File name: Pandora141s1_Calakmul_20250702_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20250703T163707.9Z 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_20250702_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: 20250702 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 20250702T134149.1Z 9314.570707 127 1 7.11 2 60.45 73.57 148.10 68.29 0.00 1 0.00 1 0 17 9.244e-03 6.273e-03 6.195e-03 2.480e-03 2.566942e-01 1.336947e-03 2.782081e-03 -6.000000e+00 5.654169e-03 228.02 -2.00 3.11 -2.00 316.68 0.00e+00 1.979405e-04 1.715356e-04 1.779328e-04 -6.000000e+00 2.584969e-04 293.78 -2.00 20.00 -2.00 315.81 0.00e+00 2.018 0.000 302.00 328.00 3 4.1597e+00 3.4825e-03 2.2730e-02 -6.0000e+00 1.3989e-02 1.6203e-02 3.8834e-03 1.1822e-02 -6.0000e+00 1.5048e-02 3.3201e-03 2.2725e-03 5.7667e-03 -6.0000e+00 9.0280e-03 -4.3723e-03 1.0945e-03 1.6131e-03 -6.0000e+00 3.9134e-03 8.6060e-04 -2.6082e-04 7.8997e-05 2.2132e-05 -6.0000e+00 2.8576e-04 -4.2055e-02 -2.1135e-05 12 1 1 12 9 1 99.96 20.23 0.14 -0.04206 -0.04402 13 59 1 5 0 507.060 26.41 20.01 20.23 33.48 40.7 985.36 -1270 352 -2144 447 -1378 -1850 -1746 -746 1235 -1795 -1280 -1370 -1205 294 -1358 -795 -1757 794 709 161 374 1362 598 1152 657 772 687 -871 1694 1547 2295 2176 -205 -1645 -2172 -1224 -1586 143 -508 -213 -1630 -576 -84 -865 -222 -1353 -431 -1709 -425 -173 763 1248 815 766 540 341 302 258 158 870 1141 1588 1864 1015 276 -29 -317 509 1332 1410 466 267 346 360 -327 -454 318 -589 -490 -481 -1123 -1959 -1762 -1669 -1246 -402 -618 -53 -110 498 302 122 -67 173 473 498 711 190 77 -481 -636 -690 310 -96 -782 -681 -861 -612 251 703 549 398 80 64 159 451 838 485 191 -150 -373 -31 459 -3 285 338 667 625 335 159 -222 -558 -189 96 -162 48 106 -58 -33 -288 -96 -420 -181 53 -338 66 -191 -249 -246 -115 204 -317 -228 -253 -243 66 -342 -215 -501 230 212 50 117 426 192 384 229 276 244 -302 553 500 766 775 -78 -645 -835 -466 -646 65 -263 -122 -1004 -365 -54 -566 -145 -886 -278 -1093 -267 -110 497 848 579 562 406 262 233 199 121 666 893 1295 1596 901 246 -24 -261 413 1124 1273 446 262 340 346 -302 -395 259 -472 -405 -425 -1071 -1993 -1868 -1832 -1420 -475 -753 -65 -136 600 349 134 -71 179 505 563 854 242 101 -628 -804 -835 366 -116 -983 -886 -1154 -843 355 1027 821 599 118 91 216 595 1104 656 268 -218 -550 -46 660 -5 391 451 870 820 455 225 -323 -827 -283 148 -257 79 176 -97 -56 -479 -157 -674 SS 20250702T134531.1Z 9314.573276 130 1 2.72 2 59.61 73.72 147.33 69.08 0.00 1 0.00 1 0 17 9.781e-03 6.380e-03 6.129e-03 2.804e-03 2.521242e-01 1.515844e-03 2.728650e-03 -6.000000e+00 5.983880e-03 228.02 -2.00 3.11 -2.00 316.34 0.00e+00 2.912937e-04 1.791066e-04 1.637282e-04 -6.000000e+00 2.735356e-04 293.78 -2.00 20.00 -2.00 315.49 0.00e+00 1.968 0.000 302.00 328.00 3 3.5294e+00 3.9281e-03 2.2187e-02 -6.0000e+00 1.4805e-02 1.2742e-02 4.3693e-03 1.1551e-02 -6.0000e+00 1.5924e-02 2.6063e-03 2.5355e-03 5.6393e-03 -6.0000e+00 9.5538e-03 -4.6174e-03 1.2002e-03 1.5760e-03 -6.0000e+00 4.1423e-03 1.7100e-03 -1.5142e-04 8.9009e-05 2.2049e-05 -6.0000e+00 3.0230e-04 -4.2665e-02 1.9936e-05 12 1 1 12 9 1 99.97 20.21 0.17 -0.04266 -0.04380 7 88 1 5 0 339.920 26.32 19.98 20.21 33.58 40.6 985.35 -1682 242 -833 -928 -1347 -3323 2781 -747 1150 -3449 -791 -998 -1257 1991 994 467 -727 930 -971 1874 793 337 1355 441 1392 305 -217 -1681 609 749 1647 940 -13 -1019 -1975 -2599 -1750 -60 -869 -289 -544 4 -365 -630 -140 -1703 -899 -1138 -390 -150 158 118 1213 795 571 712 227 295 369 479 1210 1920 1849 1002 1306 -380 -303 381 1040 1478 778 177 -36 100 327 168 -881 -848 -366 -557 -1013 -1932 -1575 -1747 -1262 -913 -207 -318 252 205 102 555 58 93 290 362 407 422 -124 52 -699 -1001 37 54 -487 -787 -702 -235 490 639 339 494 -122 34 548 472 650 592 329 -207 -257 -141 149 371 70 266 -6 607 614 -112 -314 -116 -354 -306 -171 -68 363 -23 81 -17 -80 -584 -288 44 -154 -165 -223 -541 449 -136 225 -727 -165 -215 -296 508 282 143 -233 304 -331 643 279 120 485 165 538 122 -86 -652 224 272 615 374 -5 -437 -834 -1100 -781 -30 -483 -175 -351 3 -248 -432 -96 -1174 -610 -763 -258 -100 109 84 895 605 445 563 182 235 293 380 977 1607 1623 909 1179 -335 -256 318 900 1357 753 177 -36 98 306 149 -743 -700 -309 -503 -979 -1982 -1678 -1926 -1441 -1080 -251 -393 309 247 118 611 61 98 311 410 489 532 -162 67 -877 -1209 43 64 -608 -1018 -932 -319 683 920 500 732 -178 48 737 618 849 791 455 -296 -373 -203 212 517 94 351 -8 790 823 -156 -451 -168 -524 -464 -266 -109 588 -37 133 -28 -127 -920 SS 20250702T135829.4Z 9314.582285 136 1 4.49 2 56.65 74.23 144.57 71.63 0.00 1 0.00 1 0 17 1.481e-02 8.195e-03 1.157e-02 5.405e-03 2.305693e-01 2.921668e-03 2.509515e-03 -6.000000e+00 9.061276e-03 228.02 -2.00 3.11 -2.00 316.28 0.00e+00 2.023857e-04 3.414611e-04 1.853598e-04 -6.000000e+00 4.141582e-04 293.78 -2.00 20.00 -2.00 315.43 0.00e+00 1.813 0.000 302.00 328.00 3 5.1603e+00 7.5683e-03 2.0403e-02 -6.0000e+00 2.2419e-02 1.4129e-02 8.4153e-03 1.0584e-02 -6.0000e+00 2.4112e-02 6.0857e-03 4.8787e-03 5.1639e-03 -6.0000e+00 1.4466e-02 -5.1033e-03 2.3028e-03 1.4499e-03 -6.0000e+00 6.2738e-03 4.0170e-04 6.0843e-05 1.7224e-04 2.0612e-05 -6.0000e+00 4.5764e-04 -4.4847e-02 -1.3486e-05 12 9 1 12 1 1 999.00 20.15 0.18 -0.04485 -0.04439 2 20 1 5 0 1494.830 26.32 19.99 20.15 34.22 40.2 985.34 -3559 2064 2656 -5695 -3032 -1582 1127 -3981 6537 4460 -2281 -1232 1220 -1369 125 -350 -1205 813 2421 515 1384 1519 446 -1139 878 413 1883 -770 222 -1846 -2345 3525 -77 283 -3086 -2223 352 -1248 -1701 -1014 -932 -1003 -747 -2019 783 -1664 -218 27 -743 1278 1092 1112 279 -726 803 785 654 2117 -163 11 3210 1520 1950 663 980 -1113 -44 -279 894 1148 651 252 136 752 378 -438 322 -105 -318 -691 -826 -1576 -1184 -2630 -1604 -1086 440 -111 -220 -361 1013 -239 -309 1049 -480 1108 336 356 -15 -714 -32 -2018 -243 264 -763 -1220 -779 -53 178 599 559 486 -25 333 30 1160 498 331 301 276 377 -331 272 181 -480 786 160 390 742 -74 16 -350 199 -254 60 -129 159 186 -165 -399 -546 -221 -647 383 497 -1091 -525 -261 190 -771 1256 906 -495 -273 287 -367 36 -110 -396 271 818 181 492 542 163 -438 346 167 747 -300 82 -685 -902 1372 -32 120 -1306 -932 154 -621 -960 -628 -613 -684 -519 -1425 542 -1165 -149 18 -497 848 748 794 209 -563 629 624 526 1681 -131 9 2579 1288 1731 610 895 -989 -37 -233 773 1058 634 252 136 736 355 -389 269 -85 -266 -620 -795 -1613 -1260 -2924 -1844 -1295 536 -138 -273 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