File name: Pandora206s1_BuffaloNY_20240607_L2Fit_fout2c1d20220512p1-8.txt File generation date: 20240608T051805.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Kang Sun Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 206 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora206_OF_v3d20211008.txt Instrument calibration file used: Pandora206s1_CF_v1d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20240607_L1_smca1c1d20220512p1-8.txt Full location name: University at Buffalo Short location name: BuffaloNY Country of location: Canada Location latitude [deg]: 43.0015 Location longitude [deg]: -78.7869 Location altitude [m]: 190 Local noon date: 20240607 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: 223 365 Nominal wavelengths inside fitting window [nm]: 305.0398 305.1808 305.3218 305.4628 305.6038 305.7447 305.8857 306.0266 306.1675 306.3084 306.4493 306.5902 306.7311 306.8720 307.0128 307.1537 307.2945 307.4353 307.5761 307.7169 307.8577 307.9985 308.1393 308.2800 308.4207 308.5615 308.7022 308.8429 308.9836 309.1243 309.2649 309.4056 309.5462 309.6869 309.8275 309.9681 310.1087 310.2493 310.3899 310.5305 310.6710 310.8116 310.9521 311.0926 311.2331 311.3736 311.5141 311.6546 311.7950 311.9355 312.0759 312.2164 312.3568 312.4972 312.6376 312.7779 312.9183 313.0587 313.1990 313.3394 313.4797 313.6200 313.7603 313.9006 314.0408 314.1811 314.3214 314.4616 314.6018 314.7421 314.8823 315.0225 315.1626 315.3028 315.4430 315.5831 315.7232 315.8634 316.0035 316.1436 316.2837 316.4238 316.5638 316.7039 316.8439 316.9839 317.1240 317.2640 317.4040 317.5439 317.6839 317.8239 317.9638 318.1038 318.2437 318.3836 318.5235 318.6634 318.8033 318.9431 319.0830 319.2228 319.3627 319.5025 319.6423 319.7821 319.9219 320.0616 320.2014 320.3412 320.4809 320.6206 320.7603 320.9000 321.0397 321.1794 321.3191 321.4587 321.5984 321.7380 321.8776 322.0172 322.1568 322.2964 322.4360 322.5755 322.7151 322.8546 322.9941 323.1336 323.2731 323.4126 323.5521 323.6916 323.8310 323.9705 324.1099 324.2493 324.3887 324.5281 324.6675 324.8069 324.9462 --------------------------------------------------------------------------------------- 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: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Temperature at electronics board 1 [°C], 999=no temperature signal Column 98: Temperature at electronics board 2 [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: 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 20240607T125037.1Z 8924.535152 128 1 24.01 2 57.32 88.17 64.94 74.41 0.00 1 0.00 1 0 17 1.998e-01 2.148e-02 1.736e-01 1.774e-02 3.211585e-01 8.880687e-03 3.972389e-03 -6.000000e+00 1.140255e-01 232.42 -2.00 3.55 -2.00 318.46 0.00e+00 1.672901e-04 1.773184e-03 9.830228e-04 -6.000000e+00 4.965462e-03 283.79 -2.00 20.00 -2.00 317.69 0.00e+00 1.846 0.000 302.00 328.00 3 7.6211e+00 2.4412e-02 2.5520e-02 -6.0000e+00 2.8658e-01 7.3681e-02 2.7830e-02 1.8201e-02 -6.0000e+00 3.1020e-01 1.0055e-02 1.8877e-02 8.4787e-03 -6.0000e+00 1.8419e-01 -1.0842e-02 9.8750e-03 2.3985e-03 -6.0000e+00 7.7872e-02 2.6489e-05 -6.2901e-05 4.9726e-04 2.4240e-05 -6.0000e+00 5.0942e-03 1.7575e-03 1.6072e-04 12 8 8 10 0 0 42.06 18.76 5.79 0.00176 0.00128 6 6 2 8 0 4000.000 15.00 18.76 22.83 22.09 22.19 22.5 1008.56 -12726 37479 53053 49224 71013 26402 145902 93734 23135 64333 56846 -7860 -19237 20552 -7359 991 21654 19014 2157 5362 10100 -1089 -5879 16728 12528 7496 11750 -2190 2658 -3133 7875 -9940 10278 -3582 10910 1196 -4275 -1948 -1398 -1955 -434 -5850 -1924 -3463 4336 1993 -5837 -9396 -1402 5547 -3372 3016 -2310 -759 -2971 -2692 238 -1169 1849 -130 -8197 -19 -2396 -650 17 4048 -1152 -3998 5037 -3413 3596 3268 1289 1787 4888 5179 4660 -3990 -4253 -532 -2141 3967 -3333 -1481 -567 3551 1732 472 448 1608 -3656 29 2847 -2142 55 -276 3528 1668 1405 4 3493 -102 -2013 -3732 1764 -415 -2225 3651 -182 159 -572 958 -2301 -1653 -1439 564 -1189 -2236 -2768 -609 1968 -803 -698 -726 2674 -153 -41 531 1838 -1927 2758 -457 -668 -297 1203 396 -495 1979 615 841 -656 -896 -955 -692 1390 1770 1769 1796 984 2525 2121 1201 2398 2270 -607 -1759 1587 -809 114 2306 2177 285 716 1425 -170 -908 2382 1968 1297 1986 -402 428 -525 1279 -2104 1956 -834 2048 236 -973 -501 -432 -726 -176 -2437 -799 -1595 1835 867 -2711 -4427 -603 2230 -1575 1433 -1227 -422 -1760 -1620 142 -710 1061 -75 -5237 -12 -1697 -491 13 2732 -762 -2650 3205 -2707 2944 2810 1132 1501 3702 3495 2847 -2512 -2796 -384 -1775 3448 -3354 -1522 -618 3994 1937 552 528 1806 -4292 30 2622 -1993 53 -297 4081 2045 1853 5 4477 -125 -2310 -4446 2181 -553 -3146 5117 -259 241 -933 1572 -3777 -2520 -2160 774 -1651 -3265 -4351 -928 2980 -1225 -1118 -1113 3737 -210 -53 684 2527 -2959 4283 -759 -1131 -519 2049 716 -923 3681 1169 1542 -1171 -1657 -1713 SS 20240607T135443.4Z 8924.579669 168 1 24.01 2 45.64 99.78 53.81 83.61 0.00 1 0.00 1 0 17 1.041e-01 2.417e-02 6.840e-02 1.499e-02 2.583015e-01 7.529073e-03 3.133574e-03 -6.000000e+00 5.943732e-02 232.43 -2.00 3.55 -2.00 317.79 0.00e+00 1.846353e-03 1.217858e-03 3.158821e-04 -6.000000e+00 2.588256e-03 283.80 -2.00 20.00 -2.00 317.03 0.00e+00 1.428 0.000 302.00 328.00 3 7.9008e+00 2.0297e-02 1.9960e-02 -6.0000e+00 1.4939e-01 4.0915e-02 2.2878e-02 1.4233e-02 -6.0000e+00 1.6169e-01 1.9653e-02 1.4142e-02 6.7314e-03 -6.0000e+00 9.6010e-02 -9.7509e-03 7.1405e-03 2.5379e-03 -6.0000e+00 4.0595e-02 3.3303e-05 -5.5463e-05 4.1801e-04 2.4035e-05 -6.0000e+00 2.6552e-03 1.4612e-03 1.7467e-04 12 9 8 11 8 0 98.28 18.75 0.64 0.00146 0.00104 6 6 2 8 0 4000.000 15.00 18.75 25.77 22.09 22.09 22.5 1025.53 -25693 64195 3358 38873 20147 30628 14365 48184 8907 19286 31775 -1401 3440 -3652 14607 -20803 20274 -6598 7467 -9398 15286 5316 6547 561 3465 -2566 -6363 4928 -13333 10943 -4830 2518 -846 9566 710 3123 -4508 -3261 6363 -4733 1738 -2949 1977 -6349 5517 -5850 362 -10944 442 -3546 1023 1047 1048 4853 -93 12707 -538 1082 921 1193 -8908 5305 -4851 947 -2775 1409 -2079 -2828 2555 -4489 4769 2701 1881 682 3745 -1752 4195 -4793 -3604 -1932 543 1385 -965 -1524 -108 2967 713 1599 -942 1515 -1703 -28 1408 -1132 1497 -2493 1173 630 2998 1043 3799 -1879 -769 -5211 1079 -2137 -1429 1233 -109 34 1029 961 -1183 126 -5735 1550 -2486 271 -2192 757 -359 952 -629 2138 2654 -1413 890 708 1518 -719 3635 -1591 621 -1243 970 -719 -721 119 157 -172 344 -110 -81 -2863 3360 327 2621 1425 1820 1050 2772 848 1773 2532 -155 409 -522 2066 -4570 3193 -1365 1402 -2168 2919 1068 1352 126 812 -663 -1680 1134 -3388 2131 -1175 612 -232 2499 188 764 -1296 -1062 2256 -2155 818 -1514 1000 -3546 2812 -3252 192 -6128 223 -1847 536 590 621 2929 -59 7417 -366 722 601 769 -6518 3614 -3857 765 -2347 1080 -1522 -2009 1792 -3738 4131 2422 1706 604 3099 -1371 2869 -3360 -2491 -1485 458 1284 -982 -1567 -117 3361 869 2001 -1221 1848 -1975 -30 1353 -1062 1437 -2753 1387 809 4024 1402 4659 -2318 -870 -6314 1348 -2817 -1950 1719 -161 53 1641 1557 -1945 190 -8368 2018 -3347 369 -3184 1145 -562 1451 -951 3105 3614 -1912 1109 879 2005 -1037 5288 -2510 971 -1978 1608 -1277 -1310 220 292 -312 597 -185 -136 SS 20240607T140524.5Z 8924.587089 173 1 21.52 2 43.73 101.97 51.92 85.22 0.00 1 0.00 1 0 17 9.028e-03 5.533e-03 4.741e-03 1.789e-03 2.285209e-01 9.027589e-04 2.763732e-03 -6.000000e+00 5.149679e-03 232.43 -2.00 3.55 -2.00 316.98 0.00e+00 5.017187e-04 1.170435e-04 4.335162e-05 -6.000000e+00 2.243375e-04 283.80 -2.00 20.00 -2.00 316.22 0.00e+00 1.382 0.000 302.00 328.00 3 4.4418e+00 2.3942e-03 1.8344e-02 -6.0000e+00 1.2943e-02 5.8197e-03 2.6807e-03 1.2106e-02 -6.0000e+00 1.4012e-02 1.9657e-03 1.5716e-03 5.8746e-03 -6.0000e+00 8.3199e-03 -3.8133e-03 7.5354e-04 1.6559e-03 -6.0000e+00 3.5153e-03 1.2134e-03 1.5210e-04 4.9256e-05 1.7556e-05 -6.0000e+00 2.3025e-04 2.3251e-03 6.7195e-06 12 1 1 12 1 1 99.99 18.75 0.37 0.00233 0.00347 56 72 2 8 0 377.360 14.99 18.75 25.85 22.09 22.19 22.5 1026.27 -2303 -340 -1769 694 -4425 -1400 -2025 1468 267 -393 -848 -853 -1520 -1119 135 229 66 -537 854 101 1522 -694 136 6 183 270 441 -1236 356 369 1998 1378 1384 353 -2145 -1336 -3062 -709 -753 -209 -783 -605 -757 -661 70 -730 -496 -637 -500 -128 966 777 938 714 633 705 1100 741 699 514 922 1138 1247 1561 202 150 -596 -504 118 680 131 562 63 735 10 137 -204 -1005 -249 -827 -619 -1176 -1799 -1643 -1090 -766 -371 -220 187 253 416 271 43 85 424 178 610 875 31 -87 -227 -484 -883 41 -425 -694 -596 -535 -320 6 439 183 141 22 100 101 40 52 -6 248 -385 -23 352 198 620 377 383 1161 675 591 255 100 -16 148 -83 -69 -182 223 -197 -294 -76 -490 -568 -322 -51 -279 101 -586 -169 -259 202 42 -66 -139 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