File name: Pandora141s1_Calakmul_20250106_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20250107T061223.2Z 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 v1.8.60 Instrument operation file used: Pandora141_OF_v2d20230802.txt Instrument calibration file used: Pandora141s1_CF_v3d20231011.txt Level 1 file used: Pandora141s1_Calakmul_20250106_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: 20250106 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 20250106T142634.8Z 9137.601792 98 1 1.63 2 67.05 125.41 131.56 65.07 0.00 1 0.00 1 0 25 9.966e-03 5.772e-03 4.009e-03 1.468e-03 2.842909e-01 7.843959e-04 3.099743e-03 -6.000000e+00 6.025226e-03 224.63 -2.00 3.11 -2.00 316.89 0.00e+00 3.800362e-04 1.056915e-04 1.468890e-04 -6.000000e+00 2.750472e-04 290.65 -2.00 20.00 -2.00 316.07 0.00e+00 2.544 0.000 302.00 328.00 3 1.3373e+00 2.0344e-03 2.7621e-02 -6.0000e+00 1.4807e-02 -1.6624e-03 2.2748e-03 1.2976e-02 -6.0000e+00 1.5968e-02 8.0675e-03 1.3482e-03 6.3864e-03 -6.0000e+00 9.5866e-03 -6.9844e-03 6.6039e-04 1.8226e-03 -6.0000e+00 4.1768e-03 8.5794e-03 -2.8001e-04 4.6654e-05 2.5097e-05 -6.0000e+00 3.0758e-04 -5.0769e-02 -1.9265e-05 12 1 1 12 1 1 68.66 19.92 0.14 -0.05077 -0.05287 30 1143 1 5 0 52.430 26.11 20.02 19.92 31.49 35.4 984.98 394 -1956 -1422 -3204 -2038 -3862 500 -1554 -171 -1892 -3916 -1871 -2312 1418 -579 -319 -357 820 340 -209 1179 -300 1166 739 1300 906 3 200 -782 620 820 2382 660 -211 -1528 -1778 -1877 -584 -106 -1166 -408 -477 -259 -732 -141 -115 -684 -655 -707 504 554 617 1051 644 404 849 593 -23 160 347 1253 1342 2018 1151 187 -117 -491 223 803 1213 338 503 504 -78 -79 -376 -578 -538 -339 -604 -1029 -1777 -1916 -1640 -1242 -556 -226 -82 212 330 343 321 244 360 809 359 463 257 -145 -393 -643 -695 -222 30 -860 -841 -758 -240 102 675 434 256 316 29 253 555 594 431 199 -131 -107 -138 -94 220 306 268 539 854 213 321 -61 -376 -145 83 40 -156 73 42 -270 -232 -221 -337 48 -268 -199 -435 -251 -465 61 -215 -26 -306 -657 -322 -411 280 -134 -81 -96 213 93 -59 336 -87 343 230 426 308 1 65 -245 190 265 824 250 -77 -549 -682 -728 -261 -53 -634 -243 -283 -158 -456 -87 -71 -420 -396 -423 303 350 417 713 462 300 614 437 -17 117 265 933 1069 1644 999 164 -97 -406 181 656 1097 320 475 476 -75 -70 -321 -475 -427 -281 -532 -974 -1786 -1983 -1795 -1386 -658 -271 -101 259 389 393 352 259 376 848 400 549 322 -193 -519 -805 -838 -266 37 -1090 -1089 -993 -328 143 995 650 388 466 42 349 750 799 583 286 -193 -161 -206 -136 317 421 365 705 1124 299 464 -91 -575 -221 131 65 -256 124 72 -467 -393 -362 -550 SS 20250106T143245.4Z 9137.606081 102 1 37.87 2 65.86 126.27 130.27 66.01 0.00 1 0.00 1 0 25 1.222e-02 5.743e-03 9.364e-03 2.326e-03 2.725299e-01 1.233134e-03 2.970396e-03 -6.000000e+00 7.386416e-03 224.63 -2.00 3.11 -2.00 317.79 0.00e+00 2.876332e-04 2.095461e-04 2.427917e-04 -6.000000e+00 3.371510e-04 290.65 -2.00 20.00 -2.00 316.94 0.00e+00 2.428 0.000 302.00 328.00 3 4.9399e+00 3.2589e-03 2.6424e-02 -6.0000e+00 1.8153e-02 2.9667e-02 3.6818e-03 1.2542e-02 -6.0000e+00 1.9575e-02 1.5674e-02 2.2807e-03 6.1689e-03 -6.0000e+00 1.1752e-02 -1.1155e-02 1.1618e-03 1.7585e-03 -6.0000e+00 5.1207e-03 2.6060e-04 -2.0400e-04 7.5401e-05 2.3068e-05 -6.0000e+00 3.7701e-04 -5.0700e-02 9.5577e-06 12 1 1 12 1 1 100.00 19.91 0.21 -0.05070 -0.05223 79 127 1 5 0 473.280 26.11 20.00 19.91 31.95 35.7 985.16 -1500 2301 -5027 1704 -1275 -2237 965 2994 3259 -1622 -944 -5360 2106 -843 -518 -290 -1381 1284 -383 -563 650 1032 -7 2541 -335 -2005 1073 -360 182 -486 2430 1831 333 -1270 -3304 -1965 -2229 -1012 -1243 -1090 -1061 -947 -432 -336 271 -1273 -813 -1017 409 -504 1291 377 1159 980 585 1207 365 185 88 927 796 1744 1928 1464 591 -525 -509 269 875 1318 283 571 810 397 -224 153 -556 -880 -769 -855 -1319 -1536 -1564 -1509 -1085 -623 -188 47 151 259 117 341 237 662 138 659 353 233 93 -471 -392 -1097 -86 -286 -800 -939 -688 -63 460 757 593 412 82 225 120 268 198 140 -54 -42 -145 -250 100 150 144 -67 637 634 347 151 -186 -430 -87 189 -161 29 314 74 230 -269 -205 -576 -121 196 -470 143 -102 -174 76 258 309 -169 -100 -612 248 -117 -81 -49 -252 238 -75 -114 133 213 -2 554 -79 -497 257 -84 41 -108 549 450 89 -351 -907 -531 -647 -335 -480 -478 -506 -474 -222 -174 140 -666 -419 -517 204 -256 674 211 679 600 371 777 240 122 57 601 532 1222 1442 1148 467 -401 -369 191 653 1068 248 516 732 350 -188 119 -403 -620 -561 -682 -1159 -1460 -1571 -1587 -1195 -719 -225 57 184 308 132 362 237 650 142 724 421 298 124 -627 -501 -1333 -101 -341 -1007 -1238 -939 -88 672 1154 936 657 129 335 171 366 270 196 -79 -63 -225 -386 151 221 206 -92 851 854 487 223 -287 -677 -140 311 -277 51 568 136 422 -490 -366 -1005 SS 20250106T144441.0Z 9137.614363 111 1 6.52 2 63.61 128.03 127.75 67.72 0.00 1 0.00 1 0 17 8.196e-03 5.723e-03 1.534e-03 6.907e-04 2.512387e-01 3.688070e-04 2.752802e-03 -6.000000e+00 4.955170e-03 224.63 -2.00 3.11 -2.00 316.40 0.00e+00 2.791382e-04 4.401159e-05 1.109403e-04 -6.000000e+00 2.262120e-04 290.65 -2.00 20.00 -2.00 315.60 0.00e+00 2.236 0.000 302.00 328.00 3 1.5723e+00 9.5022e-04 2.4311e-02 -6.0000e+00 1.2178e-02 1.8167e-03 1.0587e-03 1.1451e-02 -6.0000e+00 1.3132e-02 7.9246e-03 6.1795e-04 5.6384e-03 -6.0000e+00 7.8842e-03 -5.8735e-03 2.9534e-04 1.6072e-03 -6.0000e+00 3.4348e-03 9.5179e-03 -3.0827e-04 2.1894e-05 2.2489e-05 -6.0000e+00 2.5298e-04 -5.0625e-02 -3.0331e-05 12 1 1 12 1 1 99.49 19.92 0.15 -0.05062 -0.05294 127 1178 1 5 0 50.900 26.11 20.01 19.92 32.49 36.0 985.25 -208 -1117 -1074 -2504 -2062 -1582 99 164 -159 -1277 -2560 -945 -750 7 -145 -120 -219 163 798 587 860 487 1213 1000 1567 723 -164 -185 165 823 1077 1787 807 -982 -2100 -2068 -1571 -455 -182 -899 -997 -860 -670 -567 -397 -350 -484 -715 -343 352 389 621 860 582 723 635 764 105 376 630 1085 1502 1792 993 167 -43 -228 264 1071 1018 266 340 294 63 81 -304 -423 -370 -633 -817 -1213 -1781 -1937 -1554 -1036 -608 -338 55 -34 230 209 170 304 519 567 589 560 191 -45 -472 -607 -635 31 -42 -673 -761 -706 -226 251 657 515 177 165 110 289 473 586 530 289 -203 -240 -111 -68 122 174 228 541 703 413 171 -146 -312 -123 114 -60 -87 58 -52 -99 -258 -195 -343 -34 -203 -199 -446 -335 -244 16 29 -31 -265 -544 -205 -165 2 -41 -37 -66 51 259 197 294 168 422 366 602 290 -66 -71 60 290 395 701 342 -403 -904 -882 -672 -224 -99 -535 -652 -559 -447 -382 -267 -234 -319 -462 -230 237 258 439 644 434 556 500 609 84 296 496 878 1228 1573 880 149 -38 -189 213 912 915 250 334 288 59 75 -271 -362 -303 -542 -737 -1170 -1812 -2022 -1711 -1159 -723 -407 67 -41 272 241 188 324 538 616 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