File name: Pandora141s1_Calakmul_20250401_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20250402T060633.3Z 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_20250401_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: 20250401 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 20250401T133852.2Z 9222.568659 93 1 60.91 2 65.41 93.29 98.17 62.11 0.00 1 0.00 1 0 17 5.098e-02 1.400e-02 4.789e-02 1.001e-02 2.952690e-01 5.388591e-03 3.340727e-03 -6.000000e+00 3.128249e-02 228.56 -2.00 3.11 -2.00 318.08 0.00e+00 -5.706351e-04 9.786424e-04 9.510764e-04 -6.000000e+00 1.413463e-03 291.71 -2.00 20.00 -2.00 317.21 0.00e+00 2.387 0.000 302.00 328.00 3 7.2326e+00 1.4421e-02 2.7002e-02 -6.0000e+00 7.7559e-02 1.4941e-01 1.6349e-02 1.4955e-02 -6.0000e+00 8.3396e-02 1.0649e-02 1.0301e-02 6.6847e-03 -6.0000e+00 4.9942e-02 -9.2892e-03 5.2579e-03 2.3909e-03 -6.0000e+00 2.1606e-02 2.4661e-05 -8.2195e-04 3.2535e-04 2.7673e-05 -6.0000e+00 1.5752e-03 -5.1120e-02 -1.8423e-05 12 9 8 11 8 0 99.37 19.88 1.36 -0.05112 -0.05730 20 20 1 5 0 3044.940 26.11 20.01 19.88 32.72 37.7 981.72 6904 -113 7563 1843 2692 -22644 33669 3722 -3651 -4539 2674 -11698 -789 -17980 6237 -196 11287 16334 -771 -1288 791 14893 -2872 10711 -6187 3133 -2797 -3096 -2654 -1658 -621 4880 -1369 -7540 -1738 -2321 -3188 2747 -1794 -2111 -219 3405 -2037 1327 937 48 -2458 -1267 -4308 -5227 2453 695 -26 -523 313 -528 -388 2208 788 3 494 457 3275 4006 131 288 2799 -1418 735 1055 986 707 1803 3642 -679 1541 -1673 -525 -4122 -832 -1766 -1901 -2543 -2161 -760 633 1230 2474 9 410 -478 -1066 -1849 592 -2292 -80 -1387 -1576 1247 495 428 -1993 -1863 -983 -1692 -1402 -156 1264 670 2666 2025 461 906 -78 -535 -1476 -1349 64 721 864 406 107 1516 -588 618 -1233 -854 -2360 -55 720 -1123 311 144 403 -96 3 653 532 865 -531 45 -1391 435 -8 534 132 177 -1814 1671 273 -318 -420 236 -1231 -83 -2541 794 -29 1600 2306 -133 -232 143 2372 -554 1916 -1378 662 -623 -662 -539 -329 -128 1036 -331 -1983 -421 -563 -837 791 -636 -862 -96 1528 -991 632 448 23 -1192 -597 -2074 -2573 1177 362 -14 -307 188 -329 -245 1358 485 2 313 307 2308 2947 100 209 1874 -974 524 827 836 626 1581 3035 -551 1122 -1154 -345 -2912 -630 -1497 -1766 -2537 -2262 -832 725 1467 2999 11 490 -540 -1122 -1826 561 -2329 -86 -1673 -2068 1677 665 547 -2429 -2183 -1164 -2128 -1854 -213 1779 995 4108 3269 763 1455 -120 -772 -2044 -1855 89 1059 1327 638 168 2283 -871 869 -1685 -1124 -3168 -76 1049 -1742 490 232 673 -169 6 1218 1009 1636 -997 81 -2471 SS 20250401T135339.9Z 9222.578934 103 1 1.24 2 61.92 94.58 95.17 63.36 0.00 1 0.00 1 0 17 8.437e-03 5.776e-03 2.911e-03 1.326e-03 2.548698e-01 7.198583e-04 2.752652e-03 -6.000000e+00 5.178204e-03 228.56 -2.00 3.11 -2.00 316.37 0.00e+00 3.469383e-04 8.411383e-05 1.084974e-04 -6.000000e+00 2.339170e-04 291.71 -2.00 20.00 -2.00 315.54 0.00e+00 2.113 0.000 302.00 328.00 3 1.2796e+00 1.8694e-03 2.3496e-02 -6.0000e+00 1.2838e-02 -3.6461e-03 2.0758e-03 1.1742e-02 -6.0000e+00 1.3803e-02 2.6326e-03 1.2058e-03 5.7217e-03 -6.0000e+00 8.2664e-03 -4.1033e-03 5.6886e-04 1.6016e-03 -6.0000e+00 3.5773e-03 1.4174e-02 -3.4429e-04 4.2153e-05 2.1996e-05 -6.0000e+00 2.6065e-04 -5.3357e-02 -3.1618e-05 12 1 1 12 1 1 96.31 19.89 0.13 -0.05336 -0.05594 32 1608 1 5 0 37.320 26.11 19.96 19.89 33.41 37.9 981.82 -472 -41 -1360 -1512 -2983 -2359 -1375 749 213 -2196 -1642 -1875 -873 141 143 -403 -621 331 749 1198 676 1325 1043 1243 1139 106 162 -740 194 606 1087 1616 1095 -946 -1743 -1628 -1590 -392 -416 -475 -789 -473 -453 -521 -135 -588 -690 -791 -481 -118 275 577 772 1024 258 783 344 319 105 823 936 1440 1608 990 549 -321 -101 102 1011 971 80 518 308 368 -110 -66 -837 -407 -590 -841 -1357 -1671 -1713 -1575 -1130 -514 -228 49 146 311 350 417 217 485 490 653 420 267 28 -488 -534 -873 104 15 -588 -826 -928 -419 184 772 416 168 104 60 112 469 612 593 336 6 -38 -46 -146 237 54 179 486 783 263 425 -338 -343 -268 190 -122 -115 266 -179 35 -282 -171 -386 -79 -7 -254 -269 -494 -370 -223 132 42 -463 -349 -413 -210 36 41 -127 -193 106 248 409 237 463 372 464 449 41 66 -291 71 219 407 650 444 -400 -719 -709 -699 -186 -222 -292 -506 -319 -298 -348 -89 -391 -476 -534 -319 -79 191 404 573 757 199 614 275 255 83 646 756 1181 1417 884 491 -286 -84 87 864 880 76 514 307 354 -103 -59 -721 -334 -505 -763 -1322 -1720 -1815 -1697 -1292 -600 -270 59 177 378 397 469 226 512 518 727 499 335 36 -624 -669 -1058 124 18 -720 -1076 -1227 -577 257 1098 619 245 152 85 152 622 805 783 473 8 -55 -67 -209 337 74 239 624 1008 358 596 -484 -506 -393 289 -190 -182 432 -297 57 -462 -280 -611 SS 20250401T140306.2Z 9222.585489 109 1 28.09 2 59.69 95.44 93.24 64.11 0.00 1 0.00 1 0 17 7.961e-03 5.472e-03 2.190e-03 8.776e-04 2.398781e-01 4.744481e-04 2.592436e-03 -6.000000e+00 4.887320e-03 228.56 -2.00 3.11 -2.00 316.71 0.00e+00 3.420825e-04 6.040013e-05 1.253964e-04 -6.000000e+00 2.206942e-04 291.71 -2.00 20.00 -2.00 315.87 0.00e+00 1.973 0.000 302.00 328.00 3 3.5356e+00 1.2378e-03 2.1996e-02 -6.0000e+00 1.2117e-02 1.5258e-02 1.3782e-03 1.1082e-02 -6.0000e+00 1.3027e-02 5.1370e-03 8.0728e-04 5.4005e-03 -6.0000e+00 7.8015e-03 -6.3673e-03 3.8784e-04 1.5114e-03 -6.0000e+00 3.3771e-03 1.7217e-03 -1.4979e-04 2.8106e-05 2.0423e-05 -6.0000e+00 2.4588e-04 -5.4480e-02 8.3827e-06 12 1 1 12 9 1 99.99 19.88 0.15 -0.05448 -0.05561 175 376 1 5 0 159.560 26.11 20.00 19.88 34.09 37.9 981.88 -1221 299 -1136 -2183 -1167 -1360 517 -379 933 -1777 -1622 -1337 -148 386 -409 -162 -576 123 269 789 880 823 719 1395 1273 433 178 -899 529 810 1119 1820 861 -337 -2384 -1792 -1838 -64 -442 -756 -877 -951 -670 -803 -465 -743 -751 -938 -463 -156 465 700 769 688 340 770 548 249 507 620 1223 1509 1798 874 310 -97 -269 429 949 986 444 374 326 208 24 -59 -584 -472 -390 -745 -1006 -1866 -1703 -1612 -912 -595 -330 60 11 236 282 339 112 543 450 559 373 287 66 -317 -572 -679 -24 -13 -573 -702 -751 -294 193 641 392 216 39 68 210 447 576 528 335 -193 -110 -197 -62 48 152 186 464 664 402 229 -321 -286 -176 91 -24 -133 146 -22 -44 -217 -149 -278 -176 46 -181 -336 -165 -184 72 -58 155 -316 -292 -246 -29 86 -101 -43 -162 36 80 241 274 257 229 459 439 154 63 -310 173 259 369 636 320 -128 -903 -671 -729 -28 -224 -428 -534 -603 -434 -525 -304 -485 -484 -594 -290 -98 300 472 541 501 254 584 420 192 387 473 949 1223 1536 777 276 -83 -220 344 790 881 422 367 321 200 22 -51 -476 -372 -315 -648 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