File name: Pandora141s1_Calakmul_20250320_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20250321T172117.2Z 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 v1.8.74 Instrument operation file used: Pandora141_OF_v2d20230802.txt Instrument calibration file used: Pandora141s1_CF_v3d20231011.txt Level 1 file used: Pandora141s1_Calakmul_20250320_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: 20250320 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 20250320T125235.3Z 9210.536520 255 1 60.25 2 78.72 93.77 58.14 219.02 0.00 1 0.00 1 0 17 4.870e-01 7.483e-03 1.892e-01 4.521e-03 5.570497e-01 2.579741e-03 5.814630e-03 -6.000000e+00 2.997557e-01 227.66 -2.00 3.11 -2.00 320.80 0.00e+00 6.225176e-04 1.138597e-03 1.364476e-03 -6.000000e+00 1.376703e-02 291.39 -2.00 20.00 -2.00 320.12 0.00e+00 4.938 0.000 302.00 328.00 3 3.6768e+00 8.5043e-03 5.4436e-02 -6.0000e+00 7.4288e-01 -1.3395e-02 1.1157e-02 2.7633e-02 -6.0000e+00 8.0056e-01 -2.8149e-03 1.0098e-02 1.3856e-02 -6.0000e+00 4.7736e-01 -5.8022e-03 4.9582e-03 3.9614e-03 -6.0000e+00 2.0778e-01 6.4751e-05 -3.7364e-04 1.4656e-04 5.6694e-05 -6.0000e+00 1.5402e-02 -4.8883e-02 -1.1183e-04 11 9 0 11 8 0 97.13 19.90 0.27 -0.04888 -0.05169 60 60 1 5 0 1003.920 26.11 19.97 19.90 27.37 38.0 985.10 900000 37282 900000 -132393 491605 -122846 21792 900000 -101990 -30082 -97817 -28252 -65155 -3746 -25464 -42223 -28904 10176 -8409 -51508 23894 -39955 797 -16915 26613 9837 -17500 -13668 -16440 483 -4553 4533 -6006 6712 -6210 -6006 7005 4422 14261 -366 5482 -10004 4942 -716 2806 334 1108 -89 301 6256 -1189 4612 -1249 2971 3524 -1211 1685 -3253 1616 -1555 1128 2722 744 1736 1032 4543 -279 2680 2008 2843 1131 -1260 734 390 535 -1807 2947 -1075 1729 -1558 -1396 -1290 -2675 -1976 -410 -280 -1441 622 -386 1368 889 725 300 594 906 428 290 -95 162 -901 -1171 -256 293 359 -1143 -692 -1279 -443 220 387 -135 -119 114 -247 659 -86 981 701 489 132 -67 58 -395 418 378 -188 134 783 26 -173 -74 -520 80 -35 250 -178 81 -159 -415 81 105 99 900000 164 900000 -1894 2166 -1536 96 900000 -1479 -241 -1599 -270 -1067 -43 -431 -977 -662 177 -188 -1822 435 -1355 19 -530 604 276 -644 -479 -592 16 -177 188 -309 324 -337 -331 377 289 1023 -35 562 -1278 576 -91 349 43 145 -12 43 892 -199 807 -253 622 777 -292 407 -825 387 -384 282 730 226 570 354 1491 -95 910 752 1185 521 -619 353 180 230 -730 1075 -412 706 -753 -769 -795 -1811 -1415 -308 -222 -1212 528 -329 1116 690 534 214 434 719 383 292 -107 193 -1079 -1339 -270 293 363 -1233 -785 -1533 -559 298 567 -212 -194 184 -389 986 -126 1433 1063 778 216 -111 94 -626 641 562 -272 191 1148 42 -300 -137 -1014 162 -73 555 -412 192 -382 -996 190 237 216 SS 20250320T125823.7Z 9210.540553 258 1 14.28 2 77.35 94.26 59.00 220.11 0.00 1 0.00 1 0 17 7.427e-02 4.787e-03 4.272e-02 1.856e-03 5.038415e-01 1.018081e-03 5.286633e-03 -6.000000e+00 4.541584e-02 227.66 -2.00 3.11 -2.00 319.81 0.00e+00 1.739386e-03 3.299653e-04 9.492677e-04 -6.000000e+00 2.056231e-03 291.39 -2.00 20.00 -2.00 319.05 0.00e+00 4.441 0.000 302.00 328.00 3 1.6791e+00 2.9642e-03 4.8736e-02 -6.0000e+00 1.1237e-01 -3.3018e-03 3.6047e-03 2.3832e-02 -6.0000e+00 1.2092e-01 6.5829e-04 2.9744e-03 1.2164e-02 -6.0000e+00 7.2450e-02 -8.7561e-03 1.5447e-03 3.8296e-03 -6.0000e+00 3.1387e-02 7.8818e-04 2.8545e-05 5.7994e-05 5.0193e-05 -6.0000e+00 2.2941e-03 -4.9372e-02 2.3480e-05 12 1 1 12 9 1 41.91 19.88 0.16 -0.04937 -0.04916 83 353 1 5 0 169.850 26.11 20.00 19.88 27.63 37.9 985.18 -28684 -32850 -19268 -8560 -30504 -21350 -15458 -15423 -33492 -29157 -22102 -15435 -6443 -9230 -8084 -3934 -5328 -5054 -3681 -3194 -2961 950 -5865 -2735 -3015 -2723 -1410 -2821 -8121 -3425 -3112 1361 2509 -1421 -2283 -2319 -2186 -2816 50 -401 -1894 -997 -599 -934 258 -756 219 554 212 690 219 587 2 1234 607 605 -396 -190 -349 930 1532 1892 2232 1364 922 412 -255 767 1615 1185 1201 383 809 334 -391 -246 -727 -974 -1226 -693 -862 -1805 -1893 -1271 -1154 -490 168 129 422 513 483 565 138 363 284 622 410 134 122 -377 -827 -656 62 -197 -669 -793 -681 -482 385 503 285 105 37 30 78 417 770 320 306 -56 -150 -28 128 30 -31 56 342 541 161 -146 -477 -253 -273 92 -164 -64 267 70 15 -200 40 -65 -326 -449 -244 -96 -402 -253 -186 -211 -617 -557 -418 -305 -140 -255 -269 -146 -206 -213 -164 -150 -143 45 -311 -152 -181 -172 -89 -177 -533 -225 -230 111 228 -142 -228 -234 -242 -372 8 -74 -365 -205 -129 -207 57 -173 50 129 51 175 61 179 1 438 229 237 -149 -71 -140 368 626 780 1019 683 480 211 -128 390 889 688 763 256 537 213 -232 -142 -395 -531 -730 -440 -630 -1402 -1603 -1143 -1107 -468 168 133 431 505 475 518 122 324 277 644 456 167 162 -504 -1046 -762 72 -231 -791 -997 -904 -644 553 749 457 174 61 48 116 628 1157 478 483 -93 -250 -46 202 46 -48 83 492 802 248 -249 -836 -465 -501 178 -323 -132 565 150 32 -418 83 -129 SS 20250320T130409.3Z 9210.544552 261 1 59.96 2 75.99 94.74 59.87 221.15 0.00 1 0.00 1 0 17 5.022e-02 4.598e-03 2.048e-02 1.014e-03 4.643939e-01 5.535496e-04 4.874056e-03 -6.000000e+00 3.068878e-02 227.66 -2.00 3.11 -2.00 319.73 0.00e+00 1.664349e-03 1.721306e-04 4.640539e-04 -6.000000e+00 1.390247e-03 291.39 -2.00 20.00 -2.00 318.94 0.00e+00 4.038 0.000 302.00 328.00 3 2.1587e+00 1.6069e-03 4.4409e-02 -6.0000e+00 7.5932e-02 -8.9138e-03 1.9354e-03 2.1747e-02 -6.0000e+00 8.1723e-02 1.1183e-02 1.5482e-03 1.0985e-02 -6.0000e+00 4.8966e-02 -1.3712e-02 8.0687e-04 3.5405e-03 -6.0000e+00 2.1200e-02 7.3823e-04 -6.1095e-04 3.2215e-05 4.3281e-05 -6.0000e+00 1.5517e-03 -4.8604e-02 -1.2636e-04 11 1 0 11 8 0 99.37 19.88 0.19 -0.04860 -0.05320 303 303 1 5 0 197.840 26.11 19.99 19.88 28.03 38.0 985.27 -9860 -21719 -2479 -16843 -11520 -24580 -18157 -14660 -22370 -6643 -18189 -8212 -12203 2517 -4359 -1022 -2339 -3251 -1797 -1752 2242 -2341 741 -2615 -2989 -735 -3929 -1175 -3686 -957 -404 2299 -589 -530 -1744 -2563 -1113 -957 506 -1520 -1032 -918 -1455 -799 -597 184 -695 22 -312 180 440 1214 755 570 771 68 156 -386 -176 725 1323 1698 1856 1321 609 366 147 897 1176 1178 596 418 421 -323 69 -272 -701 -337 -270 -542 -1113 -1494 -1906 -1507 -1052 -433 -264 194 193 620 672 690 833 610 743 464 583 323 -6 -348 -689 -687 -100 183 -802 -802 -791 -320 169 332 167 -16 -39 -144 248 565 613 629 162 -82 -268 -124 -101 229 -3 118 458 481 272 -134 -394 -356 -92 112 -137 4 105 -52 -22 -31 9 -42 -117 -332 -33 -253 -154 -369 -274 -242 -448 -122 -397 -179 -330 72 -161 -42 -108 -165 -96 -98 125 -139 44 -174 -215 -54 -302 -86 -272 -72 -34 213 -63 -59 -194 -290 -136 -127 80 -287 -217 -207 -344 -192 -146 45 -174 5 -81 49 128 385 261 211 300 28 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