File name: Pandora206s1_BuffaloNY_20240610_L2Fit_fout2c1d20220512p1-8.txt File generation date: 20240611T052048.9Z 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_20240610_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: 20240610 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 20240610T121835.8Z 8927.512914 124 1 24.01 2 63.11 82.66 99.56 47.99 0.00 1 0.00 1 0 17 2.289e-01 3.196e-02 2.292e-01 2.378e-02 3.977052e-01 1.240725e-02 4.847670e-03 -6.000000e+00 1.329606e-01 232.61 -2.00 3.55 -2.00 319.17 0.00e+00 1.614039e-03 3.043711e-03 6.912078e-04 -6.000000e+00 6.390711e-03 284.10 -2.00 20.00 -2.00 318.42 0.00e+00 2.199 0.000 302.00 328.00 3 7.5197e+00 3.4795e-02 3.0950e-02 -6.0000e+00 3.3541e-01 1.5291e-01 4.0680e-02 2.2272e-02 -6.0000e+00 3.6443e-01 -5.8466e-02 3.0569e-02 1.0583e-02 -6.0000e+00 2.1454e-01 2.9259e-02 1.5988e-02 3.2818e-03 -6.0000e+00 9.1196e-02 1.7868e-05 -1.6486e-03 6.8550e-04 3.3325e-05 -6.0000e+00 6.0521e-03 7.3301e-03 -2.1579e-04 12 8 8 10 0 0 44.65 18.40 3.07 0.00733 -0.00506 6 6 2 8 0 4000.000 15.00 18.40 19.17 21.79 21.79 22.1 983.66 -48873 900000 900000 900000 69442 900000 108753 900000 92845 900000 99283 62287 -47459 -40456 26693 -13586 900000 30132 81332 -161 900000 314 17967 9342 9100 -15111 8119 -4564 -12803 30467 19513 48928 9878 55087 4595 45035 -1130 21172 7666 -7638 4753 -521 1142 -7688 14185 -6605 -755 -24684 13900 126 9610 1254 4381 -16105 11887 -3564 5173 1730 4059 -409 -10425 18102 -11495 4775 -2296 7109 -1457 -185 -3753 11 1488 1500 1615 -1344 8046 421 6357 -3283 8693 -5822 1946 -238 -1015 -464 -1336 4217 -815 -10 -2892 2775 -1499 856 279 -1843 250 4439 1942 -392 -75 315 3638 850 -1976 -7784 4295 -3829 -3624 530 1013 1497 3821 771 -4187 -413 -1623 1626 -704 -1764 -2723 -277 -1389 883 -927 3128 2675 -278 1411 1580 1982 -860 3120 -502 178 -3577 2870 -1531 421 2184 841 -479 -204 -2000 -782 -2469 900000 900000 900000 1608 900000 2518 900000 2150 900000 2299 1535 -3984 -3662 1507 -1317 900000 2137 3767 -17 900000 33 1625 987 1014 -2242 969 -585 -1658 2663 2114 4386 1415 5514 685 4441 -188 3369 1637 -2266 1379 -167 374 -2793 4127 -2385 -255 -10485 4013 42 3164 489 1763 -8496 4938 -1762 2400 826 1839 -191 -5507 7768 -7312 2823 -1485 3889 -819 -101 -2263 7 1079 1135 1214 -993 4996 259 3348 -1827 4558 -3939 1386 -194 -898 -426 -1322 4233 -902 -11 -3382 2946 -1527 781 244 -1608 230 4254 2145 -499 -102 421 4391 962 -2112 -8985 4802 -4877 -4810 712 1434 2280 6111 1265 -7026 -646 -2366 2150 -950 -2506 -4172 -439 -2244 1356 -1410 4366 3659 -374 1769 1993 2720 -1275 4739 -821 296 -6412 5142 -3011 827 4298 1682 -933 -378 -3591 -1339 SS 20240610T132624.7Z 8927.560008 166 1 24.00 2 50.74 94.03 90.03 59.81 0.00 1 0.00 1 0 17 2.460e-01 2.619e-02 1.587e-01 1.578e-02 3.140999e-01 7.950193e-03 3.854260e-03 -6.000000e+00 1.403750e-01 232.61 -2.00 3.55 -2.00 318.22 0.00e+00 -4.750778e-03 1.466588e-03 7.588525e-04 -6.000000e+00 6.119760e-03 284.11 -2.00 20.00 -2.00 317.43 0.00e+00 1.577 0.000 302.00 328.00 3 7.7475e+00 2.1696e-02 2.3143e-02 -6.0000e+00 3.5293e-01 5.9718e-02 2.4672e-02 1.6766e-02 -6.0000e+00 3.8205e-01 5.0814e-02 1.6486e-02 9.1382e-03 -6.0000e+00 2.2685e-01 -3.0394e-02 8.5966e-03 4.3439e-03 -6.0000e+00 9.5811e-02 3.0640e-05 4.4405e-04 4.4278e-04 3.4390e-05 -6.0000e+00 6.2733e-03 5.2205e-03 6.7181e-05 12 9 8 11 8 0 -3.96 18.41 -1.51 0.00522 0.00856 6 6 2 8 0 4000.000 15.00 18.41 20.81 21.88 21.79 22.2 993.07 6734 143184 98019 51674 139255 23571 125099 11546 57709 46399 30810 39674 -6502 37254 17775 31740 8685 18579 -4702 4367 5750 9466 -2719 15003 -110 11673 7376 7577 6406 6347 5291 -7069 9096 654 219 -5997 1898 177 15546 -10492 4676 -18094 1130 -4652 5332 -6863 -12028 -6588 -1893 3899 -4378 4017 -5091 3749 -36 550 115 3839 1008 -1721 -165 3609 -2978 -449 108 -2784 1295 -4961 4550 -6000 3364 -711 2619 -59 2964 6610 4992 5751 -2046 1532 32 2085 -3034 738 -1294 2823 -1465 -254 -1473 3274 777 585 3025 -2755 2517 -462 5965 864 2875 14 2435 -1818 -2134 -3442 1520 -2333 -2577 3664 -1396 1261 254 2063 -4129 250 -1028 -3493 241 -992 -1162 -688 131 -1954 -792 78 2474 -1737 2520 -2574 2283 -2280 2354 128 455 -123 -1016 101 -235 2449 351 1777 -537 293 -1781 354 2645 2640 1962 2516 1004 2542 682 2576 2465 1912 2285 -644 2793 1787 3099 1115 2252 -753 666 891 1402 -473 2410 -22 2224 1490 1421 1100 1059 952 -1551 1864 154 48 -1350 437 48 4479 -4571 2002 -9858 524 -2287 2408 -3486 -6289 -3175 -858 1675 -2182 1994 -2936 2112 -22 343 75 2386 627 -1077 -104 2332 -2236 -343 82 -2071 863 -3439 3042 -4965 2882 -643 2289 -53 2371 4544 3242 3504 -1407 1119 27 1898 -3021 760 -1416 3183 -1809 -319 -1881 3822 880 608 2808 -2616 2411 -505 6797 1122 3890 19 3024 -2227 -2435 -4101 1889 -3066 -3539 4961 -2086 1964 413 3341 -6858 381 -1455 -4881 324 -1402 -1710 -1072 206 -3067 -1199 116 3365 -2351 3186 -3332 3041 -3408 3551 204 734 -200 -1784 184 -439 4554 670 3223 -956 497 -3088 SS 20240610T153238.3Z 8927.647666 236 1 24.00 2 29.02 125.18 69.35 79.61 0.00 1 0.00 1 0 17 4.930e-02 2.144e-02 4.607e-02 1.629e-02 2.259680e-01 8.172124e-03 2.893879e-03 -6.000000e+00 2.810961e-02 232.62 -2.00 3.55 -2.00 317.08 0.00e+00 1.195243e-03 1.090653e-03 5.477417e-04 -6.000000e+00 1.227129e-03 284.11 -2.00 20.00 -2.00 316.30 0.00e+00 1.143 0.000 302.00 328.00 3 8.2917e+00 2.1733e-02 1.6903e-02 -6.0000e+00 7.0670e-02 9.2292e-02 2.4407e-02 1.2724e-02 -6.0000e+00 7.6530e-02 -6.3460e-03 1.4369e-02 5.9008e-03 -6.0000e+00 4.5435e-02 -1.1606e-02 6.9134e-03 2.1283e-03 -6.0000e+00 1.9172e-02 3.1334e-05 -2.4032e-04 4.5119e-04 2.3476e-05 -6.0000e+00 1.2581e-03 6.7201e-03 -1.6737e-04 12 8 8 10 0 0 47.79 18.42 1.25 0.00672 0.00491 6 6 2 8 0 4000.000 15.00 18.42 22.59 21.88 21.79 22.5 1005.11 1173 20557 14920 11258 7220 -98 17737 -11215 3829 -5327 21862 8777 -15996 9096 3672 3187 2407 4919 1 -6039 10723 -5098 512 -825 -7418 -2344 -3802 -1134 -7695 3759 -137 2034 1830 -2381 6453 -2843 -6284 3394 6754 -6162 1623 -3312 3854 -1395 4062 -1471 -3929 -7065 -594 -258 -1003 3248 387 4788 2207 1656 3332 3030 850 -1466 -3034 -6248 -4779 1477 1404 -3423 -1329 -3093 2476 -776 4325 1422 2827 1853 3485 -193 2948 -326 0 -1787 -493 649 -3129 1202 -1746 3390 740 1597 -1288 277 86 221 1132 -2883 232 -457 2290 -425 -482 -209 1627 440 2914 -2363 383 -1845 -1760 1995 -1767 1778 88 1946 -3720 -1156 -2351 1581 -628 -1231 -3671 -343 248 -554 514 263 2061 -833 563 1862 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