File name: Pandora141s1_Calakmul_20250709_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20250710T060934.1Z 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_20250709_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: 20250709 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 20250709T123211.2Z 9321.522351 224 1 29.91 2 76.57 70.67 120.38 247.33 0.00 1 0.00 1 0 25 1.642e-01 5.753e-03 1.523e-01 3.504e-03 5.162568e-01 1.945441e-03 5.610003e-03 -6.000000e+00 1.005145e-01 227.76 -2.00 3.11 -2.00 320.26 0.00e+00 2.423927e-03 7.307102e-04 2.025823e-03 -6.000000e+00 4.591777e-03 293.76 -2.00 20.00 -2.00 319.50 0.00e+00 4.199 0.000 302.00 328.00 3 3.4412e+00 5.9726e-03 4.7610e-02 -6.0000e+00 2.4855e-01 -4.8123e-03 7.5004e-03 2.6473e-02 -6.0000e+00 2.6725e-01 1.5367e-02 6.3993e-03 1.3209e-02 -6.0000e+00 1.6037e-01 -1.5506e-02 3.2695e-03 3.7011e-03 -6.0000e+00 6.9692e-02 1.6505e-04 -6.0841e-05 1.1082e-04 6.0150e-05 -6.0000e+00 5.0707e-03 -5.2414e-02 8.0034e-05 11 1 0 11 8 0 95.99 19.83 0.16 -0.05241 -0.05287 44 44 1 5 0 679.490 26.00 19.98 19.83 31.79 40.3 986.57 53195 131583 -20297 -27853 -54451 -72022 -45460 -33976 -6982 12252 -38425 -57 1333 -25364 8371 -2832 -9106 2935 -19611 -3078 -6291 1824 -9299 -11028 -3873 -1503 3047 -10067 -1269 -1632 -7992 4252 1972 -5130 -6474 -5943 -9031 -6325 -4815 -55 -2506 -1838 -593 -1627 227 -485 1455 -430 -441 -653 2021 892 757 1286 1753 2261 1038 -320 1040 1019 1735 -68 2794 2465 1507 258 638 1019 624 1859 1550 857 314 444 -32 186 -1337 -1209 -1300 -1262 -1611 -977 -1584 -1278 -421 -765 129 639 109 143 162 -570 -392 -148 52 808 721 188 -304 -553 -640 -629 239 -754 -957 -857 -980 -57 24 615 769 633 192 116 -58 666 597 679 171 -103 -293 -14 -92 368 -180 -548 636 765 446 -118 -92 -297 -692 -118 -514 -280 450 -26 -99 80 313 -28 193 450 -183 -267 -636 -976 -515 -390 -70 111 -592 -1 19 -564 165 -72 -274 86 -763 -109 -237 65 -383 -497 -176 -70 138 -510 -59 -80 -469 257 137 -402 -511 -472 -803 -645 -579 -7 -385 -302 -101 -289 40 -88 265 -81 -86 -135 442 216 200 361 516 690 328 -103 326 320 561 -24 1071 1027 656 112 269 438 292 956 866 502 185 251 -17 91 -623 -563 -654 -720 -1044 -698 -1228 -1045 -361 -695 121 615 105 135 145 -485 -320 -122 46 790 786 225 -387 -706 -783 -719 260 -832 -1108 -1041 -1247 -75 34 930 1230 1043 315 185 -89 986 888 1040 273 -170 -489 -23 -148 573 -273 -809 915 1127 704 -201 -166 -560 -1351 -240 -1089 -615 1001 -58 -223 178 671 -58 SS 20250709T124229.2Z 9321.529504 227 1 30.95 2 74.26 71.29 122.53 247.59 0.00 1 0.00 1 0 17 4.055e-01 1.660e-02 2.670e-01 1.189e-02 4.473633e-01 6.596067e-03 4.908960e-03 -6.000000e+00 2.481706e-01 227.76 -2.00 3.11 -2.00 320.13 0.00e+00 3.601170e-03 2.290638e-03 1.787495e-03 -6.000000e+00 1.144801e-02 293.76 -2.00 20.00 -2.00 319.33 0.00e+00 3.620 0.000 302.00 328.00 3 5.8948e+00 1.9855e-02 4.0996e-02 -6.0000e+00 6.1366e-01 2.0688e-02 2.4319e-02 2.2366e-02 -6.0000e+00 6.5988e-01 -2.5007e-02 1.9315e-02 1.1836e-02 -6.0000e+00 3.9620e-01 5.7452e-03 9.9544e-03 3.8637e-03 -6.0000e+00 1.7289e-01 2.5926e-05 -4.1466e-04 3.9100e-04 5.9861e-05 -6.0000e+00 1.2533e-02 -5.3058e-02 -2.3203e-05 12 8 8 10 0 0 99.05 19.83 0.59 -0.05306 -0.05617 8 8 1 5 0 3866.990 26.00 20.01 19.83 32.24 40.2 986.63 -98953 900000 -32363 205565 134173 162599 7330 -103724 243937 -30100 65252 -73932 139942 -39447 27506 -22924 49869 -18046 66261 36802 -48643 25217 24358 -552 10017 8435 40465 -18530 39974 -3417 32612 -14635 -16163 -13007 -2481 10699 -17156 -5482 3856 12382 -5245 6782 -20673 1846 3497 5866 6145 4408 8446 1298 28 -2661 7835 3170 6603 -2463 -1728 8034 1855 598 3272 6758 3542 6332 -2617 -3958 1435 -1413 3749 454 6166 -1224 1813 2014 -2381 3465 358 96 -793 1752 -1408 -1096 -1164 -5343 -2405 -1279 1596 -1810 1497 -1648 639 -2216 -851 653 -3342 2646 -938 -259 220 -425 -659 -1493 2808 -812 -1275 -871 424 -207 945 214 554 841 -387 643 -718 2159 236 1151 -492 123 847 -1237 569 -865 1284 -1019 1115 1754 -796 -39 -444 -628 -215 324 -7 -836 48 496 783 -1218 1488 -1187 -2869 900000 -602 2383 1556 1885 88 -3976 2828 -676 757 -2870 1622 -1580 698 -1078 1299 -965 1698 1308 -4006 1045 1045 -32 554 493 1761 -1383 1696 -227 1705 -1363 -1696 -1387 -236 902 -2040 -682 522 1791 -996 1230 -5094 377 715 1189 1254 925 1743 299 7 -745 2144 964 2034 -855 -607 2576 624 204 1130 2441 1454 2728 -1260 -1881 627 -640 1745 243 3396 -754 1084 1156 -1329 1680 167 44 -397 971 -910 -784 -900 -4548 -2118 -1181 1507 -1814 1454 -1600 574 -1915 -690 525 -2989 2495 -1022 -309 277 -539 -797 -1691 2924 -885 -1471 -1058 534 -277 1335 328 895 1393 -641 1013 -1087 3076 343 1717 -781 202 1399 -2050 905 -1350 1900 -1483 1559 2492 -1237 -66 -791 -1166 -411 645 -14 -1836 108 1122 1766 -2735 3158 -2488 SS 20250709T125154.3Z 9321.536045 230 1 29.56 2 72.14 71.83 124.50 247.79 0.00 1 0.00 1 0 25 9.675e-02 7.697e-03 6.813e-02 5.021e-03 3.920258e-01 2.723158e-03 4.208620e-03 -6.000000e+00 5.918878e-02 227.76 -2.00 3.11 -2.00 319.41 0.00e+00 1.479741e-03 7.567269e-04 6.413693e-04 -6.000000e+00 2.706052e-03 293.76 -2.00 20.00 -2.00 318.55 0.00e+00 3.216 0.000 302.00 328.00 3 5.1505e+00 7.7253e-03 3.5924e-02 -6.0000e+00 1.4636e-01 -1.7323e-02 9.1341e-03 1.8486e-02 -6.0000e+00 1.5740e-01 3.0402e-02 6.7703e-03 9.2342e-03 -6.0000e+00 9.4450e-02 -1.9865e-02 3.5604e-03 2.7382e-03 -6.0000e+00 4.1024e-02 8.6230e-05 -3.9224e-04 1.6331e-04 3.5848e-05 -6.0000e+00 2.9894e-03 -5.4023e-02 -1.5254e-04 11 9 0 11 8 0 91.44 19.82 0.16 -0.05402 -0.05697 13 13 1 5 0 2272.960 26.00 20.00 19.82 32.47 40.3 986.72 -50789 -36653 -9758 -22698 38601 -23740 27003 -17874 31004 -8469 -8980 15687 -13673 12078 -18717 48715 7090 -2182 -9551 219 1673 -5805 4458 -5608 5501 -6280 -1657 -1874 -867 -6834 3238 -2397 2574 8627 -4243 -588 837 -1625 -3251 493 -1550 -2479 -914 1439 -38 -555 1131 597 -1851 321 1890 33 -1384 218 -941 2682 1641 -2103 631 -36 1213 1531 1779 1308 639 1149 503 1467 296 1562 -172 851 -442 1454 -384 -927 542 242 1455 -531 782 -1498 -612 -2103 -1947 105 -348 392 -1099 178 1789 1344 471 1895 -122 1059 639 -1095 -421 -649 -849 -1079 -193 -1024 -801 -853 -1289 -28 -495 569 -41 -366 453 718 243 220 777 596 1088 -345 -83 -617 275 6 168 387 181 1000 876 527 92 -177 -339 246 -163 -164 63 -411 -67 11 -345 -77 -1595 -1134 -246 -630 569 -611 460 -519 635 -267 -296 443 -586 484 -1173 1833 430 -155 -768 17 131 -495 356 -525 495 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