File name: Pandora141s1_Calakmul_20250223_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20250224T063648.0Z 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_20250223_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: 20250223 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 20250223T150134.7Z 9185.626096 247 1 17.36 2 54.54 117.09 48.62 192.01 0.00 1 0.00 1 0 17 1.009e-02 6.597e-03 6.382e-03 3.253e-03 2.002675e-01 1.745526e-03 2.180771e-03 -6.000000e+00 6.126653e-03 225.78 -2.00 3.11 -2.00 316.02 0.00e+00 6.542395e-04 1.918623e-04 1.043200e-04 -6.000000e+00 2.786403e-04 290.80 -2.00 20.00 -2.00 315.25 0.00e+00 1.719 0.000 302.00 328.00 3 5.8316e+00 4.4877e-03 1.8860e-02 -6.0000e+00 1.5096e-02 4.7956e-02 4.9871e-03 9.1203e-03 -6.0000e+00 1.6266e-02 4.9068e-03 2.8860e-03 4.4716e-03 -6.0000e+00 9.7573e-03 -5.5904e-03 1.3502e-03 1.2952e-03 -6.0000e+00 4.2417e-03 2.3435e-04 -1.6864e-04 1.0370e-04 1.7837e-05 -6.0000e+00 3.1148e-04 -5.1232e-02 -2.3592e-05 12 9 1 12 9 1 99.99 19.90 0.24 -0.05123 -0.05250 9 35 1 5 0 1735.400 26.11 20.00 19.90 32.61 39.2 988.48 1887 73 -3313 2831 -1890 531 49 1680 1002 -894 -622 -2964 -33 -1825 47 -1809 -529 -442 1238 1679 722 925 -822 1808 162 1875 -694 134 -1016 1764 1539 2296 393 -1933 -2066 -1742 -790 -908 -1539 -353 -1380 -826 -733 142 -676 397 -1328 90 -240 -719 581 -351 393 425 1298 1386 476 403 619 984 984 1175 2063 1636 62 155 -545 -391 960 841 679 480 720 -55 108 -256 -773 -843 -1299 -1138 -1505 -1965 -1858 -1132 -716 -433 225 -54 89 263 212 -287 53 -194 -318 785 508 548 200 -156 -1024 -707 215 254 -661 -733 -251 -800 659 403 464 677 112 -36 289 -38 23 548 21 96 108 -11 249 320 499 -284 398 103 130 116 -504 -208 170 -54 -111 224 469 251 -42 -446 -225 -650 379 16 -757 582 -373 98 9 348 227 -213 -148 -736 -9 -537 15 -627 -189 -162 458 634 279 358 -326 727 69 800 -300 55 -403 668 598 937 171 -865 -898 -749 -357 -464 -898 -226 -952 -589 -533 103 -495 287 -956 63 -165 -497 408 -259 300 335 1036 1123 392 331 504 800 819 1021 1873 1535 58 140 -466 -329 831 781 668 487 731 -55 103 -229 -649 -684 -1081 -1013 -1445 -2013 -1989 -1250 -823 -519 277 -68 112 324 250 -320 56 -200 -336 873 604 687 259 -202 -1284 -846 250 302 -823 -949 -334 -1098 924 585 688 1005 162 -50 383 -48 29 714 28 136 155 -16 351 441 667 -370 502 131 169 158 -704 -294 244 -79 -168 349 744 404 -68 -714 -355 -1006 SS 20250223T150620.2Z 9185.629401 250 1 0.61 2 53.54 117.84 48.85 193.33 0.00 1 0.00 1 0 17 8.563e-03 7.150e-03 5.408e-03 3.501e-03 1.927934e-01 1.895620e-03 2.150614e-03 -6.000000e+00 5.195251e-03 225.78 -2.00 3.11 -2.00 315.18 0.00e+00 2.034490e-04 1.741019e-04 9.986741e-05 -6.000000e+00 2.364093e-04 290.80 -2.00 20.00 -2.00 314.48 0.00e+00 1.678 0.000 302.00 328.00 3 2.8074e+00 4.8264e-03 1.8380e-02 -6.0000e+00 1.2801e-02 1.0911e-02 5.3354e-03 8.8337e-03 -6.0000e+00 1.3796e-02 5.7097e-03 3.0734e-03 4.3474e-03 -6.0000e+00 8.2755e-03 -4.7362e-03 1.3922e-03 1.2379e-03 -6.0000e+00 3.5959e-03 5.1713e-03 -1.1862e-03 1.1060e-04 1.9423e-05 -6.0000e+00 2.6445e-04 -5.5075e-02 -3.5925e-04 12 9 1 12 9 1 74.15 19.90 0.15 -0.05507 -0.06399 3 397 1 5 0 151.080 26.11 20.02 19.90 33.26 39.1 988.50 -895 190 -564 -1157 -1401 -1356 -154 531 536 -1151 -294 -146 127 343 655 338 -93 505 97 839 1521 308 571 838 1094 448 133 -765 838 2109 331 1113 711 -797 -1450 -2810 -2111 -643 103 -596 -1401 -1089 -511 -735 -1015 -840 -963 -974 -1638 -206 250 1608 852 1292 459 280 631 417 599 79 1326 2132 1525 1175 716 -345 -486 563 1946 707 516 821 534 268 411 -420 -1062 -581 -510 -690 -1685 -1755 -2025 -1209 -1160 -927 -267 -71 198 187 330 -531 289 21 567 492 437 853 247 -606 -148 -860 -33 -467 -588 -699 -514 -220 288 539 534 358 -254 305 184 445 667 835 370 -23 -394 -435 43 257 28 1058 500 863 -28 45 -454 -309 -562 531 -413 -351 -29 -258 191 11 120 -407 -265 59 -178 -350 -397 -370 -43 159 172 -385 -98 -49 46 133 273 148 -42 232 46 400 732 150 280 421 566 237 70 -391 409 1001 162 564 375 -427 -762 -1480 -1160 -385 68 -427 -1062 -848 -402 -583 -806 -663 -751 -747 -1244 -155 192 1267 695 1078 391 241 548 362 517 69 1161 1925 1438 1137 690 -323 -436 494 1749 677 517 842 550 272 402 -392 -942 -499 -446 -638 -1659 -1817 -2178 -1334 -1325 -1097 -324 -88 244 226 384 -593 306 22 602 547 512 1045 312 -764 -181 -1017 -39 -550 -718 -883 -666 -291 390 750 756 509 -356 410 237 556 831 1061 488 -32 -547 -604 58 344 37 1339 621 1070 -36 59 -613 -423 -779 747 -599 -523 -44 -395 293 17 180 -603 SS 20250223T151107.5Z 9185.632726 253 1 17.67 2 52.54 118.63 49.12 194.64 0.00 1 0.00 1 0 17 7.945e-03 5.999e-03 2.491e-03 1.501e-03 1.903507e-01 8.102134e-04 2.091470e-03 -6.000000e+00 4.825248e-03 225.78 -2.00 3.11 -2.00 315.44 0.00e+00 2.926623e-04 7.855387e-05 6.140360e-05 -6.000000e+00 2.194332e-04 290.80 -2.00 20.00 -2.00 314.71 0.00e+00 1.640 0.000 302.00 328.00 3 4.6529e+00 2.0696e-03 1.7992e-02 -6.0000e+00 1.1889e-02 3.1461e-02 2.2918e-03 8.6909e-03 -6.0000e+00 1.2810e-02 5.3938e-03 1.3203e-03 4.2688e-03 -6.0000e+00 7.6845e-03 -5.7689e-03 6.0346e-04 1.2130e-03 -6.0000e+00 3.3410e-03 8.4356e-04 -2.0229e-04 4.7586e-05 1.8026e-05 -6.0000e+00 2.4529e-04 -5.1659e-02 -1.4776e-05 12 1 1 12 1 1 99.96 19.90 0.14 -0.05166 -0.05318 22 78 1 5 0 768.040 26.00 19.98 19.90 34.16 39.1 988.51 -387 -547 -1414 -789 -2301 -1200 113 1029 -218 -1037 -748 -613 -631 632 375 -107 0 479 110 777 1017 886 716 1922 1038 214 179 -612 783 1493 858 2230 660 -691 -2052 -2213 -2034 -442 -262 -869 -1003 -884 -680 -694 -445 -1036 -841 -832 -46 28 -201 913 1017 509 587 814 645 209 589 334 1294 1327 1611 826 336 -123 -340 277 869 901 622 487 97 275 -27 -194 -558 -692 -655 -997 -1053 -1614 -1798 -1592 -961 -706 -233 120 3 426 202 239 -27 666 319 549 663 476 103 -368 -677 -452 -18 73 -532 -805 -744 -452 373 638 404 264 -119 161 142 522 387 364 489 68 -213 -161 -80 241 284 206 411 457 409 192 -252 -359 -200 66 -82 -3 87 -105 -119 -147 -172 -264 -101 -152 -401 -213 -581 -288 28 272 -63 -311 -224 -186 -205 222 144 -44 0 205 48 346 459 401 328 900 506 107 89 -294 357 662 390 1048 327 -348 -1018 -1090 -1054 -251 -166 -608 -743 -676 -528 -543 -347 -806 -644 -625 -34 21 -152 708 818 422 494 693 554 180 502 286 1123 1196 1514 800 324 -115 -301 240 777 857 623 502 101 279 -26 -179 -487 -585 -563 -912 -1027 -1666 -1935 -1768 -1103 -842 -286 150 4 520 237 266 -28 690 339 611 780 589 132 -468 -835 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