File name: Pandora141s1_Calakmul_20250711_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20250712T210519.7Z 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_20250711_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: 20250711 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 20250711T133847.6Z 9323.568607 295 1 30.23 2 61.63 74.47 110.87 249.95 0.00 1 0.00 1 0 17 8.453e-03 5.728e-03 3.607e-03 1.219e-03 2.598433e-01 6.561601e-04 2.825099e-03 -6.000000e+00 5.172274e-03 227.69 -2.00 3.11 -2.00 317.09 0.00e+00 4.552611e-04 9.299177e-05 1.996574e-04 -6.000000e+00 2.364172e-04 293.75 -2.00 20.00 -2.00 316.20 0.00e+00 2.094 0.000 302.00 328.00 3 4.0653e+00 1.7200e-03 2.3429e-02 -6.0000e+00 1.2787e-02 8.6429e-03 1.9240e-03 1.2011e-02 -6.0000e+00 1.3751e-02 6.6254e-03 1.1428e-03 5.8678e-03 -6.0000e+00 8.2522e-03 -6.0972e-03 5.6279e-04 1.6437e-03 -6.0000e+00 3.5863e-03 8.7864e-04 -2.6882e-04 3.9069e-05 2.1906e-05 -6.0000e+00 2.6109e-04 -5.3973e-02 -2.4820e-05 10 0 0 10 0 0 99.98 19.83 0.16 -0.05397 -0.05599 62 62 1 5 0 487.380 26.00 19.98 19.83 34.28 40.7 986.52 -950 -278 -822 -1389 -3066 -2670 -2141 -76 -41 -544 -238 -1212 -581 -942 246 -619 430 755 88 249 -349 -245 152 595 1181 769 328 -489 866 -134 1250 1977 977 -1266 -1899 -2235 -954 -854 -350 -548 -1052 -1089 -1039 -710 -292 -620 -660 -898 -405 27 680 667 1002 984 814 926 535 273 276 611 1138 1573 1898 1143 364 -21 -162 327 1040 1111 505 414 268 162 217 95 -619 -192 -634 -767 -1214 -1809 -1925 -1594 -1062 -750 -259 110 -108 126 206 5 -48 507 408 800 691 11 -2 -363 -539 -855 -29 -41 -827 -761 -687 -328 356 608 442 322 67 171 249 432 445 554 217 -215 47 -63 -122 72 296 245 579 770 362 298 -330 -305 -77 112 -130 -111 124 -43 -190 -121 -125 -427 -109 -34 -105 -171 -354 -295 -245 -9 -6 -78 -35 -184 -96 -177 51 -142 103 187 23 66 -95 -67 42 172 356 239 102 -148 248 -38 366 616 326 -439 -647 -758 -341 -347 -163 -286 -593 -641 -627 -431 -177 -376 -397 -532 -237 16 413 426 668 680 578 670 393 201 202 445 846 1222 1557 978 313 -18 -128 255 843 969 469 397 258 152 195 80 -491 -148 -503 -656 -1127 -1801 -2012 -1727 -1197 -881 -314 136 -134 153 238 6 -50 518 430 895 826 14 -2 -478 -687 -1042 -34 -50 -1042 -997 -927 -455 509 902 674 494 101 248 344 578 594 758 309 -318 71 -95 -180 103 413 332 765 1021 498 427 -490 -461 -118 176 -211 -187 212 -74 -329 -207 -210 -706 SS 20250711T134724.4Z 9323.574588 301 1 30.04 2 59.66 74.85 112.71 250.38 0.00 1 0.00 1 0 17 4.009e-02 1.004e-02 3.670e-02 9.245e-03 2.420394e-01 4.949728e-03 2.631786e-03 -6.000000e+00 2.452817e-02 227.69 -2.00 3.11 -2.00 317.92 0.00e+00 9.463320e-04 8.592170e-04 1.238412e-04 -6.000000e+00 1.121307e-03 293.75 -2.00 20.00 -2.00 316.99 0.00e+00 1.971 0.000 302.00 328.00 3 6.9761e+00 1.3208e-02 2.2031e-02 -6.0000e+00 6.0641e-02 1.0592e-02 1.4917e-02 1.1282e-02 -6.0000e+00 6.5212e-02 2.9616e-02 9.1282e-03 5.5434e-03 -6.0000e+00 3.9135e-02 -1.8394e-02 4.6221e-03 1.6867e-03 -6.0000e+00 1.7006e-02 5.4748e-05 -1.6382e-04 3.0415e-04 2.1526e-05 -6.0000e+00 1.2384e-03 -5.4003e-02 -5.7553e-05 12 9 8 11 8 0 99.99 19.83 0.47 -0.05400 -0.05523 33 33 1 5 0 910.160 26.00 20.02 19.83 34.51 40.7 986.40 -12150 2686 3306 -2945 -10954 3768 -2355 14575 14261 18289 18382 -3839 1245 -7254 2566 -7938 2695 -6130 4752 3338 9334 -588 1959 1112 -5220 5408 -2773 7558 1644 -4293 -2333 5919 7722 -7861 -151 -901 -139 -3230 859 -764 -4102 285 300 567 -1203 -185 -1765 1927 -1274 -479 -2489 1459 3818 -2659 -218 115 -411 487 -2108 209 555 2419 1073 2097 1427 -578 -3448 -362 2522 1204 1426 -641 74 281 2589 -843 265 -1103 -714 -679 -1087 235 -1497 -788 -1774 -882 465 -217 486 218 49 -480 1162 741 381 1595 1251 372 123 851 -1421 -13 -928 -767 -147 -942 -411 -1401 968 896 455 -132 553 -327 -41 632 -557 1172 -735 -85 -1092 -181 23 333 1104 -213 590 -595 346 -287 -607 -182 215 411 -90 471 -444 60 -435 531 186 -294 -1166 245 307 -277 -1024 295 -204 1191 1281 1654 1684 -446 152 -1087 395 -1472 478 -1227 891 656 1774 -123 408 245 -1279 1237 -681 1617 355 -966 -537 1358 1858 -2232 -39 -232 -38 -1051 316 -325 -1964 138 150 286 -618 -94 -897 927 -623 -234 -1296 777 2103 -1625 -134 73 -263 309 -1356 132 360 1641 792 1604 1096 -428 -2463 -247 1770 940 1199 -572 66 243 2055 -634 181 -735 -491 -513 -912 213 -1464 -806 -1942 -1015 555 -269 596 260 55 -502 1115 698 374 1684 1451 472 164 1116 -1812 -15 -1071 -905 -182 -1243 -563 -2021 1431 1396 738 -216 877 -493 -57 845 -749 1608 -1082 -131 -1739 -285 35 493 1560 -292 776 -794 480 -424 -935 -286 346 684 -157 853 -833 114 -834 995 341 -527 SS 20250711T140502.4Z 9323.586833 310 1 30.55 2 55.62 75.58 116.48 251.20 0.00 1 0.00 1 0 17 8.966e-03 5.944e-03 5.572e-03 2.251e-03 2.235074e-01 1.212308e-03 2.446835e-03 -6.000000e+00 5.485904e-03 227.69 -2.00 3.11 -2.00 316.72 0.00e+00 3.437147e-04 1.561705e-04 1.320216e-04 -6.000000e+00 2.507665e-04 293.75 -2.00 20.00 -2.00 315.84 0.00e+00 1.765 0.000 302.00 328.00 3 5.5458e+00 3.1590e-03 1.9874e-02 -6.0000e+00 1.3563e-02 1.2562e-02 3.5224e-03 1.0340e-02 -6.0000e+00 1.4585e-02 4.1406e-03 2.0611e-03 5.0595e-03 -6.0000e+00 8.7527e-03 -6.9813e-03 9.9266e-04 1.4196e-03 -6.0000e+00 3.8036e-03 2.9001e-04 -3.2285e-04 7.2457e-05 1.9594e-05 -6.0000e+00 2.7695e-04 -5.3640e-02 -2.5614e-05 11 1 0 11 8 0 99.90 19.83 0.15 -0.05364 -0.05607 18 18 1 5 0 1696.980 26.00 19.97 19.83 34.80 40.7 986.52 -384 -90 1192 -1885 -1192 -3427 1201 990 855 -1571 -2413 357 -100 1121 -1546 710 -998 71 730 441 428 1133 -556 1019 1537 343 400 357 2105 406 -24 1283 535 -569 -2282 -1549 -1999 -340 -338 -607 -1643 -975 -625 -584 -951 -395 -1148 -1071 -1197 313 158 1212 580 676 1325 769 499 -9 584 291 1545 1676 1800 876 610 54 -107 100 899 1190 578 345 37 287 -7 -349 -290 -569 -694 -718 -1364 -1461 -1894 -1294 -908 -487 -457 498 6 193 288 163 -281 31 507 703 839 -198 122 -222 -302 -632 -262 -117 -1076 -515 -783 -327 431 813 599 278 141 -169 487 138 425 460 -130 -447 -48 -191 -45 299 67 185 433 841 477 387 -254 -309 -292 69 46 -46 291 -118 7 -154 -249 -397 -57 -14 191 -296 -171 -480 168 153 145 -283 -442 65 -20 248 -390 190 -283 21 217 135 134 354 -179 337 528 122 142 121 672 129 -8 443 196 -214 -847 -566 -781 -149 -170 -343 -1008 -620 -406 -383 -625 -257 -742 -678 -747 194 101 807 407 490 978 580 382 -7 442 221 1192 1355 1538 780 542 46 -86 80 741 1054 547 338 36 275 -6 -300 -232 -441 -552 -615 -1270 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