File name: Pandora141s1_Calakmul_20250113_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20250114T061521.0Z 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 v1.8.70 Instrument operation file used: Pandora141_OF_v2d20230802.txt Instrument calibration file used: Pandora141s1_CF_v3d20231011.txt Level 1 file used: Pandora141s1_Calakmul_20250113_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: 20250113 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 20250113T144941.3Z 9144.617839 336 1 7.40 2 62.58 127.41 117.45 314.30 0.00 1 0.00 1 0 17 1.341e-02 7.588e-03 1.352e-02 5.587e-03 2.400287e-01 2.976313e-03 2.605165e-03 -6.000000e+00 8.102715e-03 224.51 -2.00 3.11 -2.00 316.57 0.00e+00 1.912164e-04 3.736689e-04 1.417553e-04 -6.000000e+00 3.697334e-04 290.49 -2.00 20.00 -2.00 315.77 0.00e+00 2.160 0.000 302.00 328.00 3 5.3895e+00 7.6897e-03 2.3403e-02 -6.0000e+00 1.9909e-02 4.0532e-02 8.5871e-03 1.0902e-02 -6.0000e+00 2.1470e-02 1.3843e-02 5.0383e-03 5.3580e-03 -6.0000e+00 1.2890e-02 -1.1084e-02 2.4310e-03 1.5275e-03 -6.0000e+00 5.6176e-03 2.2507e-04 1.5769e-04 1.7777e-04 2.0885e-05 -6.0000e+00 4.1368e-04 -5.1774e-02 -4.7565e-06 12 9 1 12 1 1 999.00 19.91 0.21 -0.05177 -0.05059 2 24 1 5 0 2464.970 26.11 20.01 19.91 32.54 36.1 986.27 6179 -1126 -1592 805 1056 -5429 -800 -3119 59 -1907 -332 2428 -877 675 -232 1194 -2413 2198 -623 -3500 3033 121 1549 -1699 913 232 2307 -1129 -151 -635 1885 2233 258 2374 73 -2578 -2670 -1277 -1300 -1487 954 -98 331 -772 -1097 -1046 -1363 -996 382 376 -759 888 472 25 942 1615 -906 -257 113 367 1211 1706 2430 1642 1236 500 -1957 -140 724 986 -644 1126 764 -267 479 809 -1362 -1589 -398 -500 -1121 -2407 -1975 -1058 -985 -570 595 792 -105 768 691 210 -487 -223 -15 -409 552 1141 672 -637 -937 -551 -255 -260 -748 -430 -704 -719 208 509 374 709 116 16 251 -39 -250 281 681 174 681 -345 -23 -179 72 -215 428 482 383 433 -728 80 -325 177 163 -27 526 -247 240 -127 -466 -515 865 -182 -263 124 150 -788 -116 -511 10 -353 -61 450 -183 156 -60 328 -716 648 -194 -1148 960 39 507 -595 328 86 834 -404 -51 -214 642 808 100 918 28 -1007 -1109 -592 -687 -873 589 -64 218 -517 -736 -699 -902 -647 243 241 -506 613 340 19 715 1243 -717 -202 88 285 958 1407 2100 1472 1109 433 -1645 -115 615 896 -624 1111 757 -261 445 704 -1130 -1283 -327 -442 -1068 -2458 -2102 -1160 -1125 -676 725 982 -131 932 803 232 -513 -231 -16 -463 661 1439 877 -834 -1186 -666 -302 -313 -938 -558 -942 -991 294 743 561 1065 171 23 340 -52 -328 378 947 250 995 -505 -34 -252 99 -285 555 627 515 605 -1052 117 -484 269 256 -43 861 -412 399 -210 -757 -822 SS 20250113T145521.2Z 9144.621773 339 1 59.97 2 61.52 128.30 118.36 315.19 0.00 1 0.00 1 0 17 8.981e-03 5.366e-03 5.184e-03 1.523e-03 2.344295e-01 8.062184e-04 2.562564e-03 -6.000000e+00 5.429158e-03 224.51 -2.00 3.11 -2.00 317.60 0.00e+00 1.257359e-04 1.286714e-04 1.533638e-04 -6.000000e+00 2.476777e-04 290.49 -2.00 20.00 -2.00 316.75 0.00e+00 2.087 0.000 302.00 328.00 3 4.5175e+00 2.1216e-03 2.2715e-02 -6.0000e+00 1.3340e-02 1.5047e-02 2.3903e-03 1.0768e-02 -6.0000e+00 1.4385e-02 2.1183e-02 1.4499e-03 5.3028e-03 -6.0000e+00 8.6365e-03 -1.4212e-02 7.2641e-04 1.5185e-03 -6.0000e+00 3.7644e-03 5.8717e-04 4.1811e-05 4.9836e-05 2.0296e-05 -6.0000e+00 2.7709e-04 -5.1582e-02 5.2132e-05 11 1 0 11 8 0 100.00 19.91 0.15 -0.05158 -0.05127 624 624 1 5 0 96.080 26.11 20.00 19.91 32.84 36.1 986.31 -1616 -192 -883 -2544 -536 -1703 2905 1129 2453 -2119 -1520 858 127 1232 86 322 -559 1572 253 386 784 -270 889 1055 1054 -74 358 -704 1139 269 588 1940 580 -589 -1647 -967 -2350 -706 -764 -1494 -1038 -1344 -486 -1263 -676 -1200 -826 -1033 -967 -102 402 804 655 938 217 1014 531 177 218 785 1599 1568 1829 934 482 -296 -230 725 967 965 346 422 362 226 164 231 -208 -283 -176 -831 -723 -1663 -1629 -1514 -906 -557 -522 64 136 396 269 365 224 780 734 356 678 134 100 -480 -644 -743 -107 56 -745 -764 -841 -190 192 826 224 121 75 -39 185 295 512 351 239 -354 -95 -374 -251 268 248 327 224 747 260 231 -134 -252 23 46 -14 -134 361 -28 19 -176 -173 -366 -165 -21 -99 -276 -53 -163 278 121 286 -270 -195 111 18 196 15 63 -115 330 56 88 181 -63 210 261 274 -20 96 -183 277 65 146 510 164 -171 -471 -273 -720 -246 -311 -696 -523 -714 -263 -697 -371 -659 -445 -546 -504 -53 217 458 394 587 140 667 355 119 145 520 1083 1124 1401 752 388 -228 -167 511 717 782 304 384 331 201 138 179 -149 -195 -125 -651 -623 -1567 -1628 -1587 -998 -648 -635 79 169 476 306 386 222 751 734 386 796 170 133 -637 -817 -888 -124 66 -934 -1008 -1155 -270 284 1270 358 194 117 -58 258 394 680 483 346 -539 -148 -581 -382 394 350 444 295 985 359 336 -203 -390 36 76 -24 -237 653 -52 35 -322 -309 -640 SS 20250113T153130.9Z 9144.646886 360 1 0.85 2 55.09 134.70 123.84 321.52 0.00 1 0.00 1 0 17 9.128e-03 6.652e-03 4.868e-03 3.084e-03 1.954532e-01 1.660072e-03 2.171965e-03 -6.000000e+00 5.516739e-03 224.51 -2.00 3.11 -2.00 315.27 0.00e+00 3.513166e-04 1.558057e-04 3.921644e-05 -6.000000e+00 2.517631e-04 290.49 -2.00 20.00 -2.00 314.56 0.00e+00 1.742 0.000 302.00 328.00 3 2.8912e+00 4.2201e-03 1.8945e-02 -6.0000e+00 1.3555e-02 9.4457e-03 4.6726e-03 8.9329e-03 -6.0000e+00 1.4619e-02 7.2929e-03 2.6940e-03 4.4016e-03 -6.0000e+00 8.7762e-03 -5.3624e-03 1.2267e-03 1.2660e-03 -6.0000e+00 3.8248e-03 4.4596e-03 -3.3835e-04 9.7415e-05 1.9078e-05 -6.0000e+00 2.8171e-04 -5.4005e-02 -1.0849e-04 12 9 1 12 9 1 -152.18 19.91 0.16 -0.05401 -0.05655 4 357 1 5 0 167.970 26.11 20.00 19.91 33.51 35.9 986.71 1163 -219 -307 -1752 -2830 1203 -2527 2089 -836 -309 -1789 -235 -206 -567 305 -563 567 112 340 -167 -164 1431 611 1700 -369 1658 -544 -222 929 1185 2333 2369 1781 -1389 -1740 -1874 -1536 -146 -233 -992 -1052 -783 -765 -413 -1173 -401 -1340 -798 -95 -17 36 335 735 729 1013 567 786 102 -244 1073 1499 1479 1832 767 504 -171 -441 329 680 715 763 514 410 245 -49 -446 -288 -412 -44 -348 -1600 -1860 -1961 -1635 -810 -957 -119 27 22 188 9 256 432 448 402 451 173 711 -647 -26 -513 -441 -474 115 -549 -403 -477 -673 219 274 589 494 354 -38 35 664 296 652 259 -345 -330 -294 157 -276 358 181 746 995 264 650 -7 -251 149 -134 -128 -67 58 -81 151 -299 -271 -690 326 -66 -93 -515 -783 311 -692 597 -262 -99 -582 -77 -72 -215 124 -242 249 51 156 -78 -78 676 293 832 -189 852 -282 -111 444 555 1105 1170 916 -735 -902 -967 -828 -86 -152 -704 -786 -602 -597 -324 -923 -313 -1038 -606 -71 -13 27 263 597 606 855 485 677 88 -210 918 1305 1333 1716 741 485 -159 -394 288 614 682 762 527 422 247 -48 -414 -254 -353 -38 -320 -1573 -1926 -2107 -1808 -924 -1132 -145 34 27 227 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