File name: Pandora141s1_Calakmul_20250220_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20250221T062140.5Z 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_20250220_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: 20250220 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 20250220T133332.5Z 9182.564959 290 1 59.59 2 74.47 107.27 51.73 212.80 0.00 1 0.00 1 0 25 1.041e-01 6.551e-03 7.668e-02 4.217e-03 4.153459e-01 2.280966e-03 4.403400e-03 -6.000000e+00 6.314311e-02 225.55 -2.00 3.11 -2.00 319.64 0.00e+00 3.487105e-04 6.802758e-04 2.156292e-04 -6.000000e+00 2.874490e-03 290.73 -2.00 20.00 -2.00 318.86 0.00e+00 3.667 0.000 302.00 328.00 3 4.8814e+00 6.5440e-03 4.0081e-02 -6.0000e+00 1.5550e-01 3.4945e-02 7.8201e-03 1.9316e-02 -6.0000e+00 1.6761e-01 1.4288e-02 6.0327e-03 9.5937e-03 -6.0000e+00 1.0055e-01 -1.3665e-02 3.1480e-03 2.7792e-03 -6.0000e+00 4.3710e-02 7.0820e-05 -7.4079e-04 1.3731e-04 3.5915e-05 -6.0000e+00 3.2149e-03 -4.8926e-02 -6.3378e-05 11 9 0 11 8 0 99.98 19.90 0.22 -0.04893 -0.05449 42 42 1 5 0 1418.510 26.00 20.00 19.90 31.21 38.9 986.12 -25299 -10904 9740 39818 -30337 85925 -28523 23720 -27610 16945 -21886 -18858 4959 988 8213 -9089 5546 -437 -4037 2921 -7005 1713 -3183 -846 -5931 1444 -4529 -5625 651 -4861 1605 -5802 1396 840 4486 -5548 -3212 -709 -1528 382 -288 1972 -1875 2979 -2603 1573 2024 -1748 883 -2345 629 1418 1470 -374 1829 247 254 -195 -1057 432 369 3140 2360 2404 -64 -279 -188 327 2089 -218 1674 893 700 226 -73 -863 -2080 867 -2557 -1046 -1534 -2349 -2914 -1336 129 -1090 623 162 1051 466 634 26 171 -322 293 -165 433 859 -244 -7 -503 19 -299 -304 -180 -955 -839 -191 838 413 961 102 474 9 -437 228 -228 607 -135 -299 -217 -700 311 -196 541 -453 871 184 185 -225 -218 -113 -199 61 -100 134 225 191 21 -9 24 -443 -532 -225 175 528 -723 688 -699 405 -844 367 -709 -641 156 38 349 -513 298 -27 -269 191 -518 119 -240 -67 -526 125 -418 -510 54 -437 148 -644 159 100 511 -699 -430 -109 -281 80 -67 481 -493 765 -711 416 535 -480 241 -684 191 463 516 -142 711 101 106 -82 -442 178 157 1400 1159 1260 -35 -148 -96 168 1136 -134 1096 613 481 150 -45 -500 -1136 455 -1472 -667 -1103 -1874 -2508 -1198 121 -1091 644 172 1108 480 616 24 149 -282 272 -169 489 1055 -319 -10 -627 22 -334 -345 -215 -1205 -1106 -263 1211 639 1556 170 777 15 -659 331 -331 905 -212 -487 -358 -1146 492 -303 805 -655 1219 264 282 -369 -377 -203 -368 116 -200 278 478 411 45 -20 49 -883 SS 20250220T134328.4Z 9182.571857 293 1 58.86 2 72.23 108.27 53.03 215.05 0.00 1 0.00 1 0 17 7.374e-02 7.709e-03 5.275e-02 5.400e-03 3.698316e-01 2.896845e-03 3.960978e-03 -6.000000e+00 4.473600e-02 225.55 -2.00 3.11 -2.00 319.14 0.00e+00 1.285128e-03 7.340783e-04 5.717083e-04 -6.000000e+00 2.035812e-03 290.73 -2.00 20.00 -2.00 318.33 0.00e+00 3.231 0.000 302.00 328.00 3 5.6853e+00 8.0500e-03 3.5419e-02 -6.0000e+00 1.1017e-01 8.6906e-02 9.3819e-03 1.7211e-02 -6.0000e+00 1.1873e-01 -4.2456e-03 6.6806e-03 8.5942e-03 -6.0000e+00 7.1233e-02 -5.0641e-03 3.5142e-03 2.5564e-03 -6.0000e+00 3.0978e-02 4.8979e-05 -5.7117e-04 1.7567e-04 3.3285e-05 -6.0000e+00 2.2763e-03 -5.0431e-02 -4.8774e-06 11 9 0 11 8 0 99.97 19.90 0.46 -0.05043 -0.05472 24 24 1 5 0 2451.970 26.11 19.96 19.90 31.46 38.9 986.10 2523 5320 -16669 -20849 27000 -45545 33182 -23820 -5506 -20816 -542 16505 1310 12514 -14015 8709 -3837 16209 -43 4181 2108 -3876 6903 -2725 13652 -871 4042 320 846 -4649 -3360 5010 -3493 7360 -7240 7223 -2471 -2843 -662 2984 -677 -2197 2374 -3967 78 -43 95 -353 -3573 1873 -2136 1724 2401 -295 -1140 -1535 -828 1763 459 373 3310 921 1718 777 2034 636 -1048 -223 -545 2018 509 447 1387 60 -119 -531 -598 -3027 -962 -1779 -1171 -1395 -375 -1428 -196 202 -613 258 201 753 383 -647 -536 586 -525 -131 1068 583 1144 35 -765 -1290 -454 57 -1281 -353 -697 99 694 466 458 429 -200 68 372 -138 428 -746 338 -406 272 483 586 450 -1229 294 2 575 -23 -280 -667 -67 184 -575 144 -224 436 -17 241 83 39 -362 71 164 -658 -829 640 -2064 757 -1034 -223 -1030 -23 634 66 670 -1121 632 -339 1259 -4 399 211 -415 685 -313 1429 -109 483 38 98 -574 -441 676 -558 1098 -1217 1058 -428 -576 -155 781 -202 -706 759 -1371 26 -15 32 -119 -1248 640 -803 673 998 -133 -537 -747 -408 846 221 179 1599 486 980 475 1246 380 -609 -128 -336 1344 371 340 1044 44 -82 -338 -354 -1791 -589 -1225 -896 -1174 -335 -1358 -195 212 -677 290 226 818 394 -628 -491 529 -505 -137 1228 732 1504 46 -971 -1539 -517 65 -1571 -452 -934 138 1016 726 747 713 -328 106 550 -197 608 -1105 521 -654 443 776 917 684 -1829 416 3 803 -34 -444 -1116 -115 325 -1060 275 -447 886 -35 497 168 78 -693 SS 20250220T135022.2Z 9182.576646 297 1 59.19 2 70.68 108.99 53.98 216.54 0.00 1 0.00 1 0 17 4.366e-02 6.394e-03 3.006e-02 3.996e-03 3.394389e-01 2.132692e-03 3.637912e-03 -6.000000e+00 2.648586e-02 225.55 -2.00 3.11 -2.00 318.76 0.00e+00 1.184395e-03 4.794203e-04 4.665264e-04 -6.000000e+00 1.205511e-03 290.73 -2.00 20.00 -2.00 317.92 0.00e+00 2.988 0.000 302.00 328.00 3 5.6444e+00 5.8164e-03 3.2662e-02 -6.0000e+00 6.5226e-02 5.4267e-02 6.6988e-03 1.5708e-02 -6.0000e+00 7.0299e-02 1.0418e-02 4.5700e-03 7.8123e-03 -6.0000e+00 4.2176e-02 -1.0662e-02 2.3982e-03 2.3164e-03 -6.0000e+00 1.8338e-02 6.7806e-05 -5.4610e-04 1.2982e-04 2.9198e-05 -6.0000e+00 1.3481e-03 -5.0159e-02 -5.0077e-05 10 0 0 10 0 0 99.87 19.90 0.25 -0.05016 -0.05426 17 17 1 5 0 3481.170 26.00 20.02 19.90 31.49 39.2 985.95 -5091 -10894 -13256 -1275 9155 -18344 30056 -10634 -300 -12923 -4148 -14445 -985 8704 3672 -639 -4183 5828 -613 3190 -2741 1403 1989 -2884 -1130 -5965 2046 997 3059 -496 9682 -43 -1495 -95 -2323 -3686 -1314 -1357 -1342 1099 -2627 217 -810 245 -409 -334 -697 -2894 -654 -282 1370 910 1689 1937 1090 373 380 52 299 1818 1748 1036 630 1609 671 -308 249 276 861 1113 515 1328 131 218 -128 -922 -1465 -515 -1316 -1202 -1172 -2121 -2014 -1862 -673 -611 392 851 496 953 399 138 -95 191 -774 591 285 447 1 -407 -166 -1168 91 -772 -677 -995 -331 -199 294 993 343 635 -85 -5 6 -201 328 514 595 -115 66 178 67 256 -143 -133 268 189 92 87 -536 -359 -229 -88 -13 207 312 -28 158 -52 -139 -360 -202 -508 -657 -54 330 -830 906 -526 -15 -763 -232 -946 -64 608 311 -63 -459 615 -72 377 -352 175 253 -407 -166 -953 303 144 420 -71 1346 -7 -277 -18 -438 -704 -265 -318 -371 341 -927 79 -308 94 -159 -130 -271 -1141 -253 -112 563 403 791 952 560 198 205 28 160 959 952 606 400 1069 454 -202 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