File name: Pandora141s1_Calakmul_20250613_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20250614T060232.6Z 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_20250613_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: 20250613 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 20250613T132138.9Z 9295.556700 288 1 29.96 2 64.07 72.58 92.68 242.44 0.00 1 0.00 1 0 17 8.618e-03 5.360e-03 2.770e-03 7.289e-04 2.763894e-01 3.923673e-04 2.972271e-03 -6.000000e+00 5.291887e-03 228.72 -2.00 3.11 -2.00 317.65 0.00e+00 3.621783e-04 6.395387e-05 1.568809e-04 -6.000000e+00 2.410706e-04 293.79 -2.00 20.00 -2.00 316.74 0.00e+00 2.273 0.000 302.00 328.00 3 2.6871e+00 1.0413e-03 2.5353e-02 -6.0000e+00 1.3115e-02 3.5717e-03 1.1714e-03 1.2856e-02 -6.0000e+00 1.4095e-02 9.8656e-03 7.1478e-04 6.2602e-03 -6.0000e+00 8.4511e-03 -9.1685e-03 3.6018e-04 1.7489e-03 -6.0000e+00 3.6639e-03 2.8730e-03 -2.2206e-04 2.3521e-05 2.2590e-05 -6.0000e+00 2.6630e-04 -5.2980e-02 -6.3687e-05 11 1 0 11 8 0 100.00 19.87 0.15 -0.05298 -0.05465 449 449 1 5 0 66.700 26.00 20.01 19.87 33.80 38.4 983.66 305 -1757 42 -2996 -1133 -1341 -1082 495 -921 -1445 -3188 -964 -1587 46 -339 26 -370 -353 275 -648 853 -402 894 672 1533 748 -526 -284 -99 1076 1120 2442 1233 -552 -1485 -1865 -1470 -752 -194 -1042 -1164 -1085 -573 -851 -522 -503 -787 -534 -747 266 250 774 664 566 533 511 707 206 345 548 1418 1521 1698 855 215 -48 -244 710 1192 1110 375 319 405 143 141 -209 -57 -302 -222 -403 -1179 -1659 -1849 -1553 -1169 -639 -372 26 70 220 298 380 465 710 739 516 588 194 -96 -459 -603 -588 66 66 -727 -655 -856 -313 154 433 280 -20 -25 -65 279 657 673 607 211 -216 -267 -87 -217 172 138 162 674 794 549 149 -115 -308 -156 107 -81 -53 105 -19 -99 -188 -198 -261 26 -164 4 -278 -96 -109 -92 46 -96 -159 -363 -112 -205 7 -56 5 -71 -70 56 -139 185 -89 199 157 375 190 -135 -70 -23 249 271 631 344 -160 -424 -531 -447 -261 -78 -476 -576 -564 -305 -459 -282 -271 -421 -281 -391 139 137 446 403 358 348 341 476 139 231 367 970 1095 1302 687 174 -37 -181 518 911 919 333 293 373 128 120 -167 -42 -219 -167 -329 -1053 -1599 -1881 -1645 -1294 -740 -446 31 85 262 339 407 471 708 764 572 702 247 -128 -609 -769 -715 78 79 -917 -861 -1166 -439 224 655 437 -32 -38 -97 392 892 912 846 307 -328 -411 -133 -327 253 197 224 904 1071 771 220 -176 -482 -248 175 -138 -92 187 -34 -179 -337 -347 -448 SS 20250613T133239.5Z 9295.564346 297 1 14.21 2 61.58 73.06 94.91 243.24 0.00 1 0.00 1 0 17 1.425e-02 6.722e-03 1.136e-02 3.601e-03 2.542182e-01 1.940006e-03 2.761574e-03 -6.000000e+00 8.747543e-03 228.72 -2.00 3.11 -2.00 317.26 0.00e+00 -2.879513e-05 2.854899e-04 1.880167e-04 -6.000000e+00 3.985376e-04 293.79 -2.00 20.00 -2.00 316.36 0.00e+00 2.091 0.000 302.00 328.00 3 5.3077e+00 5.1089e-03 2.3332e-02 -6.0000e+00 2.1680e-02 -2.0648e-03 5.7209e-03 1.1868e-02 -6.0000e+00 2.3299e-02 1.5684e-02 3.4183e-03 5.7605e-03 -6.0000e+00 1.3970e-02 -1.0284e-02 1.6910e-03 1.6251e-03 -6.0000e+00 6.0557e-03 2.5764e-04 -4.1951e-04 1.1586e-04 2.1582e-05 -6.0000e+00 4.4029e-04 -5.2097e-02 -6.6756e-05 12 9 1 12 9 1 99.98 19.87 0.21 -0.05210 -0.05525 11 25 1 5 0 1183.580 26.00 20.02 19.87 34.06 38.6 983.81 -2338 3566 -4568 599 -5239 3251 -581 -4883 1696 -2295 -951 -1300 761 550 2526 -4657 -1306 1319 247 1892 -2327 1259 1147 3172 47 2106 737 -1601 2630 -204 1378 2194 2334 -751 -2105 -3159 -2615 239 -1337 -346 -1176 -613 -1726 -533 -662 -914 -764 -740 1125 -743 719 366 755 1144 292 1207 -72 467 -200 554 1832 2371 1075 956 318 563 -60 -419 1553 270 565 717 398 -108 -342 525 -589 141 -1064 -1095 -928 -1878 -1800 -1206 -1099 -1294 -361 63 -159 -205 665 775 521 786 509 1065 101 458 151 -407 -1152 -798 278 151 -374 -1172 -678 -122 452 777 153 601 382 110 20 194 705 339 267 44 -245 -398 236 -772 443 -326 471 386 290 557 -389 78 -436 214 -53 -199 295 -143 79 -359 61 -247 -252 396 -560 67 -571 315 -61 -594 214 -315 -131 -186 117 96 485 -1037 -297 305 60 465 -607 321 298 849 14 617 217 -463 701 -55 381 645 729 -246 -678 -1023 -902 92 -602 -174 -643 -349 -1016 -314 -391 -539 -445 -424 629 -425 422 227 490 770 203 851 -52 335 -143 395 1326 1797 873 806 269 456 -46 -321 1228 233 518 678 378 -101 -304 433 -458 105 -829 -923 -847 -1851 -1865 -1295 -1235 -1523 -438 78 -197 -249 765 840 535 793 531 1182 121 583 200 -538 -1473 -970 328 181 -470 -1544 -920 -170 651 1160 236 931 580 161 27 261 941 465 382 66 -372 -602 351 -1124 622 -445 625 514 401 802 -582 119 -677 340 -87 -338 510 -250 139 -626 105 -413 SS 20250613T140622.3Z 9295.587758 315 1 29.34 2 53.91 74.34 101.82 245.45 0.00 1 0.00 1 0 17 3.832e-02 1.548e-02 3.437e-02 1.262e-02 2.229595e-01 6.784717e-03 2.450407e-03 -6.000000e+00 2.351894e-02 228.72 -2.00 3.11 -2.00 317.06 0.00e+00 1.741972e-03 9.420955e-04 3.702492e-04 -6.000000e+00 1.071869e-03 293.79 -2.00 20.00 -2.00 316.17 0.00e+00 1.693 0.000 302.00 328.00 3 7.6792e+00 1.7768e-02 1.9265e-02 -6.0000e+00 5.8288e-02 1.2989e-01 1.9874e-02 1.0231e-02 -6.0000e+00 6.2651e-02 -5.3723e-03 1.1681e-02 5.0358e-03 -6.0000e+00 3.7565e-02 -3.3035e-03 5.6687e-03 1.5712e-03 -6.0000e+00 1.6276e-02 3.4796e-05 -8.0690e-04 4.0783e-04 1.8453e-05 -6.0000e+00 1.1844e-03 -4.9186e-02 -6.8338e-05 12 9 8 11 8 0 97.26 19.88 0.72 -0.04919 -0.05525 17 17 1 5 0 1725.570 26.11 20.02 19.88 34.71 38.7 984.05 -14086 6220 -2617 13336 -8683 9611 1371 10894 9636 -9707 7762 -17507 4644 -9079 2816 -3066 95 4957 -6581 1329 1747 2596 9045 597 360 2524 714 -6777 3069 -5446 -950 1988 -1278 -2208 -4261 672 -6186 2526 941 -369 947 2906 -816 -1807 -313 -195 437 15 2920 -3009 -601 345 -1770 1125 -1572 4912 -204 1395 -2011 4387 179 1666 2311 3395 2700 1003 -116 -2960 915 -110 1425 1659 431 -453 -417 2530 -3788 -911 -2197 -935 -4741 -3276 -984 -1748 -2659 -133 420 -37 2100 1558 -1858 -332 -824 80 -829 -804 1302 315 1015 -1374 409 -1117 254 -1461 -1900 -1227 -1460 1684 916 1453 2020 851 380 565 -667 -1785 -527 -650 621 907 1814 236 501 -1409 985 -358 -1383 149 -1165 1031 -592 27 -499 675 -492 250 1679 1153 -408 -924 185 -1740 -2213 874 -406 1693 -1241 1100 175 1393 1355 -1695 1156 -3390 799 -2006 623 -778 25 1263 -1927 372 495 730 2415 179 113 792 225 -2193 862 -1624 -281 613 -430 -760 -1445 215 -2257 975 430 -194 533 1682 -502 -1134 -194 -120 263 9 1641 -1791 -363 218 -1199 771 -1133 3396 -149 1001 -1474 3032 132 1291 1905 2886 2294 816 -89 -2279 715 -95 1308 1580 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