File name: Pandora83s1_BondvilleIL_20250915_L2Fit_fout2c8d20241002p1-8.txt File generation date: 20250916T123231.3Z Data description: Level 2 spectral fitting results file Data file version: fout2c8p1-8 Local principal investigator: Kevin Mishoe Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 83 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora83_OF_v4d20231115.txt Instrument calibration file used: Pandora83s1_CF_v8d20241002.txt Level 1 file used: Pandora83s1_BondvilleIL_20250915_L1_smca1c8d20241002p1-8.txt Full location name: Bondville, Illinois EPA Castnet Site Short location name: BondvilleIL Country of location: United States Location latitude [deg]: 40.0520 Location longitude [deg]: -88.3725 Location altitude [m]: 213 Local noon date: 20250915 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are latency correction, matrix method stray light correction (replaced by simple method) Data caveats: None First and last pixel inside fitting window: 199 341 Nominal wavelengths inside fitting window [nm]: 305.0376 305.1782 305.3189 305.4595 305.6001 305.7407 305.8813 306.0219 306.1625 306.3031 306.4436 306.5841 306.7247 306.8652 307.0057 307.1462 307.2867 307.4271 307.5676 307.7081 307.8485 307.9889 308.1293 308.2697 308.4101 308.5505 308.6909 308.8312 308.9716 309.1119 309.2522 309.3925 309.5328 309.6731 309.8134 309.9537 310.0939 310.2342 310.3744 310.5146 310.6548 310.7950 310.9352 311.0754 311.2155 311.3557 311.4958 311.6359 311.7761 311.9162 312.0563 312.1963 312.3364 312.4765 312.6165 312.7565 312.8966 313.0366 313.1766 313.3166 313.4565 313.5965 313.7365 313.8764 314.0163 314.1563 314.2962 314.4361 314.5760 314.7158 314.8557 314.9955 315.1354 315.2752 315.4150 315.5548 315.6946 315.8344 315.9742 316.1139 316.2537 316.3934 316.5331 316.6728 316.8125 316.9522 317.0919 317.2316 317.3712 317.5109 317.6505 317.7901 317.9297 318.0693 318.2089 318.3485 318.4880 318.6276 318.7671 318.9066 319.0462 319.1857 319.3251 319.4646 319.6041 319.7435 319.8830 320.0224 320.1618 320.3013 320.4407 320.5800 320.7194 320.8588 320.9981 321.1375 321.2768 321.4161 321.5554 321.6947 321.8340 321.9733 322.1125 322.2518 322.3910 322.5302 322.6694 322.8086 322.9478 323.0870 323.2262 323.3653 323.5045 323.6436 323.7827 323.9218 324.0609 324.2000 324.3391 324.4781 324.6172 324.7562 324.8952 --------------------------------------------------------------------------------------- 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 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: 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 20250915T122043.4Z 9389.514392 241 1 54.68 2 82.06 93.02 13.07 154.66 0.00 1 0.00 1 0 25 6.340e-01 3.174e-02 2.228e-01 6.896e-03 7.692930e-01 4.146175e-03 8.629164e-03 -6.000000e+00 3.833667e-01 229.16 -2.00 3.49 -2.00 321.77 0.00e+00 2.368810e-03 2.412610e-03 7.447962e-04 -6.000000e+00 2.547925e-02 287.46 -2.00 20.00 -2.00 321.24 0.00e+00 6.753 0.005 302.00 328.00 3 1.8505e+00 1.6356e-02 7.7870e-02 -6.0000e+00 9.5635e-01 4.7944e-01 2.3135e-02 4.2887e-02 -6.0000e+00 1.0415e+00 -7.2770e-01 2.1377e-02 2.2262e-02 -6.0000e+00 6.1366e-01 3.0214e-01 9.6579e-03 7.4985e-03 -6.0000e+00 2.6468e-01 5.4705e-05 -9.1870e-04 2.0543e-04 9.8120e-05 -6.0000e+00 1.9365e-02 1.7462e-02 0.0000e+00 12 8 8 10 0 0 37.23 25.28 0.58 0.01746 0.01056 35 4 1 5 0 1562.140 34.00 20.00 25.28 22.37 2.0 1100.00 -220797 -156950 900000 900000 900000 900000 -15783 900000 -47958 900000 900000 900000 -221622 -52399 900000 900000 -80561 -112687 900000 -65502 -85629 900000 900000 -59872 -81844 900000 900000 900000 900000 900000 900000 900000 310998 900000 49866 7965 59800 -20589 68384 101698 340408 26783 -11554 40687 8302 70474 900000 88032 40580 41269 44600 3219 34758 67740 62731 68905 -3372 33773 17238 5732 96915 18695 52010 17780 23610 -1595 3998 34540 23859 3034 23180 13144 -1298 30289 19521 4778 18519 -1652 -14108 7101 -1183 -2945 7595 -15039 -4381 3678 4658 4154 1499 -1661 1101 -4267 -4538 9922 -2478 -1250 2838 -7713 -3215 -4333 63 4211 -2140 -3602 -3398 -4310 -5284 -1261 -473 -663 2477 312 -37 -2325 731 -315 882 -1739 -881 190 2180 2906 714 -379 -346 1136 8157 -1462 -762 965 2313 1115 927 1885 -612 1411 -1077 -1323 129 226 -1364 -1440 -306 -6449 -2770 900000 900000 900000 900000 -106 900000 -321 900000 900000 900000 -11463 -638 900000 900000 -2157 -4526 900000 -1794 -2866 900000 900000 -1639 -2988 900000 900000 900000 900000 900000 900000 900000 2082 900000 935 219 1041 -937 1556 1974 2279 1327 -874 1852 522 2406 900000 2652 2064 2237 2597 319 2769 4217 4367 4704 -488 3346 1938 698 4800 2202 5013 2749 3714 -322 755 4971 4216 761 5291 3484 -394 6325 4129 1046 3272 -362 -3919 1911 -412 -1208 3127 -8315 -2320 1915 2535 2349 872 -967 586 -2250 -2317 4529 -1441 -843 2160 -6876 -3056 -4290 57 3280 -1761 -2946 -2686 -3677 -4813 -1184 -487 -778 3188 447 -55 -3465 1012 -424 1171 -2475 -1318 295 3304 4206 1011 -527 -465 1458 9426 -1913 -1117 1608 3907 2064 1824 3927 -1404 3366 -2709 -3127 327 554 -3183 -3124 -623 SS 20250915T123741.1Z 9389.526170 246 1 54.06 2 78.82 95.80 12.13 170.87 0.00 1 0.00 1 0 25 2.547e-01 8.100e-03 9.112e-02 1.739e-03 5.972437e-01 9.239558e-04 6.981258e-03 -6.000000e+00 1.483702e-01 229.16 -2.00 3.49 -2.00 320.39 0.00e+00 3.244264e-03 3.576150e-04 2.077396e-03 -6.000000e+00 7.006169e-03 287.46 -2.00 20.00 -2.00 319.71 0.00e+00 4.977 0.002 302.00 328.00 3 1.5449e+00 2.8430e-03 5.8136e-02 -6.0000e+00 3.7044e-01 1.7544e-02 3.6340e-03 3.2918e-02 -6.0000e+00 4.0152e-01 -4.8002e-02 3.3906e-03 1.7326e-02 -6.0000e+00 2.3767e-01 9.6241e-03 1.7072e-03 5.5040e-03 -6.0000e+00 1.0171e-01 4.8105e-04 -1.4022e-04 4.7941e-05 6.9086e-05 -6.0000e+00 7.1147e-03 1.7553e-02 0.0000e+00 11 8 0 10 0 0 27.75 25.26 0.32 0.01755 0.01650 120 13 1 5 0 450.420 34.00 20.00 25.26 23.89 2.0 1100.00 -159843 41585 900000 -49918 900000 -51758 -76091 900000 -129833 900000 -14016 -45174 87229 -55704 84643 -25050 -40474 -50603 -16526 -31734 -41844 -2708 -14717 -25272 -18485 5714 2628 -5378 -11175 23675 1948 5449 2387 -777 -4390 -9180 1928 -13732 -2758 1157 694 -2419 -4877 -4070 -2592 471 7214 2502 1752 612 2591 -427 3003 4328 3351 2369 -1379 -787 -601 -512 3616 158 4637 1342 2737 -373 980 2960 1896 1189 1794 1420 -151 2189 752 26 -849 -2309 -3086 -168 -913 -1085 -510 -3105 -892 0 -92 400 572 511 608 76 -397 1575 -38 -368 677 -444 -289 -1043 -783 -555 -708 -609 -1570 -1865 -1445 1 619 756 915 540 283 357 423 286 573 46 1 25 -122 452 32 62 -235 -36 1213 100 101 243 31 -8 -250 50 -230 86 -268 16 121 56 -342 -123 -26 -2340 106 900000 -338 900000 -325 -658 900000 -2509 900000 -97 -482 310 -1067 502 -535 -1146 -1758 -445 -1060 -1603 -71 -451 -938 -699 180 87 -190 -413 658 79 256 134 -49 -278 -602 123 -1227 -272 132 90 -351 -766 -655 -419 76 1110 416 306 115 528 -91 683 1056 878 656 -409 -233 -174 -146 1019 50 1607 540 1154 -159 401 1211 858 572 955 800 -86 1168 375 13 -390 -1070 -1581 -90 -579 -788 -375 -2493 -748 0 -87 361 517 483 539 63 -313 1230 -33 -344 724 -512 -366 -1354 -960 -658 -767 -657 -1829 -2171 -1765 1 855 1087 1368 862 457 557 659 425 844 72 2 41 -201 717 49 98 -358 -52 1680 143 159 406 54 -15 -486 96 -479 179 -580 35 268 121 -701 -249 -52 SS 20250915T124409.5Z 9389.530666 249 1 54.04 2 77.59 96.87 12.02 177.50 0.00 1 0.00 1 0 25 2.856e-01 6.813e-03 9.055e-02 1.294e-03 5.463331e-01 6.710219e-04 6.389015e-03 -6.000000e+00 1.648922e-01 229.15 -2.00 3.49 -2.00 319.90 0.00e+00 2.788694e-03 2.201724e-04 1.388851e-03 -6.000000e+00 7.375282e-03 287.45 -2.00 20.00 -2.00 319.17 0.00e+00 4.520 0.002 302.00 328.00 3 1.4942e+00 1.9652e-03 5.2618e-02 -6.0000e+00 4.1043e-01 1.0858e-02 2.3976e-03 2.9088e-02 -6.0000e+00 4.4418e-01 -4.4938e-02 2.0607e-03 1.4974e-02 -6.0000e+00 2.6501e-01 1.0199e-02 1.0667e-03 4.7813e-03 -6.0000e+00 1.1332e-01 8.1571e-04 -1.0628e-04 3.5561e-05 5.4971e-05 -6.0000e+00 7.7582e-03 1.7707e-02 0.0000e+00 11 8 0 10 0 0 48.79 25.26 0.29 0.01771 0.01691 157 18 1 5 0 344.190 34.00 19.99 25.26 24.44 1.9 1100.00 -102512 -58274 -23813 -57809 269011 -66774 -61195 -30526 -68368 9318 -32247 -44746 -13266 -32755 2696 -13293 -21376 -19248 -11579 -17263 -15161 -8302 -12910 -9788 -13899 -2991 -3205 -7558 -6303 7937 -2024 1430 -1213 -2466 -403 -5010 -4133 -3765 -1297 838 119 -2583 -2730 -359 -202 356 3410 1162 1312 1873 1757 504 1714 2431 2429 1683 -765 260 -665 -278 2852 677 3076 1439 2355 196 430 1825 1416 1116 1084 195 -73 701 699 -77 -438 -2168 -2117 -668 -667 -1013 -919 -2074 -1102 -118 49 375 355 502 480 -77 201 926 -18 -349 148 -207 -358 -1019 -829 -512 -670 -755 -1169 -1454 -1326 -1 410 797 883 769 443 381 433 572 399 234 -52 -180 -322 69 77 58 118 97 718 428 169 61 135 144 -324 131 -111 -61 -125 -28 -1 -3 -286 -250 10 -1876 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