File name: Pandora141s1_Calakmul_20250308_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20250309T061353.3Z 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 v1.8.74 Instrument operation file used: Pandora141_OF_v2d20230802.txt Instrument calibration file used: Pandora141s1_CF_v3d20231011.txt Level 1 file used: Pandora141s1_Calakmul_20250308_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: 20250308 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 20250308T131009.2Z 9198.548717 143 1 59.93 2 76.96 99.55 133.35 349.86 0.00 1 0.00 1 0 25 3.126e-01 9.393e-03 2.214e-01 6.101e-03 4.860813e-01 3.383834e-03 5.262575e-03 -6.000000e+00 1.904183e-01 226.76 -2.00 3.11 -2.00 320.41 0.00e+00 1.054954e-03 1.289424e-03 1.903073e-03 -6.000000e+00 8.642914e-03 291.10 -2.00 20.00 -2.00 319.68 0.00e+00 4.316 0.000 302.00 328.00 3 4.6217e+00 1.0487e-02 4.8009e-02 -6.0000e+00 4.7019e-01 1.4500e-02 1.3129e-02 2.5740e-02 -6.0000e+00 5.0636e-01 -1.1900e-02 1.1071e-02 1.2024e-02 -6.0000e+00 3.0356e-01 5.7597e-04 5.6021e-03 3.3278e-03 -6.0000e+00 1.3166e-01 4.7221e-05 -8.3081e-04 1.9891e-04 4.9191e-05 -6.0000e+00 9.6546e-03 -4.6965e-02 -6.7296e-06 12 9 8 11 8 0 99.97 19.88 0.25 -0.04696 -0.05321 59 59 1 5 0 1015.560 26.00 19.99 19.88 29.06 38.4 983.22 -58115 -87717 231748 -109743 110183 27887 -29723 125237 -32639 81702 -60726 33172 -54735 35326 17367 22854 -3194 -32161 29470 -28222 32924 12648 45871 -16947 26 -5284 9501 -12050 3131 3713 -6852 1418 -15199 -2466 6120 -17916 -6762 -10533 6049 -6391 4058 -4717 3278 1383 12164 1904 -1211 6516 -603 5433 -592 6994 3703 1289 2973 -3479 4501 469 1176 -677 1532 3121 2360 2930 271 234 -26 1580 -197 3410 127 1765 457 -2760 -400 -1126 1303 91 -1678 -1365 -1717 -1029 -3471 -1494 -2411 82 -347 843 701 -725 607 -940 -1414 -422 -184 -160 1298 1110 52 -456 -683 -233 -1414 -590 -489 -719 -476 148 1033 870 1366 -36 1457 225 -249 -161 436 -169 152 585 -568 32 -526 256 571 -67 169 32 -439 -557 100 -1314 -276 -187 58 -31 36 502 53 331 64 -274 -779 -1758 1379 -2803 655 186 -363 745 -518 486 -1418 359 -1564 534 369 530 -104 -1476 819 -1400 964 455 1265 -894 1 -283 448 -680 152 186 -421 92 -1281 -194 441 -1629 -603 -1143 672 -929 596 -806 544 240 1931 337 -223 1135 -116 1032 -129 1550 919 350 835 -1080 1329 144 355 -208 477 1036 871 1163 114 96 -10 636 -87 1636 68 976 255 -1528 -202 -526 557 39 -794 -733 -1050 -696 -2600 -1168 -2020 72 -317 784 651 -664 519 -766 -1107 -332 -156 -151 1357 1282 64 -567 -810 -256 -1499 -629 -549 -854 -594 193 1439 1311 2179 -60 2375 357 -379 -237 639 -257 242 963 -953 52 -846 397 854 -98 240 47 -692 -955 182 -2522 -545 -387 126 -71 84 1171 124 757 142 -587 SS 20250308T131554.6Z 9198.552715 146 1 59.99 2 75.61 100.06 133.56 351.49 0.00 1 0.00 1 0 17 3.674e-02 4.676e-03 5.918e-03 4.155e-04 4.325331e-01 2.243692e-04 4.579402e-03 -6.000000e+00 2.239512e-02 226.76 -2.00 3.11 -2.00 319.38 0.00e+00 1.131754e-03 6.258471e-05 6.432235e-04 -6.000000e+00 1.015950e-03 291.10 -2.00 20.00 -2.00 318.59 0.00e+00 3.938 0.000 302.00 328.00 3 6.1782e-01 6.3142e-04 4.2814e-02 -6.0000e+00 5.5300e-02 6.2598e-04 7.4452e-04 2.0270e-02 -6.0000e+00 5.9541e-02 3.0264e-03 5.6708e-04 1.0101e-02 -6.0000e+00 3.5696e-02 -9.2642e-03 2.9941e-04 2.9822e-03 -6.0000e+00 1.5493e-02 3.9379e-03 -1.8503e-04 1.3193e-05 3.7874e-05 -6.0000e+00 1.1345e-03 -5.1541e-02 -2.2960e-06 10 0 0 10 0 0 87.39 19.89 0.15 -0.05154 -0.05293 1388 1388 1 5 0 43.210 26.11 20.00 19.89 29.39 38.4 983.33 -9929 -7699 -9376 -11251 -15124 -14493 -14676 -11620 -10962 -13612 -11774 -7861 -6338 -4844 -866 -1785 -1650 -523 -211 -388 -541 435 -550 -64 -844 -1212 -2278 -2610 -1138 -703 139 1101 579 -1287 -2176 -2756 -2551 -1118 -284 -725 -1152 -978 -694 -385 -558 -386 -488 -459 -436 -85 323 794 979 664 593 648 472 42 42 488 1131 1768 2241 1329 849 278 140 466 1249 1254 672 492 415 116 -19 -293 -773 -611 -771 -758 -1136 -1533 -1807 -1529 -919 -482 -62 348 287 472 490 357 157 426 280 453 464 330 -103 -302 -691 -779 -67 -95 -762 -820 -777 -285 261 574 369 188 57 17 171 505 583 599 185 -195 -135 -105 2 129 72 -3 374 459 216 69 -297 -389 -267 50 -155 -97 195 42 49 -74 -29 -114 -176 -152 -198 -236 -309 -316 -311 -270 -284 -389 -346 -242 -226 -206 -42 -100 -102 -34 -15 -29 -41 33 -44 -5 -78 -118 -225 -252 -106 -67 15 129 76 -179 -301 -385 -389 -198 -55 -165 -295 -267 -197 -112 -164 -114 -146 -138 -133 -27 110 294 391 284 246 279 208 19 18 212 507 852 1183 764 502 160 78 261 751 846 463 355 298 80 -13 -185 -456 -355 -483 -539 -859 -1300 -1667 -1399 -893 -496 -67 385 318 503 491 332 148 403 267 484 524 413 -138 -404 -878 -914 -79 -114 -918 -1050 -1049 -405 373 887 577 302 91 26 258 723 836 894 294 -306 -215 -173 3 198 106 -4 548 687 330 115 -503 -690 -491 91 -301 -196 387 85 98 -153 -57 -219 SS 20250308T132705.0Z 9198.560474 149 1 60.13 2 73.01 101.09 133.88 354.71 0.00 1 0.00 1 0 25 1.786e-02 4.933e-03 2.296e-03 2.806e-04 3.746978e-01 1.505804e-04 3.999373e-03 -6.000000e+00 1.088082e-02 226.76 -2.00 3.11 -2.00 318.74 0.00e+00 7.204363e-04 3.378445e-05 4.036536e-04 -6.000000e+00 4.937591e-04 291.10 -2.00 20.00 -2.00 317.90 0.00e+00 3.370 0.000 302.00 328.00 3 4.9659e-01 4.1160e-04 3.6714e-02 -6.0000e+00 2.6868e-02 -1.2227e-03 4.7387e-04 1.7448e-02 -6.0000e+00 2.8931e-02 3.2086e-03 3.2616e-04 8.5641e-03 -6.0000e+00 1.7344e-02 -7.8433e-03 1.7162e-04 2.4359e-03 -6.0000e+00 7.5254e-03 8.0927e-03 -5.1606e-04 8.9899e-06 3.0723e-05 -6.0000e+00 5.5150e-04 -5.0848e-02 -6.9121e-05 10 0 0 10 0 0 99.96 19.88 0.16 -0.05085 -0.05473 2261 2261 1 5 0 26.520 26.11 20.01 19.88 30.98 38.2 983.38 -4484 -4154 -3641 -7363 -7560 -6852 -6374 -4270 -3010 -5140 -5288 -4271 -2927 -877 -702 -167 -133 315 189 44 -5 352 201 485 393 -374 -988 -1658 -884 -387 444 1396 689 -1090 -2548 -2418 -2144 -844 -451 -954 -1190 -1119 -707 -602 -238 -295 -573 -744 -351 48 430 752 929 750 617 716 553 142 198 491 1214 1760 2003 1329 664 52 -111 483 1218 1242 604 472 460 252 -43 -208 -618 -608 -654 -741 -1186 -1643 -1819 -1538 -957 -490 -156 253 201 357 360 271 116 425 354 488 506 254 -115 -432 -664 -731 39 -20 -710 -810 -810 -289 231 572 412 215 91 35 232 493 563 558 198 -214 -124 -98 -27 126 127 93 422 545 283 95 -286 -360 -201 66 -129 -109 158 6 -4 -99 -81 -190 -151 -156 -141 -287 -274 -240 -236 -174 -135 -251 -268 -230 -179 -62 -58 -16 -13 34 22 5 -1 43 26 66 57 -57 -151 -247 -127 -56 69 239 120 -200 -464 -440 -424 -193 -123 -306 -424 -424 -256 -222 -88 -110 -213 -300 -142 18 175 331 439 377 324 388 306 79 109 269 682 1061 1222 873 446 34 -69 298 804 915 488 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