File name: Pandora141s1_Calakmul_20250219_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20250220T061808.4Z 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 v1.8.70 Instrument operation file used: Pandora141_OF_v2d20230802.txt Instrument calibration file used: Pandora141s1_CF_v3d20231011.txt Level 1 file used: Pandora141s1_Calakmul_20250219_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: 20250219 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 20250219T134012.0Z 9181.569584 42 1 1.70 2 73.13 108.27 57.03 226.90 0.00 1 0.00 1 0 25 5.897e-02 8.667e-03 5.782e-02 7.486e-03 3.882298e-01 3.996346e-03 4.182686e-03 -6.000000e+00 3.577914e-02 225.47 -2.00 3.11 -2.00 318.43 0.00e+00 9.310043e-04 8.352266e-04 5.963865e-04 -6.000000e+00 1.627856e-03 290.71 -2.00 20.00 -2.00 317.61 0.00e+00 3.394 0.000 302.00 328.00 3 3.1908e+00 1.0785e-02 3.7166e-02 -6.0000e+00 8.8099e-02 1.8981e-02 1.2329e-02 1.8010e-02 -6.0000e+00 9.4937e-02 1.0043e-02 8.3491e-03 8.8759e-03 -6.0000e+00 5.6962e-02 -1.2339e-02 4.4077e-03 2.5363e-03 -6.0000e+00 2.4785e-02 5.1697e-04 -1.4664e-04 2.3534e-04 3.1906e-05 -6.0000e+00 1.8199e-03 -5.2013e-02 3.9472e-05 12 9 1 12 1 1 999.00 19.90 0.18 -0.05201 -0.05312 2 106 1 5 0 566.220 26.00 20.01 19.90 30.77 39.0 983.72 -28942 24752 -22444 -18419 4951 4415 14369 8169 10438 -18837 17907 -11856 16460 519 -6086 3998 -8054 12081 -10017 3955 2799 1954 1423 -1490 4013 -2659 4381 4793 6978 3711 1710 7841 2245 8263 -8228 3566 -5395 -2142 -1374 -313 -1398 -1127 245 -3400 -520 -204 -1605 -2528 -3144 255 2673 167 -1201 739 -877 1829 -1836 842 556 -1273 1685 1829 2544 1260 922 445 435 -108 412 1419 1965 1772 71 -664 -390 281 -1195 657 446 -487 26 -1207 -1708 -1903 164 -1176 -636 -435 474 794 -92 1481 898 420 -239 -180 610 -79 -407 -1176 172 -1313 -483 -561 -534 -760 -1719 -81 559 845 578 48 887 1 276 693 356 120 441 -180 577 -654 354 -141 203 -280 -48 977 113 338 -490 -716 430 -100 453 -330 -308 -114 121 -392 632 -449 -1350 787 -1156 -890 181 158 496 335 465 -1171 825 -770 943 41 -588 396 -965 1285 -1368 498 366 261 197 -224 612 -448 697 740 1031 573 290 1395 457 1654 -1870 734 -1289 -572 -424 -109 -534 -453 100 -1461 -220 -87 -690 -1095 -1382 112 1216 82 -635 403 -501 1051 -1101 495 325 -754 1003 1149 1701 893 664 313 297 -74 297 1099 1608 1497 61 -556 -311 209 -850 455 324 -387 23 -1127 -1685 -1956 174 -1307 -728 -507 549 900 -100 1530 895 420 -250 -201 731 -102 -542 -1573 220 -1619 -576 -677 -668 -990 -2324 -112 803 1266 898 76 1383 2 404 984 506 175 664 -280 902 -1022 541 -212 296 -399 -67 1378 167 525 -793 -1187 725 -174 810 -608 -578 -216 228 -734 1153 -806 SS 20250219T134527.5Z 9181.573235 46 1 6.56 2 71.95 108.81 57.93 227.83 0.00 1 0.00 1 0 25 2.800e-02 6.997e-03 3.067e-02 4.603e-03 3.619336e-01 2.454534e-03 3.884641e-03 -6.000000e+00 1.697739e-02 225.47 -2.00 3.11 -2.00 318.35 0.00e+00 1.206579e-03 4.983529e-04 3.788926e-04 -6.000000e+00 7.728734e-04 290.71 -2.00 20.00 -2.00 317.52 0.00e+00 3.185 0.000 302.00 328.00 3 3.9705e+00 6.6028e-03 3.4795e-02 -6.0000e+00 4.1803e-02 1.6542e-02 7.5354e-03 1.6676e-02 -6.0000e+00 4.5057e-02 1.7843e-02 5.0167e-03 8.2761e-03 -6.0000e+00 2.7033e-02 -1.3906e-02 2.6329e-03 2.4920e-03 -6.0000e+00 1.1755e-02 2.9748e-04 -1.8528e-04 1.4611e-04 3.0858e-05 -6.0000e+00 8.6437e-04 -4.9647e-02 -3.1749e-05 12 9 1 12 9 1 99.95 19.90 0.23 -0.04965 -0.05104 6 64 1 5 0 936.840 26.00 19.97 19.90 31.04 39.1 983.74 -15019 2547 -5426 -7594 -6814 -2421 -3577 -4494 7102 2575 5097 -15040 2527 -1302 -1786 7869 -6492 7817 -575 1603 -2538 -1395 -4977 2277 -2397 -3092 -1319 -4711 -198 -1907 1099 4 -382 -64 -1179 858 -2300 -667 -380 16 132 -148 193 -1811 -214 -744 1053 -658 -376 11 -485 654 476 682 1253 311 1260 -223 935 540 488 2823 2738 805 486 -329 -54 153 2301 2159 612 1102 -403 -189 146 -1258 -403 -1069 -1726 -1853 -1019 -1529 -1705 -1998 -1171 -522 -422 877 -117 163 400 1085 -32 348 -196 1218 394 57 -182 -279 -694 -602 -273 -711 -410 -336 -831 -876 929 761 742 457 -152 176 -234 1100 529 -177 358 -524 -55 -242 30 247 166 483 447 569 20 -175 -34 -222 -54 229 -53 -147 226 -296 -150 1 288 -629 -706 113 -271 -375 -312 -104 -164 -232 365 146 292 -1110 181 -113 -181 815 -828 928 -77 220 -372 -205 -777 352 -410 -552 -233 -831 -33 -324 195 1 -82 -14 -260 186 -553 -182 -120 6 51 -61 82 -793 -93 -327 456 -288 -165 5 -230 328 253 379 716 184 749 -134 553 320 298 1793 1863 583 356 -235 -37 106 1648 1677 510 945 -349 -159 117 -949 -285 -749 -1271 -1490 -888 -1437 -1691 -2068 -1260 -584 -488 1026 -138 187 439 1127 -33 347 -205 1354 474 73 -242 -371 -894 -738 -324 -860 -514 -439 -1124 -1227 1338 1147 1158 723 -239 267 -341 1546 747 -257 537 -815 -87 -377 46 368 241 683 621 799 29 -270 -55 -364 -91 393 -94 -269 420 -558 -283 3 523 -1124 SS 20250219T135452.8Z 9181.579778 52 1 4.36 2 69.85 109.82 59.59 229.43 0.00 1 0.00 1 0 17 2.335e-02 6.712e-03 2.096e-02 4.529e-03 3.313794e-01 2.414552e-03 3.608329e-03 -6.000000e+00 1.414760e-02 225.47 -2.00 3.11 -2.00 317.82 0.00e+00 8.942364e-04 4.187862e-04 2.231038e-04 -6.000000e+00 6.443937e-04 290.71 -2.00 20.00 -2.00 316.98 0.00e+00 2.871 0.000 302.00 328.00 3 3.8879e+00 6.3898e-03 3.1511e-02 -6.0000e+00 3.4835e-02 2.7941e-02 7.2164e-03 1.5306e-02 -6.0000e+00 3.7557e-02 2.9242e-03 4.5452e-03 7.5430e-03 -6.0000e+00 2.2533e-02 -6.5998e-03 2.3387e-03 2.1678e-03 -6.0000e+00 9.7912e-03 4.5047e-04 -1.4978e-03 1.4361e-04 2.8167e-05 -6.0000e+00 7.2122e-04 -4.9666e-02 -2.4639e-04 12 9 1 12 9 1 99.78 19.90 0.23 -0.04967 -0.06092 5 83 1 5 0 725.870 26.00 19.99 19.90 31.54 39.2 983.73 -9852 5143 10010 7858 -951 1191 3463 -7061 -3401 -5403 -5280 -11539 -1427 -39 -2723 -4204 2348 354 795 2611 2837 -924 -705 477 1701 -1089 3701 -1199 2990 -2376 1455 21 2039 -1341 -4055 838 -3146 -555 -1127 -1312 -578 -326 -790 -1692 625 -2221 275 -758 1346 1117 977 -74 400 104 -419 784 1091 1061 390 803 1286 2377 2017 400 495 59 -112 136 1408 1616 280 177 -394 206 -745 152 -225 -119 -1349 -990 -1319 -1605 -1789 -2062 -915 -30 561 658 -584 323 175 466 -375 390 656 745 835 57 -424 -475 -1048 -754 304 -403 -890 -624 -526 -101 456 473 206 481 -1 543 699 568 871 194 -399 -1 39 -323 15 -156 -81 -172 413 667 125 770 -66 -146 -72 -475 -15 -126 57 -312 88 -103 176 -319 -695 349 672 518 -63 75 226 -565 -290 -495 -496 -1212 -154 -5 -393 -679 383 62 144 484 537 -182 -142 100 373 -253 824 -270 629 -526 330 5 540 -375 -1138 226 -938 -185 -434 -569 -270 -159 -398 -869 317 -1153 140 -385 674 571 523 -42 239 65 -270 512 719 700 257 527 863 1664 1505 314 392 45 -83 101 1082 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