -556 -852 -837 477 -565 543 752 953 1033 554 61 185 -315 891 1625 1136 1623 1611 184 334 -905 -308 1059 1383 640 638 774 550 607 -763 -69 -1364 -1058 -1176 -1581 -1596 -1073 -1983 -1244 -362 -398 991 111 868 591 -189 -429 -140 -10 275 333 820 121 48 -589 -1131 -113 -305 -506 -866 -602 -163 421 605 633 398 -250 705 -139 -78 424 83 715 3 88 88 -21 218 126 -316 24 150 79 -1 -530 -317 -356 193 8 185 137 479 35 -208 -60 -504 99 111 -537 -63 -310 0 325 259 -49 -160 -261 -148 270 -120 253 -136 211 364 -376 357 160 9 426 322 752 152 33 169 -31 160 812 571 531 -1119 -772 -894 -846 -520 -48 -565 -934 -574 -170 -644 -801 -526 -393 -590 -570 321 -394 392 566 739 819 447 50 151 -256 719 1334 978 1468 1503 173 298 -771 -256 904 1268 626 645 784 546 575 -682 -57 -1097 -866 -1033 -1504 -1620 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