File name: Pandora82s1_SanJose-UCR_20250822_L2Fit_fout2c2d20240415p1-8.txt File generation date: 20260426T100955.4Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Alexander Cede Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 82 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora82_OF_v3d20230727.txt Instrument calibration file used: Pandora82s1_CF_v2d20240415.txt Level 1 file used: Pandora82s1_SanJose-UCR_20250822_L1_smca1c2d20240415p1-8.txt Full location name: GasLab, Universidad de Costa Rica Short location name: SanJose-UCR Country of location: Costa Rica Location latitude [deg]: 9.9396 Location longitude [deg]: -84.0422 Location altitude [m]: 1226 Local noon date: 20250822 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are latency correction, matrix method stray light correction (replaced by simple method) Data caveats: OOB session based on clearance session1 First and last pixel inside fitting window: 196 338 Nominal wavelengths inside fitting window [nm]: 305.0740 305.2147 305.3554 305.4961 305.6368 305.7774 305.9181 306.0587 306.1993 306.3400 306.4806 306.6211 306.7617 306.9023 307.0428 307.1834 307.3239 307.4644 307.6049 307.7454 307.8859 308.0264 308.1668 308.3073 308.4477 308.5881 308.7285 308.8689 309.0093 309.1497 309.2900 309.4304 309.5707 309.7110 309.8513 309.9916 310.1319 310.2722 310.4125 310.5527 310.6930 310.8332 310.9734 311.1136 311.2538 311.3940 311.5341 311.6743 311.8144 311.9546 312.0947 312.2348 312.3749 312.5150 312.6550 312.7951 312.9351 313.0752 313.2152 313.3552 313.4952 313.6352 313.7752 313.9151 314.0551 314.1950 314.3349 314.4748 314.6147 314.7546 314.8945 315.0344 315.1742 315.3141 315.4539 315.5937 315.7335 315.8733 316.0131 316.1528 316.2926 316.4323 316.5721 316.7118 316.8515 316.9912 317.1308 317.2705 317.4102 317.5498 317.6894 317.8291 317.9687 318.1083 318.2478 318.3874 318.5270 318.6665 318.8061 318.9456 319.0851 319.2246 319.3641 319.5035 319.6430 319.7824 319.9219 320.0613 320.2007 320.3401 320.4795 320.6189 320.7582 320.8976 321.0369 321.1763 321.3156 321.4549 321.5942 321.7334 321.8727 322.0120 322.1512 322.2904 322.4296 322.5688 322.7080 322.8472 322.9864 323.1255 323.2647 323.4038 323.5429 323.6820 323.8211 323.9602 324.0993 324.2383 324.3774 324.5164 324.6554 324.7944 324.9334 --------------------------------------------------------------------------------------- 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: 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 77: 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 78: 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 79: 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 80: 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 81: 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 82: Atmospheric variability [%], 999=no atmospheric variability was determined Column 83: Wavelength effective temperature [°C], 999=no effective temperature given Column 84: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 85: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 86: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 87: Number of bright count cycles Column 88: Number of dark count cycles Column 89: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 90: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 91: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 92: Integration time [ms] Column 93: Temperature at electronics board [°C], 999=no temperature signal Column 94: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Humidity in head sensor [%], -9=no humidity signal Column 98: Pressure in head sensor [hPa], -9=no pressure signal Columns 99-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-384: 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 20250822T120400.2Z 9365.502781 54 1 54.28 2 81.98 79.56 74.53 75.06 0.00 1 0.00 1 0 25 5.447e-01 1.067e-02 9.598e-02 1.432e-03 7.550861e-01 7.419332e-04 1.974116e-02 -6.000000e+00 3.050724e-01 226.99 -2.00 3.06 -2.00 320.78 0.00e+00 1.903301e-03 3.548326e-04 3.071330e-02 -6.000000e+00 1.399570e-02 287.74 -2.00 20.00 -2.00 320.14 0.00e+00 6.707 0.000 302.00 328.00 3 3.9762e-01 2.4645e-03 1.6596e-01 -6.0000e+00 7.5534e-01 1.0976e-01 3.3495e-03 2.0144e-01 -6.0000e+00 8.2211e-01 -1.7201e-01 3.2379e-03 4.3198e-02 -6.0000e+00 4.9163e-01 6.2889e-02 1.5305e-03 2.1489e-02 -6.0000e+00 2.1109e-01 5.6828e-04 2.8453e-02 3.3842e-05 3.3687e-04 -6.0000e+00 1.4374e-02 1.9231e-01 12 8 8 10 0 0 23.28 24.88 0.30 0.19231 0.40612 231 24 1 5 0 234.950 33.00 20.01 24.88 24.37 4.4 882.20 -221504 -219286 -225811 -196907 56667 -225185 -216217 -133747 -127522 -130798 -109076 -74931 -53787 -72965 -42106 -12277 -56659 -42036 -64509 -58136 -65794 -51196 -62332 -43483 -41354 -38896 -35058 -33311 -27535 -22259 -12207 -17851 -15453 -18576 -15418 -7753 -2818 -1618 1269 4450 -424 6374 2031 3455 -3709 -2539 3978 1322 4147 6232 4882 5046 6902 5985 6474 5483 1930 3757 2046 3629 5795 4415 2308 2467 1735 2083 3311 2275 3079 2018 1200 1062 -1377 -859 -2659 -2171 -1803 -1240 -1532 -1381 -1410 -886 -450 47 548 1132 682 240 230 -961 -636 -578 -607 -239 218 -174 -455 -774 -1263 -1437 -1085 -1169 -1028 -879 -529 -108 325 670 574 438 -9 -371 -742 -210 55 -159 165 -39 48 605 663 863 405 341 640 749 488 358 176 -56 -64 -266 47 -31 456 284 20 -6 -209 -319 -614 -607 900000 -2728 -2422 -2667 -1925 79 -3860 -3761 -1196 -1247 -1736 -1539 -973 -699 -1325 -635 -151 -1155 -763 -1469 -1324 -1810 -1330 -1941 -1160 -1051 -951 -916 -1061 -1011 -923 -503 -748 -626 -867 -831 -482 -204 -133 110 395 -41 580 199 345 -418 -302 482 187 649 1059 931 1034 1325 1207 1300 1182 421 828 461 928 1674 1391 733 786 583 773 1417 1006 1417 930 525 462 -548 -318 -1025 -945 -866 -702 -932 -933 -1013 -678 -340 37 444 915 535 189 171 -701 -479 -458 -565 -242 240 -213 -564 -905 -1339 -1455 -1080 -1259 -1170 -987 -639 -135 459 1005 881 686 -13 -576 -1103 -312 85 -248 268 -62 73 937 991 1236 565 486 942 1190 843 655 333 -108 -129 -559 104 -67 1004 628 43 -12 -425 -620 -1227 -1268 900000 SS 20250822T122319.4Z 9365.516197 59 1 54.29 2 77.29 80.24 70.06 75.55 0.00 1 0.00 1 0 25 1.158e-01 6.821e-03 4.762e-03 4.447e-04 5.302104e-01 2.198500e-04 5.905986e-03 -6.000000e+00 6.489784e-02 226.99 -2.00 3.06 -2.00 319.08 0.00e+00 8.497026e-04 5.885365e-05 5.084126e-03 -6.000000e+00 2.975782e-03 287.74 -2.00 20.00 -2.00 318.29 0.00e+00 4.425 0.000 302.00 328.00 3 2.9042e-01 6.1744e-04 4.4737e-02 -6.0000e+00 1.6068e-01 1.0291e-02 7.2946e-04 2.6038e-02 -6.0000e+00 1.7484e-01 -3.6324e-02 5.4143e-04 1.7320e-02 -6.0000e+00 1.0456e-01 1.1474e-02 2.7994e-04 7.7721e-03 -6.0000e+00 4.4927e-02 5.0657e-03 2.8559e-02 1.1464e-05 9.6950e-05 -6.0000e+00 3.0556e-03 1.8761e-01 11 8 0 10 0 0 12.20 25.14 0.29 0.18761 0.40221 735 77 1 5 0 73.850 33.00 20.01 25.14 26.37 4.4 895.14 -44454 -51528 -51401 -48038 -37102 -40894 -40351 -34811 -31097 -27249 -17999 -10429 -7780 -6792 -3483 -3079 -3377 -2895 -5230 -4060 -5469 -2863 -4041 -3120 -5044 -5959 -5180 -3200 -1245 -61 -577 -3385 -4454 -3979 -2402 -400 888 625 710 1353 994 1799 990 715 562 11 742 1454 1220 1385 1586 1503 1529 1255 963 771 418 1034 1550 2225 2528 1516 492 91 -570 189 730 600 776 346 469 -122 -466 -1112 -1783 -1206 -1194 -1221 -1167 -1963 -1713 -1286 -793 -178 250 671 683 570 539 -85 -113 49 -150 209 658 227 -273 -445 -1003 -1121 -492 -634 -784 -686 -451 -131 401 614 510 248 145 -252 -297 -197 -114 -71 50 -193 16 382 405 584 437 182 816 665 431 382 164 -129 -51 -54 67 4 414 233 -14 29 -313 -332 -619 -566 900000 -1108 -1247 -1221 -1204 -951 -1245 -1337 -1126 -1061 -1097 -820 -541 -465 -445 -241 -229 -266 -234 -432 -347 -521 -287 -435 -342 -541 -617 -557 -390 -157 -9 -89 -512 -668 -657 -460 -84 224 178 216 398 300 542 306 224 179 4 254 544 472 582 722 678 715 608 469 366 196 494 802 1205 1527 911 304 54 -348 116 517 447 574 257 350 -85 -307 -718 -1139 -782 -856 -962 -994 -1759 -1613 -1233 -812 -182 264 710 698 567 520 -78 -103 49 -156 237 815 297 -359 -553 -1188 -1257 -547 -768 -967 -852 -596 -178 578 937 794 386 216 -365 -421 -276 -167 -107 77 -299 24 574 607 832 622 248 1118 974 679 612 271 -222 -90 -98 125 7 804 446 -27 53 -571 -582 -1107 -1056 900000 SS 20250822T123322.1Z 9365.523172 62 1 54.32 2 74.85 80.58 67.73 75.77 0.00 1 0.00 1 0 33 5.309e-02 6.443e-03 1.923e-03 3.105e-04 4.555220e-01 1.523436e-04 3.917683e-03 -6.000000e+00 2.975803e-02 226.99 -2.00 3.06 -2.00 318.35 0.00e+00 7.000080e-04 3.255041e-05 2.374606e-03 -6.000000e+00 1.364476e-03 287.74 -2.00 20.00 -2.00 317.53 0.00e+00 3.755 0.000 302.00 328.00 3 2.3227e-01 4.1538e-04 3.5878e-02 -6.0000e+00 7.3678e-02 1.4387e-03 4.8136e-04 1.5379e-02 -6.0000e+00 8.0172e-02 -1.9548e-02 3.1955e-04 1.0949e-02 -6.0000e+00 4.7942e-02 4.9521e-03 1.6393e-04 6.7368e-03 -6.0000e+00 2.0601e-02 1.0102e-02 2.8210e-02 8.1728e-06 5.9692e-05 -6.0000e+00 1.4011e-03 1.8743e-01 11 8 0 10 0 0 40.28 25.33 0.27 0.18743 0.39942 1062 111 1 5 0 51.140 33.25 20.01 25.33 26.82 4.4 898.20 -20623 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