File name: Pandora60s1_Fajardo_20260103_L2Fit_fout2c14d20240201p1-8.txt File generation date: 20260205T144204.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c14p1-8 Local principal investigator: Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 60 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora60_OF_v1d20230913.txt Instrument calibration file used: Pandora60s1_CF_v14d20240201.txt Level 1 file used: Pandora60s1_Fajardo_20260103_L1_smca1c14d20240201p1-8.txt Full location name: Cape San Juan Light, Fajardo (Puerto Rico) Short location name: Fajardo Country of location: Puerto Rico Location latitude [deg]: 18.3797 Location longitude [deg]: -65.6184 Location altitude [m]: 66 Local noon date: 20260103 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 based on session 13 First and last pixel inside fitting window: 185 327 Nominal wavelengths inside fitting window [nm]: 305.0457 305.1868 305.3279 305.4690 305.6101 305.7511 305.8922 306.0332 306.1742 306.3153 306.4563 306.5973 306.7382 306.8792 307.0202 307.1611 307.3021 307.4430 307.5839 307.7248 307.8657 308.0066 308.1475 308.2883 308.4292 308.5700 308.7109 308.8517 308.9925 309.1333 309.2741 309.4148 309.5556 309.6964 309.8371 309.9778 310.1186 310.2593 310.4000 310.5407 310.6813 310.8220 310.9626 311.1033 311.2439 311.3845 311.5251 311.6657 311.8063 311.9469 312.0875 312.2280 312.3686 312.5091 312.6496 312.7901 312.9306 313.0711 313.2116 313.3521 313.4925 313.6329 313.7734 313.9138 314.0542 314.1946 314.3350 314.4754 314.6157 314.7561 314.8964 315.0368 315.1771 315.3174 315.4577 315.5980 315.7382 315.8785 316.0188 316.1590 316.2992 316.4394 316.5796 316.7198 316.8600 317.0002 317.1404 317.2805 317.4206 317.5608 317.7009 317.8410 317.9811 318.1212 318.2612 318.4013 318.5413 318.6814 318.8214 318.9614 319.1014 319.2414 319.3814 319.5214 319.6613 319.8013 319.9412 320.0811 320.2210 320.3609 320.5008 320.6407 320.7806 320.9204 321.0603 321.2001 321.3399 321.4797 321.6195 321.7593 321.8991 322.0389 322.1786 322.3183 322.4581 322.5978 322.7375 322.8772 323.0169 323.1565 323.2962 323.4359 323.5755 323.7151 323.8547 323.9943 324.1339 324.2735 324.4131 324.5526 324.6922 324.8317 324.9712 --------------------------------------------------------------------------------------- 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 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: 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 20260103T112422.1Z 9499.475256 263 1 29.62 2 84.57 116.21 93.74 299.62 0.00 1 0.00 1 0 25 4.246e-01 3.695e-02 3.413e-01 2.862e-02 7.134426e-01 1.599875e-02 7.518820e-03 -6.000000e+00 2.461394e-01 224.81 -2.00 3.11 -2.00 321.56 0.00e+00 -5.919630e-03 6.554049e-03 1.580872e-03 -6.000000e+00 1.192245e-02 291.92 -2.00 20.00 -2.00 320.87 0.00e+00 9.216 0.003 302.00 328.00 3 5.4138e-01 5.3805e-02 9.6762e-02 -6.0000e+00 6.0556e-01 1.2115e+00 6.6201e-02 3.7787e-02 -6.0000e+00 6.5498e-01 -1.3700e+00 4.4386e-02 1.6553e-02 -6.0000e+00 3.9305e-01 5.0988e-01 2.2513e-02 6.6215e-03 -6.0000e+00 1.7268e-01 1.7594e-05 -3.1997e-03 8.3414e-04 7.8686e-05 -6.0000e+00 1.2068e-02 -1.1508e-01 1.2083e-04 12 8 8 10 0 0 15.37 24.72 0.87 -0.11508 -0.13912 27 27 1 5 0 1096.810 27.67 20.01 24.72 30.91 5.8 1012.07 900000 1673 209603 32423 8597 -36768 -29460 56490 144428 -5011 -2712 900000 -99372 -20258 19577 137044 14952 114620 63434 236998 -40550 100028 4387 50832 22107 35519 32148 19665 17515 -22434 112592 -33356 52817 -51627 -5347 -15747 26749 -6784 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-5960 -2067 -4353 1107 -1526 4523 4003 3969 5647 -629 -2173 -47 2877 -2103 -2714 -7947 5280 -5016 -2440 -4465 192 -4541 770 -2141 -7479 -1717 -3715 -1537 -1341 4559 1963 4811 -1790 3447 -5191 4840 -5019 4940 -3120 697 -1430 326 5429 112 4748 974 1934 -1642 2588 -1304 2597 -2383 3021 -2004 888 3474 -2495 4042 -6312 3775 -2104 1540 -4665 SS 20260103T113426.1Z 9499.482246 266 1 29.92 2 82.44 117.12 95.72 300.44 0.00 1 0.00 1 0 25 3.624e-01 1.352e-02 1.299e-01 5.441e-03 6.197938e-01 2.991726e-03 6.619146e-03 -6.000000e+00 2.100716e-01 224.81 -2.00 3.11 -2.00 321.50 0.00e+00 1.242638e-03 1.572443e-03 3.245159e-03 -6.000000e+00 9.711521e-03 291.92 -2.00 20.00 -2.00 320.90 0.00e+00 7.044 0.001 302.00 328.00 3 5.2723e-01 1.1102e-02 7.6638e-02 -6.0000e+00 5.1668e-01 2.8529e-01 1.4953e-02 3.7044e-02 -6.0000e+00 5.5869e-01 -4.7212e-01 1.2790e-02 1.6975e-02 -6.0000e+00 3.3547e-01 1.9789e-01 6.0674e-03 4.5148e-03 -6.0000e+00 1.4692e-01 1.8230e-04 -2.3753e-03 1.6213e-04 7.2990e-05 -6.0000e+00 1.0236e-02 -1.1490e-01 8.0786e-05 12 8 8 10 0 0 -11.14 24.72 0.38 -0.11490 -0.13275 115 115 1 5 0 260.130 27.67 20.00 24.72 31.73 5.8 1015.57 900000 -41724 -110258 -47129 -126383 -103327 -156478 -130869 -118120 -108096 -99196 -132781 -103008 -81360 -64384 -69601 -4745 -31487 38223 -32140 16854 -34553 1839 -42613 -241 -21643 -12816 -27175 -28980 -12148 -27973 1665 -13387 13334 -2213 5317 -4178 385 -7812 16779 6221 9999 16969 15947 5921 6832 6934 2836 13775 -436 9254 6935 16053 10129 15206 8451 11960 7132 12715 2225 8756 4273 4525 11385 6007 7866 7689 2733 453 5877 2222 3334 4970 4482 448 59 -3803 -7765 -5533 -5728 -4382 -2274 -455 -2057 312 -146 1728 714 1084 1039 808 320 -2275 -2738 -3790 -2089 -2174 -197 -1070 -661 -1942 -726 -3097 -384 -2033 -2666 -1823 55 -32 1245 804 490 1506 637 385 -353 3 -40 -42 -382 40 326 1691 1114 715 78 -513 610 -87 -102 140 25 -55 242 179 -280 -531 998 -8 128 -116 -553 -778 900000 -354 -1914 -500 -2560 -1644 -3698 -2524 -2222 -2236 -2000 -3522 -2459 -1899 -1571 -1980 -91 -869 568 -1023 340 -1173 43 -1605 -6 -758 -428 -1052 -1091 -374 -1068 55 -597 516 -106 226 -193 19 -481 979 479 827 1395 1379 523 660 677 292 1301 -45 1011 779 2010 1334 2061 1296 1840 1180 1974 372 1351 713 827 2196 1361 1821 1739 643 113 1533 689 1124 1716 1534 151 18 -1099 -2194 -1561 -1820 -1625 -964 -216 -1085 171 -87 1074 471 733 703 526 195 -1342 -1576 -2299 -1402 -1693 -174 -1091 -722 -2132 -739 -2937 -330 -1820 -2594 -1864 58 -37 1563 1137 702 2244 955 609 -533 5 -59 -66 -638 63 557 2765 1781 1109 117 -750 866 -132 -175 247 47 -112 521 410 -692 -1379 2611 -21 343 -297 -1343 -1800 SS 20260103T115148.7Z 9499.494314 271 1 30.00 2 78.80 118.81 99.10 301.95 0.00 1 0.00 1 0 17 1.721e-01 7.465e-03 2.394e-02 1.277e-03 4.772851e-01 6.708436e-04 5.084964e-03 -6.000000e+00 9.978989e-02 224.81 -2.00 3.11 -2.00 320.43 0.00e+00 2.691359e-03 2.589801e-04 1.296028e-03 -6.000000e+00 4.612510e-03 291.92 -2.00 20.00 -2.00 319.68 0.00e+00 4.966 0.000 302.00 328.00 3 3.3570e-01 2.0892e-03 5.3620e-02 -6.0000e+00 2.4544e-01 2.3773e-02 2.6287e-03 2.3007e-02 -6.0000e+00 2.6533e-01 -7.2503e-02 2.2194e-03 1.1932e-02 -6.0000e+00 1.5932e-01 2.6381e-02 1.1284e-03 3.7764e-03 -6.0000e+00 6.9826e-02 1.7834e-03 -1.6307e-03 3.8185e-05 5.0366e-05 -6.0000e+00 4.8576e-03 -1.1729e-01 1.6461e-04 11 8 0 10 0 0 -4.62 24.73 0.26 -0.11729 -0.12954 409 409 1 5 0 73.350 27.67 20.00 24.73 33.08 5.7 1020.36 900000 -71993 -51970 -55958 -56039 -61027 -65224 -59635 -57240 -47224 -42500 -43857 -40818 -38130 -23344 -19155 -7984 -9637 -3807 808 -1681 -6550 -4777 -3449 -5475 -4777 -6887 -7717 -8708 -9864 -9271 -5916 -2269 -882 -3964 -4710 -4678 -5715 -897 792 2182 2794 2393 3234 3472 3666 3241 2459 2660 981 2289 2052 2095 2633 1824 1778 1999 694 254 401 146 1418 2256 3414 2923 1170 1544 600 -307 1233 -1 474 1227 953 1004 -534 -1175 -2766 -3388 -2267 -2862 -2068 -1925 -2392 -884 -610 -57 500 875 1092 642 548 -568 -607 -793 -905 -495 642 766 -364 -324 -873 -984 -222 -347 -1704 -553 -545 106 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