File name: Pandora206s1_BuffaloNY_20240223_L2Fit_fout2c4d20220512p1-8.txt File generation date: 20241121T072947.4Z 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_20240223_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: 20240223 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 20240223T162535.9Z 8819.684443 360 1 24.00 2 54.76 160.90 120.49 350.70 0.00 1 0.00 1 0 17 1.553e-01 2.465e-02 1.642e-01 2.026e-02 3.121862e-01 9.926091e-03 3.675019e-03 -6.000000e+00 8.603452e-02 225.02 -2.00 3.55 -2.00 318.52 0.00e+00 4.205234e-03 1.940872e-03 1.607568e-04 -6.000000e+00 3.691451e-03 273.04 -2.00 20.00 -2.00 317.96 0.00e+00 1.728 0.000 302.00 328.00 3 8.2262e+00 2.6710e-02 2.3400e-02 -6.0000e+00 2.1321e-01 6.6050e-02 3.0467e-02 1.6754e-02 -6.0000e+00 2.3269e-01 3.0516e-02 2.1034e-02 8.2570e-03 -6.0000e+00 1.3810e-01 -2.4992e-02 1.1114e-02 4.4721e-03 -6.0000e+00 5.8584e-02 1.6393e-05 2.7091e-04 5.6864e-04 3.7544e-05 -6.0000e+00 3.9553e-03 -7.8695e-03 3.3488e-04 12 8 8 10 0 0 -48.81 17.65 2.72 -0.00787 -0.00583 6 6 2 8 0 4000.000 15.01 17.65 10.43 21.27 21.06 20.1 985.16 32583 -1241 -9386 90757 -30738 19183 -12664 33581 -1327 108235 2285 34923 33858 10116 -11506 -7395 28839 2333 6488 9692 43663 -22584 25432 1549 8160 -18007 -13830 20493 -9788 10260 -2583 5569 -1839 9797 1385 1336 -5481 1393 -2385 -4117 -7740 -656 8464 -6102 9061 266 -5463 -8626 5038 -8189 5937 1896 -1335 7152 415 -1322 1534 -351 1 1327 -802 7454 -3168 2109 545 2950 -6003 -1623 -1654 1072 2443 -932 3536 581 2841 1267 -964 -967 -1222 -1192 3660 -1453 -5491 2470 584 3730 1532 -7591 2797 1818 2187 1263 3575 -2045 -1730 2640 129 992 280 1190 -1299 -3839 0 -3914 -155 -1046 -524 -673 941 -1882 1839 -428 -3211 3904 -2068 757 -3072 2082 -1021 909 309 -884 2549 703 1415 606 55 2417 2343 -3065 -180 -868 132 42 344 45 2427 1343 4 -164 289 -2835 -1015 1187 -71 -614 2140 -2068 770 -711 1348 -84 2495 144 1647 1899 831 -1385 -972 2795 311 873 1316 4452 -4238 3095 244 1244 -3702 -2758 2834 -1722 1497 -472 1029 -393 2016 285 266 -1289 352 -729 -1507 -3211 -264 3245 -2754 3524 115 -2462 -3951 2058 -3726 2588 899 -690 3603 231 -755 866 -200 1 745 -477 4427 -2226 1521 400 2002 -4174 -1055 -1145 801 1971 -807 2909 471 2145 866 -611 -586 -790 -882 2908 -1349 -5481 2443 612 4055 1785 -9986 3326 2089 2369 1261 3199 -1883 -1704 2778 151 1287 387 1590 -1660 -4746 0 -4665 -194 -1387 -700 -946 1373 -3032 3032 -732 -5415 5704 -2936 1013 -4284 2882 -1516 1407 486 -1377 3861 1033 1952 806 70 3134 3193 -4734 -285 -1429 219 72 611 84 4511 2584 8 -309 521 -5227 -1791 SS 20240223T173931.0Z 8819.735776 403 1 9.44 2 52.88 183.40 120.59 10.53 0.00 1 0.00 1 0 17 1.844e-02 6.529e-03 1.417e-02 3.770e-03 2.910116e-01 1.844906e-03 3.553501e-03 -6.000000e+00 1.020233e-02 225.02 -2.00 3.55 -2.00 317.58 0.00e+00 6.354310e-05 2.795443e-04 8.868118e-05 -6.000000e+00 4.381841e-04 273.04 -2.00 20.00 -2.00 317.02 0.00e+00 1.653 0.000 302.00 328.00 3 5.1296e+00 4.8720e-03 2.2074e-02 -6.0000e+00 2.5283e-02 -3.8698e-03 5.5006e-03 1.4917e-02 -6.0000e+00 2.7600e-02 5.1730e-03 3.4322e-03 7.4475e-03 -6.0000e+00 1.6381e-02 -4.1044e-03 1.7425e-03 2.1293e-03 -6.0000e+00 6.9449e-03 4.2916e-04 -1.2245e-05 1.0401e-04 2.2705e-05 -6.0000e+00 4.6972e-04 -8.3763e-03 8.6387e-05 12 9 1 12 1 1 99.99 17.65 0.30 -0.00838 -0.00847 8 26 2 8 0 1048.410 15.00 17.65 10.82 21.27 21.06 20.2 988.17 -711 -6666 -2192 14886 -4189 -5293 271 869 -1087 -2002 -3308 755 -4717 695 -2076 -1005 1 -292 -988 133 1530 1970 1747 -17 1219 1391 -199 466 -1901 174 2073 -17 1906 -780 -955 -2877 -2753 -1333 449 -858 -1216 -998 -277 -274 -99 574 -1564 -1419 -1342 -214 864 738 85 1347 474 645 1193 441 140 -301 898 2086 2334 658 250 168 -44 -383 926 54 432 565 207 1171 -88 -49 -1176 -71 -428 -236 -72 -589 -1747 -1671 -1237 -1748 -12 -179 476 269 942 106 621 353 656 601 462 627 -15 -505 -150 -508 -664 116 -347 -494 -998 -827 -464 181 243 336 -23 43 104 155 -203 -118 37 -320 -423 -399 551 323 640 427 1129 893 589 487 188 654 -262 375 -59 -385 244 410 -392 -137 -159 -755 -533 -60 -663 -215 1196 -355 -438 23 82 -117 -231 -380 86 -622 100 -355 -190 0 -59 -212 29 338 427 391 -4 309 367 -54 116 -448 40 506 -5 554 -242 -271 -815 -864 -462 185 -409 -635 -542 -149 -148 -55 318 -869 -769 -716 -114 486 432 53 880 323 446 839 310 96 -206 627 1505 1834 548 208 131 -32 -286 707 46 391 530 194 1073 -75 -39 -879 -50 -322 -195 -65 -574 -1835 -1774 -1408 -2082 -15 -221 585 325 1068 114 630 350 675 667 556 819 -21 -666 -189 -606 -765 138 -443 -643 -1367 -1156 -662 275 381 533 -34 63 145 205 -269 -165 54 -484 -648 -600 822 460 883 580 1443 1163 810 698 285 989 -406 601 -100 -662 426 732 -690 -238 -273 -1251 -882 SS 20240223T174811.4Z 8819.741799 408 1 17.86 2 53.01 186.07 120.31 12.83 0.00 1 0.00 1 0 17 3.384e-02 9.435e-03 3.142e-02 7.051e-03 2.986508e-01 3.445570e-03 3.635584e-03 -6.000000e+00 1.872389e-02 225.02 -2.00 3.55 -2.00 317.83 0.00e+00 1.012769e-03 5.598829e-04 1.974686e-04 -6.000000e+00 8.041601e-04 273.04 -2.00 20.00 -2.00 317.27 0.00e+00 1.658 0.000 302.00 328.00 3 6.6937e+00 9.1274e-03 2.2405e-02 -6.0000e+00 4.6401e-02 2.8815e-02 1.0329e-02 1.5421e-02 -6.0000e+00 5.0652e-02 1.1305e-02 6.6054e-03 7.6532e-03 -6.0000e+00 3.0063e-02 -1.0299e-02 3.4057e-03 2.3479e-03 -6.0000e+00 1.2746e-02 8.6252e-05 -4.1636e-04 1.9420e-04 2.3862e-05 -6.0000e+00 8.6202e-04 -8.7315e-03 8.3512e-05 12 9 9 12 1 1 99.99 17.66 0.63 -0.00873 -0.01186 4 7 2 8 0 3571.790 15.00 17.66 11.40 21.27 21.06 20.4 993.38 6143 618 5703 20717 3292 5507 -829 -2678 -2237 7878 -6441 6013 -8306 6313 1962 -358 -20642 3776 -57 1253 2433 -2700 8714 230 218 -1947 -4723 627 -1773 2400 6112 3818 715 125 -2333 -2960 -3373 -778 -1140 876 -1870 1141 -623 -508 1239 -149 -2589 -3268 1730 -807 2522 1013 -384 836 387 826 1208 -289 1487 141 2964 1647 177 977 -385 942 -415 -1668 -832 967 1345 193 625 469 -87 -710 -123 874 -2023 -1001 -1615 -790 -1820 -1930 16 45 -141 -144 607 862 977 479 -278 -205 -65 163 1122 570 285 374 184 -632 -1790 -36 -230 -1445 -696 -272 -343 -227 506 953 -563 68 -1110 -58 -256 508 -1024 -509 -138 275 1254 -196 1077 -397 470 264 706 875 1173 920 202 -353 -677 67 411 293 661 -860 -372 -945 -438 425 50 455 1337 221 358 -59 -219 -204 690 -639 560 -995 760 286 -60 -4294 665 -11 246 481 -552 1631 50 50 -473 -1188 140 -375 503 1299 900 192 35 -616 -766 -969 -253 -435 387 -899 554 -319 -262 626 -76 -1343 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