File name: Pandora206s1_BuffaloNY_20240323_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T074950.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: Kang Sun Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 206 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora206_OF_v3d20211008.txt Instrument calibration file used: Pandora206s1_CF_v4d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20240323_L1_smca1c4d20220512p1-8.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: 20240323 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]: 305.0744 305.2154 305.3564 305.4973 305.6383 305.7792 305.9201 306.0611 306.2020 306.3428 306.4837 306.6246 306.7654 306.9063 307.0471 307.1879 307.3287 307.4695 307.6103 307.7511 307.8918 308.0326 308.1733 308.3140 308.4548 308.5955 308.7362 308.8768 309.0175 309.1582 309.2988 309.4394 309.5801 309.7207 309.8613 310.0019 310.1424 310.2830 310.4236 310.5641 310.7046 310.8451 310.9857 311.1261 311.2666 311.4071 311.5476 311.6880 311.8285 311.9689 312.1093 312.2497 312.3901 312.5305 312.6708 312.8112 312.9515 313.0919 313.2322 313.3725 313.5128 313.6531 313.7934 313.9336 314.0739 314.2141 314.3543 314.4946 314.6348 314.7750 314.9151 315.0553 315.1955 315.3356 315.4758 315.6159 315.7560 315.8961 316.0362 316.1763 316.3163 316.4564 316.5964 316.7364 316.8765 317.0165 317.1565 317.2964 317.4364 317.5764 317.7163 317.8563 317.9962 318.1361 318.2760 318.4159 318.5558 318.6956 318.8355 318.9753 319.1152 319.2550 319.3948 319.5346 319.6744 319.8141 319.9539 320.0937 320.2334 320.3731 320.5128 320.6525 320.7922 320.9319 321.0716 321.2112 321.3509 321.4905 321.6301 321.7697 321.9093 322.0489 322.1885 322.3280 322.4676 322.6071 322.7467 322.8862 323.0257 323.1652 323.3046 323.4441 323.5836 323.7230 323.8624 324.0018 324.1413 324.2806 324.4200 324.5594 324.6988 324.8381 324.9774 --------------------------------------------------------------------------------------- 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 20240323T144308.4Z 8848.613292 296 1 24.00 2 54.57 128.54 125.05 330.92 0.00 1 0.00 1 0 17 1.093e-01 2.294e-02 1.142e-01 1.633e-02 3.179039e-01 8.030700e-03 3.830812e-03 -6.000000e+00 6.081972e-02 226.53 -2.00 3.55 -2.00 318.41 0.00e+00 3.755465e-03 1.548551e-03 6.457345e-04 -6.000000e+00 2.623760e-03 275.44 -2.00 20.00 -2.00 317.82 0.00e+00 1.720 0.000 302.00 328.00 3 7.9448e+00 2.1630e-02 2.3993e-02 -6.0000e+00 1.5112e-01 9.1398e-02 2.4658e-02 1.7917e-02 -6.0000e+00 1.6475e-01 3.4675e-02 1.7007e-02 8.1945e-03 -6.0000e+00 9.7805e-02 -2.8082e-02 8.9945e-03 4.0334e-03 -6.0000e+00 4.1387e-02 2.1273e-05 -1.1386e-03 4.5453e-04 3.4838e-05 -6.0000e+00 2.7872e-03 -2.8960e-03 1.3522e-04 12 8 8 10 0 0 16.65 17.56 0.16 -0.00290 -0.01145 6 6 2 8 0 4000.000 15.01 17.56 5.08 21.17 20.96 19.8 946.81 15013 44964 34744 16308 2938 -12097 -15471 25739 37431 18464 43550 25089 28844 44539 35034 10927 16138 15630 -5332 2378 21318 10722 20803 217 -2513 1331 -2589 433 -10756 -864 3033 -1884 -1055 -4733 2026 -7886 -2477 -3296 4940 -8609 -5800 -4706 2889 778 1885 -13460 -8217 -7885 10248 -438 -765 4794 -4219 4001 4079 2566 3943 1795 -1278 -2282 2196 1637 -20 4761 1113 2094 -5785 -16100 804 1836 4832 579 4997 494 2393 814 160 1142 -3746 -1725 -993 1297 -2850 -851 -872 3991 2554 -159 2133 2822 -968 1426 1472 -4096 -2040 -2370 2081 1246 1196 143 2638 -1308 -1661 -2184 18 -3404 -1875 928 962 817 1642 495 -2003 -149 -1716 -1251 -976 -228 -425 -507 215 -1398 2222 -525 2022 -2377 694 -293 1115 93 -750 1196 -300 -1117 477 1271 256 -57 1161 1103 20 -1161 -1340 686 1709 1535 821 148 -677 -916 1150 1654 1043 1942 1353 1763 2769 2826 1235 1831 1883 -833 359 2716 1489 2661 36 -444 235 -481 74 -1922 -146 528 -378 -233 -1133 416 -1739 -571 -884 1468 -3449 -2468 -2066 1223 342 821 -6907 -3959 -3728 4004 -192 -360 2303 -2343 2170 2278 1473 2272 1047 -749 -1342 1280 1041 -14 3481 845 1444 -4046 -12204 549 1421 3968 515 4218 416 1827 562 104 705 -2581 -1292 -832 1180 -2878 -876 -934 4355 2963 -195 2564 3220 -1084 1424 1347 -3859 -2022 -2629 2467 1616 1645 193 3347 -1575 -1865 -2555 23 -4611 -2534 1281 1400 1278 2705 835 -3328 -227 -2496 -1701 -1327 -321 -645 -792 337 -2173 3348 -774 2748 -3223 892 -386 1522 138 -1184 1907 -494 -1868 838 2320 481 -110 2218 2028 36 -2073 -2335 SS 20240323T164741.8Z 8848.699789 369 1 24.01 2 42.27 167.37 129.59 8.13 0.00 1 0.00 1 0 33 5.210e-02 1.788e-02 3.431e-02 1.020e-02 2.406619e-01 4.995339e-03 2.845797e-03 -6.000000e+00 2.900332e-02 226.54 -2.00 3.55 -2.00 317.41 0.00e+00 2.916538e-03 7.291035e-04 8.335613e-05 -6.000000e+00 1.250518e-03 275.45 -2.00 20.00 -2.00 316.81 0.00e+00 1.350 0.000 302.00 328.00 3 7.8723e+00 1.3190e-02 1.8192e-02 -6.0000e+00 7.2066e-02 3.6123e-02 1.4870e-02 1.2734e-02 -6.0000e+00 7.8547e-02 1.7638e-02 9.0665e-03 6.1825e-03 -6.0000e+00 4.6628e-02 -9.5438e-03 4.5305e-03 2.9235e-03 -6.0000e+00 1.9747e-02 3.8615e-05 1.0482e-03 2.8307e-04 2.4122e-05 -6.0000e+00 1.3276e-03 -7.1966e-03 1.9327e-04 12 8 8 10 0 0 -129.75 17.56 1.12 -0.00720 0.00068 6 6 2 8 0 4000.000 14.99 17.56 7.31 21.17 20.96 20.1 962.27 366 30650 -2369 28494 -10414 8034 -6931 7943 -12196 1763 7866 -5022 5846 -2458 7256 -4231 13098 -7944 2190 -4160 9218 -1017 7337 -3671 731 -245 100 6305 -9860 3943 -8778 7622 -2977 5736 -3980 -1732 -7813 -561 4677 -2579 -2520 -3518 5746 -1529 7102 -3218 -3283 -6464 2983 -2247 1797 -35 -638 2446 -643 2566 -1300 2765 -1220 1434 -1103 3905 -2261 4852 158 967 -2640 -2390 353 112 3110 -394 3251 -453 1149 -3015 950 -3353 -1767 -2993 -242 -137 -3586 -246 1093 1552 -611 1689 -845 2999 -915 732 -3043 -2398 -2674 -220 1566 1315 1156 307 1613 -2729 -307 -1940 1865 -2469 1338 -40 1218 361 926 1303 734 -220 -1564 -995 -2871 203 -1052 1671 -919 575 285 367 -32 600 186 -2100 -629 -1007 1604 -1067 327 -1571 1827 -865 1445 73 1039 -58 194 -642 -677 39 2744 -294 2487 -1163 714 -754 821 -1702 223 906 -674 807 -426 1313 -950 2560 -1991 516 -1081 2127 -254 1714 -1002 197 -69 28 1603 -2648 953 -2510 2047 -939 1759 -1223 -509 -2699 -201 1909 -1320 -1392 -1969 3130 -904 3847 -1940 -1939 -3835 1573 -1247 1018 -22 -415 1624 -450 1756 -939 1898 -852 973 -797 2903 -1884 4015 135 765 -2012 -1764 271 95 2796 -381 3002 -416 991 -2417 683 -2393 -1313 -2474 -218 -131 -3765 -260 1226 1801 -759 2115 -1086 3650 -1060 759 -3078 -2336 -2791 -241 1867 1694 1564 406 2023 -3281 -350 -2290 2321 -3353 1828 -56 1771 564 1467 2060 1144 -320 -2163 -1288 -3809 274 -1503 2477 -1417 859 416 525 -43 795 235 -2744 -843 -1441 2343 -1636 501 -2469 2961 -1506 2508 127 1858 -102 326 -1049 -1117 SS 20240323T173928.4Z 8848.735745 399 1 38.16 2 41.77 186.75 127.27 23.66 0.00 1 0.00 1 0 25 8.584e-03 5.408e-03 8.002e-04 3.161e-04 2.299584e-01 1.553627e-04 2.808153e-03 -6.000000e+00 4.775611e-03 226.54 -2.00 3.55 -2.00 316.85 0.00e+00 4.049049e-04 1.941746e-05 4.221268e-05 -6.000000e+00 2.060173e-04 275.45 -2.00 20.00 -2.00 316.23 0.00e+00 1.339 0.000 302.00 328.00 3 1.9663e+00 4.0647e-04 1.7747e-02 -6.0000e+00 1.1866e-02 -1.0019e-02 4.5688e-04 1.1824e-02 -6.0000e+00 1.2936e-02 -1.4688e-03 2.6956e-04 5.8576e-03 -6.0000e+00 7.6796e-03 -2.2565e-03 1.2955e-04 1.6797e-03 -6.0000e+00 3.2499e-03 1.5245e-02 2.2396e-04 8.7212e-06 1.8223e-05 -6.0000e+00 2.1884e-04 -3.8716e-03 1.1106e-04 12 1 1 12 1 1 99.99 17.56 0.28 -0.00387 -0.00219 1724 649 2 8 0 21.800 15.00 17.56 11.26 21.17 20.96 20.6 989.89 -1834 -978 -950 -2460 -3444 -2573 -1130 -183 506 -719 -2110 -1838 -901 -771 290 20 154 238 715 1030 587 359 842 346 -58 628 69 -348 -858 542 994 912 1578 -368 -2257 -1982 -1733 -1158 -204 -255 -858 -693 -589 -600 -213 -349 -400 -247 -650 -21 838 783 905 1038 672 1018 824 612 539 627 1003 1162 1454 1493 159 -237 -532 -740 320 340 389 258 294 445 193 -94 -498 -794 -324 -730 -975 -1028 -1959 -1509 -1139 -721 -375 -16 353 225 427 273 91 299 450 168 531 696 132 -181 -158 -640 -604 10 -636 -684 -602 -564 -220 181 362 212 164 23 -149 153 92 276 186 133 -204 73 259 235 649 356 554 925 552 412 218 18 -242 53 44 -99 32 122 -110 -197 -202 -403 -586 -273 -157 -155 -377 -461 -329 -152 -27 83 -126 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