File name: Pandora141s1_Calakmul_20250123_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20250124T061653.0Z 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_20250123_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: 20250123 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 20250123T170807.6Z 9154.713976 379 1 59.72 2 40.76 157.46 72.76 237.22 0.00 1 0.00 1 0 17 8.177e-03 6.332e-03 2.454e-03 1.570e-03 1.526174e-01 8.428075e-04 1.703558e-03 -6.000000e+00 4.938680e-03 224.63 -2.00 3.11 -2.00 315.20 0.00e+00 3.567457e-04 7.813834e-05 9.383224e-05 -6.000000e+00 2.254586e-04 290.48 -2.00 20.00 -2.00 314.50 0.00e+00 1.319 0.000 302.00 328.00 3 6.1266e+00 2.1447e-03 1.4436e-02 -6.0000e+00 1.2138e-02 4.6286e-02 2.3754e-03 6.9426e-03 -6.0000e+00 1.3094e-02 4.9926e-03 1.3671e-03 3.4222e-03 -6.0000e+00 7.8603e-03 -6.5994e-03 6.1924e-04 9.7591e-04 -6.0000e+00 3.4198e-03 2.8233e-04 -2.0441e-04 4.9928e-05 1.5342e-05 -6.0000e+00 2.5245e-04 -4.2605e-02 1.0219e-05 11 1 0 11 8 0 99.96 20.16 0.16 -0.04260 -0.04414 27 27 1 5 0 2211.180 26.32 19.98 20.16 28.63 36.3 991.44 1231 -693 -920 -1313 -1106 -1604 -223 1416 967 -1129 -1296 -919 -113 -148 -182 110 420 489 688 868 547 631 523 1468 1065 571 -38 -122 533 542 1497 1492 981 -1211 -2158 -2440 -2383 -634 -435 -970 -780 -923 -566 -734 -244 -256 -944 -1092 -346 -121 163 470 806 421 904 915 480 180 317 477 1111 1312 1978 968 320 -117 -300 26 709 1069 823 594 644 458 492 -387 -1124 -1171 -1056 -1173 -1510 -1914 -1689 -1447 -549 -185 -1 138 292 485 266 -362 -361 104 41 179 525 431 217 -109 -690 -841 -423 -436 -819 -811 -520 57 491 749 672 571 194 260 -76 205 -101 379 473 38 38 176 -58 114 102 85 237 136 497 43 -235 -242 -224 65 -141 40 66 105 100 -100 -155 -562 363 -220 -293 -396 -305 -424 -60 411 305 -372 -426 -304 -40 -57 -76 48 189 223 320 412 264 304 254 730 550 301 -20 -61 251 248 690 717 492 -620 -1076 -1209 -1252 -370 -287 -710 -606 -741 -461 -602 -199 -207 -750 -846 -261 -91 124 372 661 355 773 793 420 157 275 415 984 1212 1905 962 315 -110 -265 22 633 1020 831 619 672 468 479 -355 -965 -968 -889 -1057 -1463 -1975 -1815 -1610 -634 -222 -1 176 369 599 314 -403 -378 106 42 197 614 532 277 -137 -843 -984 -484 -511 -1007 -1036 -683 76 678 1065 973 826 273 348 -97 251 -124 475 619 51 53 245 -79 152 132 107 288 165 619 55 -313 -325 -305 91 -203 59 100 161 153 -152 -233 -831 SS 20250123T171852.4Z 9154.721440 382 1 11.27 2 39.85 161.12 74.87 238.42 0.00 1 0.00 1 0 17 7.988e-03 6.483e-03 2.310e-03 1.709e-03 1.468032e-01 9.250968e-04 1.636575e-03 -6.000000e+00 4.824044e-03 224.63 -2.00 3.11 -2.00 314.50 0.00e+00 2.718784e-04 7.514278e-05 4.769268e-05 -6.000000e+00 2.202342e-04 290.48 -2.00 20.00 -2.00 313.88 0.00e+00 1.301 0.000 302.00 328.00 3 4.9023e+00 2.3376e-03 1.4163e-02 -6.0000e+00 1.1856e-02 1.9645e-02 2.5781e-03 6.6920e-03 -6.0000e+00 1.2791e-02 7.1389e-03 1.4872e-03 3.2952e-03 -6.0000e+00 7.6780e-03 -6.9410e-03 6.6114e-04 9.3839e-04 -6.0000e+00 3.3402e-03 9.9805e-04 -1.1990e-04 5.4021e-05 1.5259e-05 -6.0000e+00 2.4663e-04 -4.2548e-02 -8.0731e-06 12 9 1 12 9 1 87.53 20.17 0.24 -0.04255 -0.04345 11 64 1 5 0 938.750 26.32 20.00 20.17 29.35 36.1 991.28 424 -68 -828 -1782 -1771 -1251 427 536 954 -1085 -1172 -1314 -428 601 -550 -193 156 1012 396 843 406 698 1083 1289 1228 818 -10 -381 714 817 993 2003 1336 -1039 -2342 -1578 -1245 119 -623 -890 -886 -979 -780 -570 -420 -734 -636 -931 -776 -345 259 599 1098 784 676 648 486 296 423 817 1204 1440 1482 969 295 -67 -464 -18 966 1115 575 307 669 195 -140 -327 -623 -1021 -1044 -1212 -1359 -1811 -1571 -1815 -977 -454 -267 28 90 48 383 105 -171 642 188 513 628 348 258 -73 -652 -606 132 -198 -701 -769 -364 -288 214 874 457 471 84 277 -59 330 401 464 298 -88 -181 162 33 221 227 173 631 338 410 431 -383 -354 -193 -118 -155 -243 101 110 -54 -298 -6 -513 162 -28 -339 -686 -615 -444 154 197 380 -454 -487 -551 -191 273 -277 -103 85 560 211 456 223 381 595 731 726 495 -6 -216 400 440 542 1135 795 -591 -1385 -914 -723 79 -458 -701 -713 -822 -666 -488 -358 -618 -520 -777 -625 -275 211 512 923 685 604 588 445 270 382 736 1116 1339 1464 994 298 -63 -424 -16 889 1070 600 318 689 206 -139 -310 -568 -885 -930 -1115 -1310 -1904 -1662 -2031 -1100 -543 -320 34 110 60 439 115 -181 650 198 553 740 424 312 -92 -775 -707 149 -232 -840 -977 -459 -378 279 1183 640 656 112 357 -73 406 490 563 387 -117 -246 219 43 292 285 218 756 405 512 538 -500 -471 -249 -158 -217 -342 146 163 -80 -437 -8 -712 SS 20250123T172802.7Z 9154.727809 385 1 4.60 2 39.21 164.37 76.69 239.40 0.00 1 0.00 1 0 17 7.603e-03 6.325e-03 1.154e-03 8.832e-04 1.471373e-01 4.794266e-04 1.648501e-03 -6.000000e+00 4.591763e-03 224.63 -2.00 3.11 -2.00 314.30 0.00e+00 2.850060e-04 3.765787e-05 3.917975e-05 -6.000000e+00 2.096310e-04 290.48 -2.00 20.00 -2.00 313.71 0.00e+00 1.289 0.000 302.00 328.00 3 2.8198e+00 1.2094e-03 1.4078e-02 -6.0000e+00 1.1285e-02 1.1741e-02 1.3328e-03 6.7230e-03 -6.0000e+00 1.2175e-02 2.4785e-03 7.6972e-04 3.3110e-03 -6.0000e+00 7.3083e-03 -3.8986e-03 3.4016e-04 9.4422e-04 -6.0000e+00 3.1793e-03 8.1257e-03 -1.5454e-04 2.7806e-05 1.5564e-05 -6.0000e+00 2.3475e-04 -4.1922e-02 1.4458e-05 12 1 1 12 1 1 88.88 20.17 0.16 -0.04192 -0.04308 40 535 1 5 0 112.090 26.32 19.96 20.17 30.25 36.1 991.19 592 -164 -992 -1710 -1715 -988 516 958 731 -398 -1322 -770 -37 351 14 -171 -209 528 443 827 528 597 1165 744 1271 681 -79 -335 510 817 1203 1846 875 -992 -2046 -1819 -1550 -576 -431 -979 -1023 -1006 -793 -689 -445 -639 -616 -789 -277 219 355 895 844 624 630 887 669 309 418 695 1058 1437 1462 950 258 -339 -182 366 1007 833 394 392 328 290 125 -302 -576 -735 -813 -999 -1152 -1762 -1987 -1690 -962 -509 -256 69 -58 290 117 48 3 501 383 603 558 298 43 -275 -610 -667 84 -132 -691 -659 -664 -230 314 693 505 339 227 -63 253 496 605 515 280 -122 -45 -101 41 266 176 106 540 634 459 370 -337 -307 -197 -12 -37 -135 56 -57 -110 -100 -222 -509 240 -71 -431 -697 -677 -366 195 398 309 -175 -582 -340 -17 171 7 -92 -115 295 253 481 312 351 687 456 763 419 -48 -203 287 468 698 1050 524 -606 -1210 -1059 -969 -389 -324 -798 -860 -841 -675 -589 -377 -561 -526 -648 -230 180 285 752 742 543 561 801 610 281 376 625 979 1345 1455 941 263 -321 -165 336 925 807 398 412 344 295 124 -286 -520 -628 -714 -917 -1118 -1869 -2151 -1847 -1112 -602 -307 85 -71 353 138 53 3 514 407 662 644 359 52 -342 -719 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