File name: Pandora141s1_Calakmul_20250404_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20250405T060813.2Z 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_20250404_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: 20250404 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 20250404T124726.5Z 9225.532946 69 1 10.09 2 77.04 88.05 131.14 19.12 0.00 1 0.00 1 0 17 1.036e-01 7.214e-03 1.604e-01 5.783e-03 4.887841e-01 3.189685e-03 5.116912e-03 -6.000000e+00 6.387450e-02 228.78 -2.00 3.11 -2.00 319.88 0.00e+00 1.911695e-03 1.048671e-03 3.974784e-04 -6.000000e+00 2.906802e-03 291.79 -2.00 20.00 -2.00 319.10 0.00e+00 4.342 0.000 302.00 328.00 3 3.4898e+00 9.3626e-03 4.7588e-02 -6.0000e+00 1.5830e-01 -6.3844e-03 1.1411e-02 2.3058e-02 -6.0000e+00 1.7023e-01 1.9305e-02 9.4212e-03 1.1679e-02 -6.0000e+00 1.0174e-01 -1.5339e-02 4.8831e-03 3.9316e-03 -6.0000e+00 4.3884e-02 1.4243e-04 -7.6778e-04 1.8272e-04 4.6920e-05 -6.0000e+00 3.2008e-03 -4.9620e-02 -1.1160e-04 12 9 1 12 1 1 99.95 19.90 0.24 -0.04962 -0.05539 9 60 1 5 0 1007.550 26.11 20.01 19.90 30.49 37.9 982.49 21273 -48774 31604 -8384 12651 900000 -60416 -4290 21187 8172 -42333 15546 -14061 -1925 -6498 -20897 10454 11302 -2716 -16120 12478 -26725 16402 -3011 -12221 16725 -13931 -1023 -14773 -1176 -14772 17541 -973 -4762 -9664 -2216 -2937 -3639 5691 -914 -3277 -3443 -827 3911 -1315 6017 -2935 4608 -957 1648 2256 -1158 1906 -1534 1806 -993 609 -1980 1677 -415 1853 3995 1499 3070 942 2627 -547 131 -777 1626 193 433 1623 249 67 -810 704 -1114 -1102 -1067 -1277 -699 -2856 -1809 -1191 -182 -184 40 -183 357 985 1030 892 1101 1810 855 -201 -32 199 -798 -951 216 -661 239 -962 -406 -519 -1031 -298 66 134 38 102 -21 132 369 573 496 515 407 -205 254 -446 -294 195 86 181 406 454 -31 716 -413 -175 297 -121 -167 -144 66 -239 -249 69 9 146 -749 241 -92 108 900000 -1094 -52 226 106 -938 221 -315 -47 -199 -845 351 409 -120 -852 524 -1652 706 -167 -795 872 -979 -63 -1025 -75 -1198 1207 -89 -473 -998 -216 -315 -461 790 -157 -638 -719 -177 821 -294 1280 -686 1023 -230 407 597 -345 597 -528 633 -370 229 -763 620 -157 710 1619 681 1477 475 1281 -268 65 -418 947 122 285 1056 158 40 -453 367 -589 -625 -679 -909 -543 -2415 -1598 -1103 -176 -185 41 -188 356 934 927 774 966 1683 879 -229 -39 256 -1037 -1189 253 -749 272 -1152 -506 -674 -1406 -426 100 214 63 165 -34 201 545 846 754 814 663 -336 412 -711 -457 295 127 262 599 709 -51 1252 -752 -327 574 -244 -347 -305 142 -511 -524 142 17 SS 20250404T125229.1Z 9225.536448 72 1 11.55 2 75.85 88.44 130.76 20.42 0.00 1 0.00 1 0 17 2.687e-01 1.216e-02 2.217e-01 1.039e-02 4.590378e-01 5.726221e-03 4.833741e-03 -6.000000e+00 1.651460e-01 228.78 -2.00 3.11 -2.00 319.82 0.00e+00 -1.073152e-03 1.830797e-03 9.798568e-04 -6.000000e+00 7.515892e-03 291.79 -2.00 20.00 -2.00 319.04 0.00e+00 3.999 0.000 302.00 328.00 3 4.7874e+00 1.6779e-02 4.4274e-02 -6.0000e+00 4.0967e-01 7.9469e-04 2.0297e-02 2.2656e-02 -6.0000e+00 4.4028e-01 2.8252e-02 1.6290e-02 1.0614e-02 -6.0000e+00 2.6379e-01 -1.8683e-02 8.4482e-03 3.4048e-03 -6.0000e+00 1.1470e-01 5.4994e-05 4.6729e-04 3.3584e-04 3.7105e-05 -6.0000e+00 8.3035e-03 -5.3050e-02 1.8464e-04 12 9 9 12 9 1 99.90 19.90 0.26 -0.05305 -0.04954 4 26 1 5 0 2308.610 26.11 19.99 19.90 30.74 37.8 982.52 -95575 900000 -83720 -4996 -67724 -65650 53956 -59440 28222 -51561 174580 -33217 87506 49179 -58222 18291 43998 24922 3462 54829 -17881 8460 34072 -15626 13158 -17394 54886 -24140 62507 -208 10482 -4267 1259 6037 -9915 -11873 12403 6958 -175 -1596 981 2037 4212 -894 10645 -2750 -1025 -1257 1547 -4150 -1107 -5212 1256 2600 1667 3651 -4034 -1008 730 1158 299 593 3310 975 5269 1689 3298 -1824 3478 2305 -2157 1715 -588 2570 417 1049 -381 2512 763 2520 -1238 -3778 -2612 -2394 -1949 -1729 -1041 700 -1003 152 -602 532 1020 2388 -577 575 267 -242 -548 -178 660 -626 175 -927 756 -2397 -21 -595 319 1284 851 -329 130 -242 12 93 914 -538 691 218 206 98 393 -235 -351 596 -1178 859 345 91 -152 382 -8 -401 -607 576 1006 -205 -485 -863 482 -242 -2473 900000 -2334 -66 -1518 -1426 546 -1499 355 -1483 1768 -928 919 885 -3372 593 1235 901 163 1684 -1124 426 1411 -1115 778 -1446 2349 -2113 2384 -15 731 -387 120 579 -1097 -1350 1224 851 -27 -296 198 436 923 -210 2267 -669 -247 -306 376 -1110 -310 -1649 405 884 601 1346 -1634 -399 282 444 119 252 1505 485 2592 838 1567 -919 1801 1336 -1406 1127 -394 1621 252 582 -200 1276 420 1532 -872 -2994 -2200 -2125 -1821 -1702 -1063 723 -1049 154 -581 481 879 2048 -539 586 301 -298 -710 -230 813 -731 195 -1056 892 -3038 -27 -812 458 1947 1361 -544 212 -383 19 136 1333 -818 1083 355 339 159 623 -365 -529 865 -1700 1246 532 151 -266 688 -16 -778 -1227 1194 2126 -443 -1048 -1836 987 -483 SS 20250404T130231.6Z 9225.543421 75 1 15.42 2 73.47 89.22 129.93 22.95 0.00 1 0.00 1 0 17 6.080e-02 7.769e-03 7.235e-02 6.051e-03 4.050595e-01 3.283288e-03 4.313945e-03 -6.000000e+00 3.731032e-02 228.78 -2.00 3.11 -2.00 319.20 0.00e+00 -3.367741e-04 8.505020e-04 5.810520e-04 -6.000000e+00 1.686027e-03 291.79 -2.00 20.00 -2.00 318.37 0.00e+00 3.457 0.000 302.00 328.00 3 4.7677e+00 9.1862e-03 3.8353e-02 -6.0000e+00 9.2550e-02 2.9160e-02 1.0747e-02 1.9418e-02 -6.0000e+00 9.9522e-02 -3.2392e-03 7.8757e-03 9.2994e-03 -6.0000e+00 5.9590e-02 -1.5856e-03 4.1437e-03 2.7422e-03 -6.0000e+00 2.5752e-02 9.7862e-05 -9.6340e-04 1.9435e-04 3.2824e-05 -6.0000e+00 1.8793e-03 -4.9534e-02 -1.5369e-04 12 9 1 12 1 1 99.99 19.91 0.32 -0.04953 -0.05677 9 39 1 5 0 1541.300 26.11 20.00 19.91 31.36 37.5 982.62 -9185 1011 12524 -9384 17421 -7503 14824 -30992 -9083 17227 -25055 14750 -1250 10113 22543 8254 -1644 15297 9730 -15 13305 -6877 656 -627 6958 121 -191 -1532 549 11013 -4044 7745 -12954 4747 -2799 -41 -2662 -5931 -2055 -3917 1863 -3022 629 -5321 -1264 -1516 -906 -1009 -3145 -892 699 2700 -1709 2474 2598 307 2571 -1098 562 -367 1604 3433 1904 445 1224 557 -34 -380 1530 1987 903 127 23 -776 -1067 684 -257 888 281 -879 -2027 -1974 -955 -1880 95 -758 435 444 435 762 -176 1204 989 -649 411 422 959 192 -306 -258 -933 -1020 -289 -159 -1437 -710 -1105 -428 74 462 764 179 606 -231 129 -50 612 303 330 643 -432 -762 701 234 130 -59 231 721 -100 204 -57 -451 -175 -627 71 22 257 -23 -38 383 -144 -341 -227 25 296 -264 358 -191 327 -1184 -316 501 -1128 492 -56 477 1101 519 -123 1042 737 -1 1051 -667 61 -64 706 14 -22 -171 59 1083 -496 950 -2109 680 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