File name: Pandora141s1_Calakmul_20250309_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20250310T061607.9Z 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 v1.8.74 Instrument operation file used: Pandora141_OF_v2d20230802.txt Instrument calibration file used: Pandora141s1_CF_v3d20231011.txt Level 1 file used: Pandora141s1_Calakmul_20250309_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: 20250309 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 20250309T132608.1Z 9199.559816 184 1 60.09 2 73.03 100.64 132.96 337.80 0.00 1 0.00 1 0 17 5.104e-02 5.259e-03 5.357e-02 3.992e-03 3.822610e-01 2.163359e-03 4.017704e-03 -6.000000e+00 3.114680e-02 226.83 -2.00 3.11 -2.00 319.54 0.00e+00 1.459526e-04 6.146887e-04 3.687319e-04 -6.000000e+00 1.411343e-03 291.12 -2.00 20.00 -2.00 318.73 0.00e+00 3.374 0.000 302.00 328.00 3 4.6760e+00 6.1739e-03 3.6931e-02 -6.0000e+00 7.6926e-02 6.7621e-03 7.3110e-03 1.7842e-02 -6.0000e+00 8.2799e-02 5.1733e-02 5.4740e-03 8.8132e-03 -6.0000e+00 4.9640e-02 -3.0524e-02 2.8606e-03 2.5246e-03 -6.0000e+00 2.1558e-02 1.1935e-04 4.5056e-04 1.3154e-04 3.2188e-05 -6.0000e+00 1.5758e-03 -5.3608e-02 1.3269e-04 11 1 0 11 8 0 99.99 19.87 0.23 -0.05361 -0.05022 213 213 1 5 0 282.090 26.00 19.99 19.87 31.19 38.5 981.37 -4173 7005 -25429 22171 -11844 -5445 14687 25782 15369 -2808 2938 19573 -8421 -326 10469 -9527 -4245 3587 -1219 -3976 56 -2653 5039 1829 6574 5216 -5294 -4235 -100 1103 2119 -684 2275 3097 4097 -575 5633 -1217 -308 -1770 -2552 -2436 -2021 611 811 -1365 -2676 -3100 -565 -1393 1750 458 -30 743 870 1557 -503 288 -207 752 600 2213 1649 459 277 -933 -521 458 1713 242 1028 365 121 314 -357 1035 -417 736 -882 -158 -614 -848 -1470 -1543 -1430 -1066 426 495 794 190 346 705 -26 -13 162 393 249 589 207 -34 -325 -567 -159 97 -840 -804 -701 -391 206 704 131 588 -92 -303 -116 353 382 411 -153 158 -62 -192 -102 -16 185 -370 682 602 174 85 -853 -175 -182 82 -180 -76 327 -63 209 129 -173 -116 -90 152 -773 431 -294 -125 300 535 389 -89 92 567 -356 -15 508 -622 -287 240 -90 -315 4 -219 400 160 588 494 -556 -429 -9 105 215 -79 281 395 511 -75 752 -202 -60 -406 -652 -662 -569 171 229 -396 -786 -915 -165 -422 549 157 -11 290 354 651 -219 125 -89 321 265 1032 843 253 155 -512 -273 239 945 150 686 256 85 213 -228 600 -228 390 -502 -100 -438 -669 -1253 -1392 -1369 -1078 446 532 851 199 341 647 -23 -11 149 399 280 723 269 -45 -403 -657 -176 109 -1006 -1016 -926 -541 301 1092 214 980 -152 -478 -173 503 545 606 -239 256 -101 -313 -162 -25 274 -531 946 849 261 137 -1465 -309 -333 157 -359 -158 694 -137 452 274 -357 -231 SS 20250309T134307.6Z 9199.571616 197 1 58.88 2 69.08 102.27 134.29 342.48 0.00 1 0.00 1 0 17 4.426e-02 1.096e-02 5.036e-02 8.375e-03 3.159459e-01 4.485482e-03 3.439909e-03 -6.000000e+00 2.696748e-02 226.83 -2.00 3.11 -2.00 318.44 0.00e+00 -3.746385e-04 9.070880e-04 7.076389e-04 -6.000000e+00 1.223893e-03 291.12 -2.00 20.00 -2.00 317.59 0.00e+00 2.773 0.000 302.00 328.00 3 6.6228e+00 1.2102e-02 3.0496e-02 -6.0000e+00 6.6602e-02 1.4158e-01 1.3831e-02 1.5301e-02 -6.0000e+00 7.1721e-02 1.0928e-02 9.0183e-03 7.1619e-03 -6.0000e+00 4.2995e-02 -1.3683e-02 4.6701e-03 2.2671e-03 -6.0000e+00 1.8645e-02 3.0932e-05 -8.7215e-04 2.7284e-04 2.6697e-05 -6.0000e+00 1.3671e-03 -4.9479e-02 -1.1669e-04 12 9 8 11 8 0 99.91 19.88 0.54 -0.04948 -0.05603 24 24 1 5 0 2452.900 26.00 19.96 19.88 31.61 38.6 981.51 24467 2168 -16937 12237 27165 2687 4051 -4152 5330 1274 -5375 -8159 -10130 -4655 -408 -1451 -1901 4018 -2377 7851 -1113 6677 4391 3902 -5624 -385 -7384 5069 1025 -2374 -5246 440 1987 590 -2081 -4537 -2025 -4031 800 -1440 -144 1724 -2014 1538 -1055 -988 423 -4284 -2078 -5151 -45 1157 4070 1120 775 1456 1511 -46 749 1090 1094 -412 3097 2365 2241 803 -780 2627 -542 342 876 -1207 1570 2273 44 1278 -404 -1903 -1996 -2667 -2927 -1596 -3072 -1875 -270 1066 1346 793 93 555 77 -740 -1418 -154 -1950 -402 695 1068 426 -500 319 -1358 136 -1759 -944 -2153 -29 337 1534 1368 177 954 760 -942 -723 -1178 355 167 479 434 -124 762 641 52 197 -685 39 175 730 -596 -1115 -368 -106 59 63 -195 827 1107 363 169 -900 -1123 1025 123 -1178 623 1120 135 212 -262 340 89 -410 -671 -948 -476 -46 -181 -254 533 -349 1087 -172 968 667 631 -1057 -71 -1458 855 172 -409 -983 85 409 126 -446 -993 -467 -1103 247 -522 -56 703 -876 656 -461 -431 180 -1882 -891 -2317 -20 553 2012 598 430 826 870 -27 429 620 641 -261 2047 1657 1579 547 -511 1654 -374 258 710 -1037 1315 1826 34 888 -263 -1218 -1337 -1994 -2440 -1438 -2998 -1907 -287 1184 1561 949 112 643 84 -757 -1366 -144 -1954 -434 817 1361 573 -673 406 -1635 156 -2086 -1173 -2849 -40 476 2255 2133 291 1576 1227 -1464 -1054 -1648 488 238 717 677 -199 1196 982 77 282 -945 52 235 1027 -903 -1778 -600 -177 103 114 -369 1589 2154 711 325 -1696 -2052 SS 20250309T140551.1Z 9199.587397 205 1 14.48 2 63.84 104.62 135.60 349.12 0.00 1 0.00 1 0 17 1.875e-02 7.113e-03 1.182e-02 4.007e-03 2.534617e-01 2.144040e-03 2.753984e-03 -6.000000e+00 1.143242e-02 226.83 -2.00 3.11 -2.00 317.12 0.00e+00 6.068505e-04 3.042890e-04 2.645972e-04 -6.000000e+00 5.185201e-04 291.12 -2.00 20.00 -2.00 316.28 0.00e+00 2.255 0.000 302.00 328.00 3 5.4119e+00 5.6123e-03 2.4597e-02 -6.0000e+00 2.8235e-02 3.9308e-02 6.2820e-03 1.1672e-02 -6.0000e+00 3.0398e-02 9.1084e-03 3.7413e-03 5.7010e-03 -6.0000e+00 1.8223e-02 -7.3664e-03 1.8419e-03 1.6099e-03 -6.0000e+00 7.9086e-03 1.9598e-04 -1.1089e-04 1.2843e-04 2.1077e-05 -6.0000e+00 5.7898e-04 -5.2113e-02 -1.5805e-05 12 9 1 12 9 1 99.99 19.87 0.19 -0.05211 -0.05295 9 41 1 5 0 1447.030 26.00 19.98 19.87 32.27 38.8 981.83 -7934 -3000 -548 -2568 -11323 -3555 4374 -5722 403 -1461 2214 -3557 -229 840 2455 3149 -3036 295 4102 2094 -2166 4033 3499 1085 245 414 1294 -2479 2915 -394 1933 977 187 -823 -3038 904 -2185 -968 -1033 113 -2036 -941 -430 -267 188 -1155 -331 -2149 -1281 1046 549 -639 998 586 1418 1329 0 1 -2 -40 -333 1021 1455 1716 703 506 114 255 1024 1555 1034 1097 1047 380 262 -122 -1021 -491 -1230 -1351 -1694 -1745 -1603 -1711 -369 -486 -218 65 383 640 301 1 -972 973 -66 138 -171 -144 280 -727 -1056 -895 642 -523 -165 -844 -884 255 16 859 614 254 143 142 -155 334 521 378 811 -214 131 490 -216 -85 416 -44 114 665 555 79 -555 -236 -219 34 -9 163 358 -32 -98 -471 -67 -446 -972 -382 -70 -318 -1405 -394 471 -747 55 -210 313 -547 -38 155 499 693 -742 73 1012 542 -595 1055 935 309 74 128 395 -752 808 -111 555 303 62 -280 -1028 294 -779 -389 -479 58 -1151 -551 -257 -161 113 -701 -197 -1278 -750 607 332 -410 662 404 998 955 0 0 -1 -29 -250 795 1198 1463 603 416 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