File name: Pandora141s1_Calakmul_20250330_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20250331T060707.6Z 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_20250330_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: 20250330 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 20250330T125030.3Z 9220.535073 65 1 7.26 2 77.26 90.05 88.28 78.12 0.00 1 0.00 1 0 17 6.729e-01 2.579e-02 3.012e-01 1.989e-02 4.764430e-01 1.112110e-02 5.708385e-03 -6.000000e+00 4.164683e-01 228.41 -2.00 3.11 -2.00 320.00 0.00e+00 1.082929e-02 3.771637e-03 3.059129e-03 -6.000000e+00 2.002961e-02 291.65 -2.00 20.00 -2.00 319.25 0.00e+00 4.410 0.000 302.00 328.00 3 4.6782e+00 3.2931e-02 4.8583e-02 -6.0000e+00 1.0338e+00 1.2759e-01 3.9743e-02 2.3926e-02 -6.0000e+00 1.1130e+00 -9.7098e-02 3.1467e-02 1.6831e-02 -6.0000e+00 6.6261e-01 4.0474e-02 1.6362e-02 9.1429e-03 -6.0000e+00 2.8794e-01 3.8350e-05 -1.1176e-03 6.3985e-04 1.3354e-04 -6.0000e+00 2.1368e-02 -5.4964e-02 8.7841e-05 12 9 9 12 1 1 999.00 19.88 0.61 -0.05496 -0.06336 1 17 1 5 0 3624.670 26.00 20.02 19.88 30.22 37.4 981.15 -130361 900000 -61882 315474 900000 -139622 -532 900000 -54973 -9263 900000 335719 454907 294759 -18182 14101 -40374 36841 -49216 36666 -15954 -11961 10677 20991 1203 -28359 -4248 -14648 121534 -49118 82863 -14843 11638 11803 7861 74954 -22563 9905 30141 4432 31455 -735 -9332 -4707 -6217 8885 1080 -5845 14632 18432 377 10252 -1803 2104 -6876 -2682 4656 -2267 5855 8723 1616 737 3488 -990 290 685 6717 5809 -1607 227 -1194 1879 2498 473 6104 -4187 -8403 2573 -2549 1322 1008 -2268 1321 -708 -655 -1429 -579 -953 -154 -2580 5814 764 -5892 -816 254 -4829 1656 1282 -731 790 -1184 -4097 3887 -1989 -1669 -2629 -1084 1279 287 2160 1873 338 -1562 615 4018 623 -865 -682 1 -1003 598 709 317 -652 575 1029 -388 1705 1139 736 -400 -1356 -2219 188 166 -878 2828 -1131 1181 430 -2337 326 -5132 900000 -1593 6114 900000 -6623 -10 900000 -1352 -180 900000 6507 8816 5713 -699 469 -2534 1211 -3923 1358 -1001 -723 523 958 69 -2193 -263 -995 2355 -4961 2709 -1424 976 1043 713 3574 -2886 1071 3155 679 4130 -140 -2030 -1019 -1402 1787 238 -1403 2984 3786 98 2648 -560 668 -2462 -947 1558 -806 1916 2798 577 288 1469 -470 141 326 2942 2583 -817 125 -722 1152 1522 283 3255 -2256 -4406 1216 -1352 766 661 -1691 1027 -591 -577 -1334 -561 -952 -153 -2554 5112 661 -5140 -686 225 -4948 1789 1523 -936 1003 -1467 -4864 4133 -2227 -1949 -3249 -1383 1683 403 3202 2938 552 -2572 965 5887 907 -1275 -1035 1 -1644 979 1145 501 -1013 860 1484 -555 2443 1741 1211 -701 -2484 -4221 365 335 -1851 5932 -2468 2538 913 -4909 651 SS 20250330T125525.4Z 9220.538488 68 1 1.15 2 76.09 90.44 87.17 78.46 0.00 1 0.00 1 0 25 1.728e-01 1.702e-02 1.785e-01 1.480e-02 4.581371e-01 8.101551e-03 4.839085e-03 -6.000000e+00 1.068607e-01 228.41 -2.00 3.11 -2.00 319.31 0.00e+00 1.262614e-03 2.202333e-03 4.043531e-04 -6.000000e+00 4.813184e-03 291.65 -2.00 20.00 -2.00 318.50 0.00e+00 4.065 0.000 302.00 328.00 3 3.0366e+00 2.2829e-02 4.4532e-02 -6.0000e+00 2.6527e-01 5.3043e-02 2.6771e-02 2.1476e-02 -6.0000e+00 2.8556e-01 -5.6764e-02 2.0097e-02 1.0608e-02 -6.0000e+00 1.7013e-01 2.1826e-02 1.0627e-02 3.2107e-03 -6.0000e+00 7.3742e-02 2.9580e-04 -1.9939e-04 4.6778e-04 4.0064e-05 -6.0000e+00 5.4646e-03 -5.4938e-02 5.1389e-05 12 9 9 12 1 1 999.00 19.88 0.25 -0.05494 -0.05644 1 105 1 5 0 571.970 26.00 20.00 19.88 30.48 37.2 981.17 900000 -42846 -32516 -5564 -14594 -70157 -81530 900000 -57081 12967 -41865 5076 14427 104332 -2437 41732 25798 -11578 -1613 -10648 14885 13726 -11636 10329 5404 42259 11280 21123 -101 6121 -2224 -11899 30022 -11208 8110 -16947 25339 -10117 12125 291 906 3456 -5361 1247 -7469 6398 251 620 -1570 2000 1825 -4013 5018 319 9984 345 955 -3697 145 -1524 3271 185 -340 4132 -2597 2016 -1815 300 -991 532 3066 -5056 3666 -4232 -531 333 327 1316 -2455 4886 -2767 4290 -2627 -1059 -1742 -809 -281 151 -183 308 1757 -39 2647 -1794 -890 -651 1642 2627 -274 459 -2667 -875 -217 1754 -2206 -1350 -15 -2684 -192 1397 308 1266 394 338 946 652 -1418 1330 -70 114 -1538 414 -530 551 43 119 3802 -378 385 -1210 161 -912 76 142 -232 718 -947 693 -1524 613 -557 892 900000 -1305 -949 -124 -331 -2606 -3564 900000 -2480 314 -1769 150 455 1706 -128 1656 1303 -888 -120 -899 1024 969 -1071 828 485 2820 1010 1687 -10 566 -244 -1608 3059 -1737 1044 -2746 3019 -1929 2238 69 235 933 -1624 364 -2376 1825 76 189 -496 637 621 -1548 1924 135 4053 156 440 -1769 67 -709 1506 93 -186 2325 -1577 1157 -1045 171 -609 353 2140 -3885 2642 -3137 -362 211 195 772 -1569 3270 -2168 3472 -2377 -992 -1718 -830 -297 163 -198 325 1760 -37 2413 -1696 -881 -699 1887 3225 -359 599 -3427 -1053 -251 2022 -2716 -1722 -20 -3725 -275 2090 485 2022 628 524 1410 947 -2089 1976 -108 182 -2500 658 -833 841 65 173 5311 -552 587 -1971 273 -1598 136 262 -444 1408 -1908 1398 -3115 1219 -1088 1684 SS 20250330T130520.7Z 9220.545379 71 1 14.44 2 73.74 91.24 84.93 79.14 0.00 1 0.00 1 0 17 2.408e-02 4.937e-03 2.068e-02 2.293e-03 3.944170e-01 1.240020e-03 4.184026e-03 -6.000000e+00 1.477364e-02 228.41 -2.00 3.11 -2.00 318.78 0.00e+00 6.952180e-04 2.828238e-04 4.943953e-04 -6.000000e+00 6.675237e-04 291.65 -2.00 20.00 -2.00 317.93 0.00e+00 3.512 0.000 302.00 328.00 3 3.0943e+00 3.4025e-03 3.8442e-02 -6.0000e+00 3.6616e-02 1.8792e-02 3.9163e-03 1.8519e-02 -6.0000e+00 3.9372e-02 3.8382e-03 2.7268e-03 9.0407e-03 -6.0000e+00 2.3581e-02 -9.1690e-03 1.4367e-03 2.5373e-03 -6.0000e+00 1.0208e-02 5.0682e-04 -4.4194e-04 7.2961e-05 3.1556e-05 -6.0000e+00 7.4391e-04 -5.3367e-02 -8.1765e-06 12 1 1 12 1 1 99.97 19.89 0.22 -0.05337 -0.05669 34 146 1 5 0 412.290 26.11 20.00 19.89 30.99 37.0 981.24 5039 -13942 4949 -4002 -9302 -9617 -8514 -827 -3435 -45 -3274 -9668 -4562 -775 -955 -1239 -2698 -499 -1242 -1385 -1066 -236 1371 -1687 1498 327 -3782 -4158 -751 20 -782 2773 1712 -2099 -1480 -3456 -2111 143 152 -1372 -701 -103 -1224 -484 -826 796 -232 451 -638 421 104 576 1464 204 820 989 597 -62 180 425 1194 1853 1781 1380 768 136 -585 227 1346 1104 404 449 225 602 -11 -431 -964 -308 -627 -966 -1471 -1718 -1591 -1197 -922 -587 -237 420 -95 272 -98 216 69 671 729 408 408 251 -1 -535 -432 -559 65 -120 -783 -533 -729 -11 25 436 506 115 174 94 141 496 218 515 207 52 101 -32 -59 161 159 -4 284 461 307 -64 -453 -489 -382 75 71 -185 165 273 -36 -116 -29 -226 138 -512 160 -137 -314 -318 -295 -30 -142 -2 -150 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