File name: Pandora141s1_Calakmul_20250430_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20250501T055849.7Z 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_20250430_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: 20250430 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 20250430T135853.5Z 9251.582564 129 1 1.06 2 56.36 84.07 89.91 60.59 0.00 1 0.00 1 0 17 7.904e-03 5.870e-03 1.707e-03 9.780e-04 2.174300e-01 5.351129e-04 2.362890e-03 -6.000000e+00 4.883006e-03 229.77 -2.00 3.11 -2.00 315.64 0.00e+00 3.062512e-04 5.353616e-05 8.892431e-05 -6.000000e+00 2.198922e-04 292.52 -2.00 20.00 -2.00 314.87 0.00e+00 1.799 0.000 302.00 328.00 3 8.3391e-01 1.3804e-03 2.0042e-02 -6.0000e+00 1.2140e-02 7.0184e-04 1.5248e-03 1.0059e-02 -6.0000e+00 1.3028e-02 2.5533e-03 8.7614e-04 4.8891e-03 -6.0000e+00 7.7992e-03 -3.5884e-03 4.0147e-04 1.3606e-03 -6.0000e+00 3.3794e-03 3.1647e-02 -4.6690e-04 3.0934e-05 1.9697e-05 -6.0000e+00 2.4412e-04 -6.8100e-02 1.0022e-04 12 1 1 12 1 1 98.90 19.92 0.19 -0.06810 -0.07161 49 2966 1 5 0 20.190 26.11 20.02 19.92 33.27 36.6 983.49 547 -619 -840 -1537 -1872 -1553 -976 397 630 -773 -1474 -1345 -878 -284 365 176 -328 406 234 649 1101 854 1015 1065 1121 716 667 154 320 766 900 1918 1239 -552 -2104 -2270 -1862 -1009 -384 -610 -1205 -825 -624 -709 -559 -492 -739 -649 -916 6 267 497 1142 704 574 693 539 368 364 513 1063 1445 1639 1117 552 -38 -224 261 629 1034 544 262 449 285 -73 -157 -554 -651 -718 -695 -1101 -1552 -1891 -1610 -1267 -739 -263 153 118 222 249 212 66 320 317 305 584 348 135 -296 -518 -811 -299 -118 -449 -612 -745 -239 136 606 490 402 178 41 134 449 424 667 231 27 79 -161 -99 124 241 115 323 509 390 265 -67 -289 -302 143 -95 -61 117 -74 26 -149 -227 -507 128 -160 -223 -392 -437 -339 -217 96 168 -220 -427 -395 -257 -93 134 66 -130 165 98 280 483 377 452 462 511 339 314 70 145 334 401 902 585 -272 -1021 -1080 -935 -543 -230 -401 -833 -601 -466 -537 -423 -369 -546 -466 -678 5 191 376 910 561 473 582 460 315 308 432 914 1253 1523 1050 523 -34 -195 229 549 948 524 266 459 284 -72 -147 -495 -548 -617 -624 -1057 -1577 -1985 -1782 -1430 -854 -320 185 143 271 296 240 71 332 339 340 687 433 171 -378 -654 -991 -348 -140 -547 -765 -978 -315 188 848 715 574 256 57 178 582 542 879 314 38 110 -225 -139 167 321 152 406 637 509 354 -95 -404 -432 205 -143 -93 184 -115 40 -231 -354 -767 SS 20250430T140737.6Z 9251.588630 132 1 2.62 2 54.30 84.62 88.17 61.22 0.00 1 0.00 1 0 17 8.407e-03 6.062e-03 3.096e-03 1.856e-03 2.074131e-01 1.020139e-03 2.263801e-03 -6.000000e+00 5.195136e-03 229.77 -2.00 3.11 -2.00 315.46 0.00e+00 8.144934e-05 9.809862e-05 9.661719e-05 -6.000000e+00 2.339222e-04 292.52 -2.00 20.00 -2.00 314.70 0.00e+00 1.709 0.000 302.00 328.00 3 3.0912e+00 2.6263e-03 1.9064e-02 -6.0000e+00 1.2916e-02 1.8577e-02 2.8962e-03 9.6057e-03 -6.0000e+00 1.3859e-02 3.9216e-03 1.6653e-03 4.6727e-03 -6.0000e+00 8.2970e-03 -4.0307e-03 7.5826e-04 1.3088e-03 -6.0000e+00 3.5964e-03 3.6463e-03 -2.8415e-04 5.8828e-05 1.9594e-05 -6.0000e+00 2.5962e-04 -6.9328e-02 1.4348e-04 12 1 1 12 9 1 99.89 19.93 0.15 -0.06933 -0.07146 13 322 1 5 0 186.420 26.11 20.01 19.93 34.07 36.4 983.61 578 -250 -2415 -1022 -2931 -712 471 1056 1208 433 -1831 -1610 -666 -340 561 -366 191 369 682 1805 464 630 558 1081 1349 1271 -6 -417 613 336 869 1583 1215 -559 -2113 -1694 -2386 -591 -903 -648 -1279 -670 -1029 -391 -441 -760 -480 -664 -509 -72 -34 668 721 706 562 767 445 417 376 758 1163 1419 1832 1001 924 -217 -621 219 757 882 273 196 623 211 342 -1 -471 -730 -462 -881 -1194 -1492 -1699 -1727 -819 -751 -467 -8 -97 348 111 134 -23 320 331 817 587 412 115 -224 -474 -801 -121 -261 -392 -577 -761 -517 -13 447 797 501 79 230 -2 193 546 452 478 -148 27 -57 89 165 51 99 278 388 419 425 -88 -213 -444 329 -192 53 25 -114 -67 -111 -269 -367 146 -68 -683 -277 -751 -171 114 276 341 128 -554 -492 -214 -118 211 -148 79 157 295 793 209 285 254 504 650 628 -3 -202 283 152 396 750 602 -285 -1066 -841 -1236 -332 -565 -443 -932 -503 -789 -301 -339 -584 -364 -496 -375 -53 -26 514 575 578 469 649 381 357 320 643 1000 1260 1693 957 885 -202 -555 191 674 830 271 201 639 214 336 -1 -416 -624 -398 -803 -1159 -1530 -1816 -1904 -931 -886 -568 -10 -121 425 130 150 -24 334 351 905 687 506 146 -286 -590 -960 -141 -308 -479 -731 -991 -689 -18 625 1138 722 112 315 -2 245 688 581 634 -203 38 -81 124 224 68 128 351 488 538 563 -120 -295 -623 469 -281 80 38 -177 -105 -172 -411 -553 SS 20250430T141326.8Z 9251.592671 136 1 30.33 2 52.92 84.99 87.01 61.62 0.00 1 0.00 1 0 25 7.549e-03 5.480e-03 6.791e-04 2.989e-04 2.000343e-01 1.621218e-04 2.177889e-03 -6.000000e+00 4.664600e-03 229.77 -2.00 3.11 -2.00 316.50 0.00e+00 3.086776e-04 1.955603e-05 1.226019e-04 -6.000000e+00 2.100486e-04 292.52 -2.00 20.00 -2.00 315.65 0.00e+00 1.655 0.000 302.00 328.00 3 1.5785e+00 4.2265e-04 1.8459e-02 -6.0000e+00 1.1597e-02 1.7689e-03 4.6882e-04 9.3153e-03 -6.0000e+00 1.2445e-02 7.6182e-03 2.7317e-04 4.5238e-03 -6.0000e+00 7.4501e-03 -7.1235e-03 1.3021e-04 1.2574e-03 -6.0000e+00 3.2286e-03 1.7767e-02 -2.9563e-04 9.6151e-06 1.7447e-05 -6.0000e+00 2.3316e-04 -6.8471e-02 1.2188e-04 10 0 0 10 0 0 99.99 19.92 0.16 -0.06847 -0.07069 3056 3056 1 5 0 9.780 26.11 19.98 19.92 34.33 36.8 983.67 325 -261 -916 -1609 -2168 -1633 -300 802 882 -436 -1273 -1203 -647 17 186 -197 -101 33 400 447 520 617 662 925 950 699 68 -197 290 665 1106 1651 1055 -513 -1850 -2100 -1839 -874 -267 -715 -1077 -901 -668 -632 -498 -481 -757 -737 -555 -140 177 634 915 713 547 694 646 317 311 536 1016 1418 1783 1243 557 -70 -443 -4 798 1017 550 413 462 304 187 -56 -607 -650 -681 -729 -1088 -1574 -1865 -1676 -1090 -605 -265 157 125 282 305 156 -88 262 332 449 554 456 125 -186 -495 -770 -254 -88 -577 -666 -759 -319 115 571 558 380 230 -5 111 267 416 522 325 -42 -58 -132 -100 71 196 168 338 500 429 317 -67 -319 -246 55 -65 -39 127 17 -29 -143 -211 -417 54 -47 -170 -287 -354 -249 -50 134 163 -86 -254 -243 -140 4 50 -58 -31 10 130 149 177 210 227 329 355 270 26 -73 100 221 372 586 399 -202 -713 -793 -734 -397 -143 -408 -678 -598 -454 -434 -342 -327 -507 -479 -350 -88 114 428 652 531 420 544 514 253 245 421 814 1199 1495 1100 496 -59 -373 -3 665 933 513 406 457 294 170 -50 -495 -499 -531 -621 -1035 -1532 -1951 -1849 -1271 -701 -323 198 158 345 350 176 -91 258 336 491 666 560 163 -243 -616 -958 -301 -106 -696 -855 -1024 -447 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