File name: Pandora141s1_Calakmul_20250505_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20250506T060008.8Z 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_20250505_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: 20250505 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 20250505T130723.9Z 9256.546805 144 1 60.02 2 67.98 79.30 146.86 2.31 0.00 1 0.00 1 0 17 2.559e-01 2.366e-02 2.047e-01 2.539e-02 3.179783e-01 1.381897e-02 3.431597e-03 -6.000000e+00 1.582990e-01 229.82 -2.00 3.11 -2.00 318.89 0.00e+00 1.174814e-03 3.096749e-03 1.152045e-04 -6.000000e+00 7.129734e-03 292.67 -2.00 20.00 -2.00 318.00 0.00e+00 2.643 0.000 302.00 328.00 3 8.0242e+00 3.8110e-02 2.9570e-02 -6.0000e+00 3.9359e-01 7.7149e-02 4.3742e-02 1.5203e-02 -6.0000e+00 4.2217e-01 -2.4498e-02 2.9071e-02 7.3888e-03 -6.0000e+00 2.5275e-01 3.5674e-03 1.5108e-02 2.5044e-03 -6.0000e+00 1.0968e-01 8.8358e-06 8.1392e-04 8.4701e-04 3.0040e-05 -6.0000e+00 7.9011e-03 -7.2623e-02 2.8283e-04 12 9 8 11 8 0 99.98 19.91 1.35 -0.07262 -0.06651 20 20 1 5 0 3000.530 26.11 20.02 19.91 32.82 37.5 980.68 -22049 229989 114891 43047 -17852 -10403 9660 -10830 -7353 -19772 -502 43742 711 13346 -1005 100540 -13477 -16050 -7999 11654 34040 -24237 21796 21497 19462 13951 771 1311 -20034 -15075 3972 1041 -9818 10812 6358 -13655 13939 19465 3032 3747 6997 -6759 -9424 -121 -2495 16940 -4767 6495 4034 -4660 971 -1562 3607 -2550 411 -3895 2753 -3992 6127 5316 602 2703 3167 -4815 1286 -1203 2470 -3892 2967 -797 3386 -1214 -2320 -1196 4070 3089 -3506 -42 -3291 -3955 -1659 -1965 3050 -1150 -2847 3887 -2426 2496 -719 731 -2070 3208 -325 -2516 -2396 -2249 1968 -3376 -56 1370 -1768 3191 1794 356 641 -310 -1935 -1398 4209 940 4154 529 4115 531 -3010 -973 1356 -2576 1237 -947 -2183 349 -2530 -296 -2784 -46 -601 2790 -476 -469 705 60 -475 0 -311 635 -427 1064 -633 250 487 22 -1276 5694 2845 1548 -1045 -541 430 -641 -466 -1486 -32 1949 52 1003 -99 4315 -1777 -2277 -1100 1388 3383 -4174 2485 2572 2505 1963 123 202 -3613 -2568 595 175 -1980 1865 1122 -2869 2398 3649 780 1106 2214 -2588 -3838 -46 -974 5515 -1892 2291 1450 -1845 382 -673 1580 -1247 203 -2061 1392 -2155 2974 2591 315 1474 1864 -3248 832 -767 1434 -2356 1773 -545 2426 -954 -1857 -919 2797 1966 -2178 -24 -2028 -2714 -1247 -1636 2606 -1082 -2891 3941 -2752 2797 -832 814 -2229 3047 -297 -2290 -2272 -2332 2173 -4306 -74 1783 -2262 3629 1973 402 762 -395 -2624 -1979 5966 1464 6600 888 6553 830 -4555 -1372 1855 -3774 1846 -1520 -3637 565 -4105 -455 -4203 -65 -821 3704 -687 -724 1139 102 -826 0 -591 1254 -877 2201 -1337 515 969 43 SS 20250505T134400.2Z 9256.572225 171 1 38.88 2 59.42 81.50 145.56 17.38 0.00 1 0.00 1 0 17 9.150e-03 5.491e-03 4.894e-03 1.568e-03 2.341951e-01 8.495878e-04 2.531629e-03 -6.000000e+00 5.655591e-03 229.82 -2.00 3.11 -2.00 317.32 0.00e+00 4.411313e-04 1.247053e-04 1.662396e-04 -6.000000e+00 2.547625e-04 292.67 -2.00 20.00 -2.00 316.43 0.00e+00 1.958 0.000 302.00 328.00 3 4.6865e+00 2.2436e-03 2.1791e-02 -6.0000e+00 1.4062e-02 -1.2094e-02 2.5066e-03 1.0943e-02 -6.0000e+00 1.5088e-02 1.5924e-02 1.4954e-03 5.3143e-03 -6.0000e+00 9.0330e-03 -1.1403e-02 7.3790e-04 1.4820e-03 -6.0000e+00 3.9155e-03 5.6223e-04 -3.7238e-04 5.0939e-05 1.9430e-05 -6.0000e+00 2.8259e-04 -6.9435e-02 1.3079e-04 12 1 1 12 1 1 100.00 19.91 0.14 -0.06944 -0.07223 172 267 1 5 0 224.680 26.11 20.02 19.91 33.41 37.7 981.01 353 -1384 -415 -2019 1378 -1047 818 256 2584 556 -2228 -115 -1738 994 -443 886 -1711 334 -91 -146 346 701 1700 778 1640 422 204 -861 1931 -12 441 2635 167 429 -2721 -2155 -2422 -776 -623 -1487 -1034 -1317 -291 -995 -559 -536 -1057 -1060 -862 451 143 886 697 427 550 852 619 215 715 121 1067 1259 2004 1133 398 489 -500 362 531 1501 564 377 522 428 282 37 -231 -640 -778 -696 -927 -1758 -1803 -1748 -1219 -327 -193 357 -96 519 405 200 -155 291 268 289 669 138 332 -296 -579 -728 -383 -114 -442 -532 -886 -182 -96 634 423 268 295 -265 163 243 411 428 395 8 -56 -190 -7 66 -31 121 197 324 437 345 116 -190 -326 40 62 -103 86 73 -55 -29 -171 -390 38 -167 -51 -245 150 -110 87 30 328 76 -316 -16 -272 171 -87 187 -390 78 -22 -36 88 179 436 209 460 124 60 -247 515 -3 119 746 52 136 -864 -670 -797 -286 -267 -729 -550 -740 -167 -582 -326 -312 -611 -601 -481 249 82 531 441 282 373 589 435 152 500 85 759 940 1584 942 335 394 -383 269 408 1242 505 352 491 395 249 30 -176 -469 -581 -561 -818 -1686 -1830 -1855 -1352 -379 -233 442 -120 632 471 219 -159 290 274 315 784 174 436 -392 -742 -886 -450 -135 -551 -696 -1206 -255 -140 953 659 421 455 -393 229 326 547 584 563 12 -86 -292 -11 97 -45 166 262 431 599 496 173 -291 -507 64 103 -177 150 129 -99 -51 -298 -666 SS 20250505T134841.8Z 9256.575484 174 1 1.05 2 58.32 81.78 145.24 19.21 0.00 1 0.00 1 0 17 8.015e-03 5.774e-03 2.564e-03 1.334e-03 2.264510e-01 7.306230e-04 2.465737e-03 -6.000000e+00 4.952912e-03 229.82 -2.00 3.11 -2.00 315.98 0.00e+00 3.742462e-04 7.811584e-05 8.911149e-05 -6.000000e+00 2.231287e-04 292.67 -2.00 20.00 -2.00 315.16 0.00e+00 1.897 0.000 302.00 328.00 3 1.3579e+00 1.8905e-03 2.1081e-02 -6.0000e+00 1.2315e-02 -2.0484e-02 2.0888e-03 1.0518e-02 -6.0000e+00 1.3215e-02 5.1212e-03 1.2072e-03 5.1122e-03 -6.0000e+00 7.9113e-03 -4.5863e-03 5.6146e-04 1.4284e-03 -6.0000e+00 3.4283e-03 1.6967e-02 -4.6340e-04 4.2496e-05 2.0445e-05 -6.0000e+00 2.4756e-04 -6.8797e-02 7.9857e-05 12 1 1 12 1 1 99.02 19.91 0.15 -0.06880 -0.07228 31 1846 1 5 0 32.490 26.11 19.99 19.91 33.71 37.7 981.06 -417 -353 210 -1087 -2313 -2088 -1305 557 1424 -682 -2177 -1258 -119 -761 670 -625 -456 256 172 386 -224 842 1007 1331 1296 1150 195 -540 123 408 1350 2379 1075 -444 -1730 -1513 -1580 -527 -711 -502 -689 -782 -419 -777 -707 -647 -738 -333 -708 182 321 747 812 591 798 642 237 488 101 591 817 1359 1669 1165 638 -34 -138 280 637 1064 486 396 300 236 146 -35 -655 -1024 -627 -628 -1144 -1763 -1799 -1641 -1087 -525 -174 15 346 122 297 338 13 427 408 413 489 397 54 -409 -583 -731 -266 -127 -508 -696 -822 -426 162 572 399 272 173 8 183 403 439 682 353 -47 -180 -116 -45 214 270 273 510 502 430 519 35 -290 -202 213 -63 -121 52 -27 -117 -290 -237 -476 -83 -77 47 -235 -462 -425 -270 115 324 -167 -546 -319 -32 -219 214 -221 -170 92 64 148 -88 328 397 545 559 514 88 -234 50 160 539 1005 491 -211 -809 -692 -768 -274 -412 -317 -456 -548 -302 -569 -518 -471 -529 -232 -483 123 225 553 604 462 643 530 190 391 84 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