File name: Pandora141s1_Calakmul_20250307_L2Fit_fout2c3d20231011p1-8.txt File generation date: 20250308T061634.3Z 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_20250307_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: 20250307 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 20250307T141551.5Z 9197.594346 142 1 5.34 2 61.98 106.49 129.08 24.22 0.00 1 0.00 1 0 17 1.111e-02 6.444e-03 8.730e-03 3.710e-03 2.414174e-01 1.992680e-03 2.630698e-03 -6.000000e+00 6.766804e-03 226.68 -2.00 3.11 -2.00 316.55 0.00e+00 2.268342e-04 2.463471e-04 1.417660e-04 -6.000000e+00 3.070979e-04 291.08 -2.00 20.00 -2.00 315.74 0.00e+00 2.118 0.000 302.00 328.00 3 4.5757e+00 5.1672e-03 2.3175e-02 -6.0000e+00 1.6706e-02 1.5757e-02 5.7562e-03 1.1098e-02 -6.0000e+00 1.7990e-02 5.6705e-03 3.3649e-03 5.4274e-03 -6.0000e+00 1.0786e-02 -6.4968e-03 1.6112e-03 1.5308e-03 -6.0000e+00 4.6807e-03 5.3242e-04 -3.2891e-04 1.1832e-04 2.1186e-05 -6.0000e+00 3.4301e-04 -5.1246e-02 -5.4432e-05 12 9 1 12 9 1 99.95 19.87 0.12 -0.05125 -0.05372 6 79 1 5 0 762.340 26.00 19.99 19.87 32.08 38.7 986.14 -1863 429 -3379 346 -4501 -3103 829 -665 -921 -2569 -3108 -1748 -714 -2652 121 960 833 2208 309 450 -1169 616 1169 476 1231 1105 1191 -312 1998 -424 2137 2107 1251 -651 -2701 -1660 -2370 -321 -957 -599 -354 -682 174 -360 -548 -627 -657 -1040 240 132 211 48 1272 389 1043 896 -294 783 -543 844 1441 1505 1662 235 1181 -340 171 -13 428 624 823 720 96 565 -567 -13 -137 -999 -1456 -1171 -814 -1570 -881 -2084 -1155 -1058 -416 253 -87 142 390 953 -1162 417 -4 510 758 739 -293 -104 -206 -784 212 -416 -365 -895 -744 97 677 737 498 445 -83 240 -232 186 75 646 467 -5 -238 92 -23 130 337 -219 539 518 371 96 -234 -492 -491 422 355 -345 273 -234 99 -143 -259 -401 -289 70 -585 55 -696 -456 123 -110 -166 -491 -603 -345 -152 -642 32 269 244 662 97 145 -389 203 389 166 446 411 440 -112 678 -144 737 772 487 -261 -1074 -651 -992 -149 -506 -350 -220 -442 114 -240 -366 -417 -433 -676 153 85 139 33 911 290 790 691 -231 610 -424 653 1136 1239 1437 212 1055 -295 142 -11 363 566 786 708 95 545 -528 -11 -113 -806 -1208 -1038 -772 -1590 -927 -2290 -1314 -1252 -507 313 -108 172 453 1047 -1231 431 -4 573 904 930 -383 -135 -259 -948 250 -501 -456 -1163 -995 133 951 1072 743 667 -123 340 -316 245 99 867 651 -7 -349 135 -33 183 462 -293 702 677 501 135 -338 -725 -735 643 557 -560 449 -391 165 -237 -421 -642 SS 20250307T142511.1Z 9197.600823 148 1 0.75 2 59.87 107.59 128.18 26.42 0.00 1 0.00 1 0 17 1.099e-02 7.035e-03 7.246e-03 3.930e-03 2.278502e-01 2.121721e-03 2.513411e-03 -6.000000e+00 6.691561e-03 226.68 -2.00 3.11 -2.00 315.87 0.00e+00 3.513336e-04 2.236242e-04 8.141781e-05 -6.000000e+00 3.038680e-04 291.08 -2.00 20.00 -2.00 315.10 0.00e+00 1.983 0.000 302.00 328.00 3 2.8753e+00 5.4501e-03 2.1755e-02 -6.0000e+00 1.6521e-02 1.4770e-02 6.0431e-03 1.0493e-02 -6.0000e+00 1.7794e-02 -1.1987e-03 3.4895e-03 5.1432e-03 -6.0000e+00 1.0668e-02 -2.5036e-03 1.6182e-03 1.4530e-03 -6.0000e+00 4.6261e-03 3.3935e-03 -1.3097e-03 1.2437e-04 2.1309e-05 -6.0000e+00 3.3958e-04 -4.8048e-02 -1.4737e-04 12 9 1 12 9 1 -1015.81 19.88 0.15 -0.04805 -0.05789 3 321 1 5 0 187.110 26.00 19.96 19.88 32.38 38.7 986.19 511 -2087 -72 -3049 -4555 446 -2185 1313 -1167 -2648 -3160 -674 431 1109 918 -993 604 -1045 2013 -729 523 1268 1223 2610 1319 1613 -1780 356 625 1244 1174 854 2024 -1124 -2450 -1597 -1948 71 677 -442 -1489 -27 -1440 -569 -1216 -314 -1455 -329 -261 67 889 561 1401 303 1388 89 543 515 1078 1585 752 1028 989 1255 1171 165 -358 -507 469 1137 803 -419 1028 -424 277 -1090 -565 -435 -501 -366 -1586 -1484 -1832 -1351 -1423 -425 -293 -136 -104 172 561 40 -207 260 205 486 1127 -68 182 -422 -436 -668 162 11 -1223 -972 -657 -595 331 539 47 459 400 71 276 491 -105 358 286 88 -52 306 273 583 102 503 497 741 1080 513 -122 -422 -245 487 -197 -171 -305 59 -241 -456 -533 -260 111 -493 -17 -706 -995 90 -467 297 -291 -690 -834 -179 122 342 310 -362 225 -404 782 -295 213 516 504 1100 581 724 -813 155 262 511 495 379 932 -535 -1151 -742 -954 38 401 -288 -1033 -19 -1049 -416 -892 -228 -1054 -233 -183 47 638 418 1077 241 1116 73 449 425 882 1295 629 892 897 1167 1087 149 -311 -435 414 1060 787 -424 1034 -422 265 -994 -487 -365 -429 -332 -1544 -1523 -1958 -1485 -1624 -500 -355 -168 -128 207 651 44 -220 271 219 545 1331 -85 233 -541 -542 -800 189 14 -1518 -1245 -862 -802 456 765 68 668 573 98 366 632 -135 470 389 123 -74 435 383 800 137 656 636 948 1417 698 -171 -600 -354 715 -298 -266 -483 93 -386 -725 -835 -400 SS 20250307T143026.6Z 9197.604475 151 1 59.89 2 58.68 108.24 127.64 27.63 0.00 1 0.00 1 0 17 1.403e-02 7.239e-03 1.045e-02 3.669e-03 2.211011e-01 1.958999e-03 2.406110e-03 -6.000000e+00 8.551405e-03 226.68 -2.00 3.11 -2.00 317.14 0.00e+00 5.487018e-04 2.774509e-04 2.224286e-04 -6.000000e+00 3.880175e-04 291.08 -2.00 20.00 -2.00 316.29 0.00e+00 1.916 0.000 302.00 328.00 3 6.4852e+00 5.1278e-03 2.1032e-02 -6.0000e+00 2.1113e-02 6.2912e-02 5.7421e-03 1.0168e-02 -6.0000e+00 2.2733e-02 1.1820e-02 3.4049e-03 4.9767e-03 -6.0000e+00 1.3629e-02 -9.9502e-03 1.6670e-03 1.4106e-03 -6.0000e+00 5.9160e-03 9.6415e-05 -2.5586e-04 1.1890e-04 1.8714e-05 -6.0000e+00 4.3334e-04 -5.1511e-02 -1.1686e-05 11 9 0 11 8 0 99.98 19.88 0.21 -0.05151 -0.05343 45 45 1 5 0 1330.700 26.00 20.02 19.88 32.60 38.7 986.21 -409 -12 -1260 -1313 -1165 -1683 6320 -463 3162 10 2480 -4411 -4073 502 75 1573 -2280 3068 -621 447 56 2556 214 -609 1902 -180 2528 -2850 2543 -1293 781 887 2010 -87 -4552 27 -3684 -1425 59 -995 -1123 -1322 -921 -1558 528 -984 -559 -1807 -820 -366 -93 387 1337 1301 970 1806 495 674 1186 948 636 662 3267 642 674 -9 -519 -733 628 1107 753 1249 484 366 -307 692 -1688 -1298 -1172 -1541 -1370 -1505 -1205 -1987 -395 -442 -238 768 113 551 255 279 -1247 -445 -653 206 669 485 606 -277 -273 -1382 -33 -394 -686 -459 -914 -140 217 857 678 859 402 139 -290 -424 -275 -117 207 73 166 479 461 84 52 -399 1 579 199 365 -749 -213 98 6 -85 1 438 -83 82 138 -401 -488 -52 -2 -177 -176 -143 -198 717 -62 447 2 371 -723 -726 97 16 362 -571 755 -163 120 16 689 60 -179 572 -57 770 -872 704 -363 222 269 640 -29 -1514 8 -1289 -562 27 -516 -633 -782 -556 -957 318 -598 -333 -1062 -470 -210 -55 241 868 879 675 1272 357 484 840 673 466 513 2639 552 576 -7 -398 -553 491 942 689 1183 462 340 -271 558 -1281 -943 -876 -1260 -1226 -1459 -1234 -2144 -444 -525 -295 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