File name: Pandora75s1_EssexMD_20240726_L2Fit_fout2c1d20221230p1-8.txt File generation date: 20240727T052029.1Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 75 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora75_OF_v3d20220127.txt Instrument calibration file used: Pandora75s1_CF_v104d20221230.txt Level 1 file used: Pandora75s1_EssexMD_20240726_L1_smca1c1d20221230p1-8.txt Full location name: MDE Essex Monitoring Site Short location name: EssexMD Country of location: United States Location latitude [deg]: 39.3109 Location longitude [deg]: -76.4745 Location altitude [m]: 12 Local noon date: 20240726 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: OoB-data based on session 103 First and last pixel inside fitting window: 196 337 Nominal wavelengths inside fitting window [nm]: 305.0663 305.2078 305.3493 305.4908 305.6322 305.7737 305.9151 306.0566 306.1980 306.3394 306.4807 306.6221 306.7635 306.9048 307.0461 307.1874 307.3287 307.4700 307.6112 307.7524 307.8937 308.0349 308.1761 308.3172 308.4584 308.5996 308.7407 308.8818 309.0229 309.1640 309.3051 309.4461 309.5872 309.7282 309.8692 310.0102 310.1512 310.2921 310.4331 310.5740 310.7149 310.8558 310.9967 311.1376 311.2784 311.4193 311.5601 311.7009 311.8417 311.9825 312.1233 312.2640 312.4048 312.5455 312.6862 312.8269 312.9676 313.1083 313.2489 313.3896 313.5302 313.6708 313.8114 313.9520 314.0925 314.2331 314.3736 314.5141 314.6547 314.7951 314.9356 315.0761 315.2165 315.3570 315.4974 315.6378 315.7782 315.9186 316.0590 316.1993 316.3397 316.4800 316.6203 316.7606 316.9009 317.0411 317.1814 317.3216 317.4619 317.6021 317.7423 317.8825 318.0227 318.1628 318.3030 318.4431 318.5832 318.7233 318.8634 319.0035 319.1436 319.2836 319.4237 319.5637 319.7037 319.8437 319.9837 320.1237 320.2636 320.4036 320.5435 320.6834 320.8233 320.9632 321.1031 321.2430 321.3828 321.5227 321.6625 321.8023 321.9421 322.0819 322.2217 322.3615 322.5012 322.6409 322.7807 322.9204 323.0601 323.1998 323.3395 323.4791 323.6188 323.7584 323.8980 324.0376 324.1772 324.3168 324.4564 324.5960 324.7355 324.8750 --------------------------------------------------------------------------------------- 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 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: 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 20240726T133013.4Z 8973.562655 306 1 2.52 2 51.55 96.11 63.17 253.46 0.00 1 0.00 1 0 17 1.230e-02 8.365e-03 5.626e-03 3.218e-03 2.317183e-01 1.765801e-03 2.791668e-03 -6.000000e+00 7.601320e-03 232.37 -2.00 3.48 -2.00 315.65 0.00e+00 7.830692e-04 1.743165e-04 1.321516e-04 -6.000000e+00 3.382201e-04 290.74 -2.00 20.00 -2.00 314.89 0.00e+00 1.604 0.000 302.00 328.00 3 3.3117e+00 4.5784e-03 2.0180e-02 -6.0000e+00 1.9031e-02 4.9013e-02 5.0529e-03 1.2025e-02 -6.0000e+00 2.0430e-02 -1.3899e-02 2.9019e-03 5.8196e-03 -6.0000e+00 1.2191e-02 -4.1672e-03 1.3136e-03 1.6096e-03 -6.0000e+00 5.2057e-03 2.8814e-03 -1.1539e-03 1.0086e-04 2.3135e-05 -6.0000e+00 3.7914e-04 -3.7989e-02 2.4663e-05 12 9 1 12 1 1 63.38 23.70 0.41 -0.03799 -0.04666 3 13 1 5 0 629.000 26.41 20.00 23.70 31.38 4.6 1033.85 158 1221 924 2151 -3833 -2208 -4540 -2400 -3053 133 -3180 -1925 -449 -221 677 635 1133 -424 478 1139 1727 1143 2044 1472 1797 1672 -28 356 241 -736 847 286 190 -1314 -3140 -2650 -2499 -2720 -503 -1705 -404 -624 -557 -122 -430 648 125 67 -160 -495 194 1407 176 1668 741 1028 1236 25 199 777 1930 1307 2069 1771 601 -595 -577 -217 365 1480 431 1372 171 470 -352 -545 -1157 -1808 -2258 -1418 -1590 -1788 -1919 -1396 -545 -419 -299 888 578 688 180 -321 -342 -446 -64 43 441 470 86 -119 -923 -1714 -513 -488 -959 -632 -634 -318 261 660 1077 792 195 -35 91 -73 -4 183 1121 190 295 210 775 408 864 291 -10 -133 -79 153 79 -700 -10 26 -76 441 540 219 187 -282 -918 -1110 35 297 233 516 -886 -514 -1105 -622 -803 36 -897 -545 -136 -75 237 245 459 -180 194 473 726 484 869 655 831 798 -13 165 105 -313 366 133 94 -676 -1586 -1307 -1315 -1532 -306 -1147 -295 -454 -416 -92 -324 481 92 48 -118 -367 141 1065 142 1319 611 860 1045 21 168 648 1639 1128 1905 1637 559 -551 -524 -191 319 1413 432 1424 172 477 -336 -496 -1014 -1518 -1966 -1283 -1528 -1890 -2073 -1514 -626 -491 -368 1113 727 832 212 -363 -357 -474 -68 50 534 596 109 -150 -1158 -2024 -600 -586 -1186 -791 -832 -419 359 918 1553 1150 274 -48 119 -94 -5 234 1520 264 419 297 1061 559 1117 376 -12 -167 -105 206 106 -979 -15 37 -114 664 837 348 296 -439 -1396 -1702 SS 20240726T134201.6Z 8973.570851 315 1 6.71 2 49.29 98.21 65.28 255.61 0.00 1 0.00 1 0 17 1.163e-02 8.245e-03 4.908e-03 2.845e-03 2.246701e-01 1.560885e-03 2.689675e-03 -6.000000e+00 7.192376e-03 232.36 -2.00 3.48 -2.00 315.59 0.00e+00 5.370622e-04 1.519426e-04 1.226288e-04 -6.000000e+00 3.200269e-04 290.74 -2.00 20.00 -2.00 314.83 0.00e+00 1.530 0.000 302.00 328.00 3 4.1478e+00 4.0479e-03 1.9346e-02 -6.0000e+00 1.8007e-02 5.6498e-02 4.4673e-03 1.1610e-02 -6.0000e+00 1.9331e-02 -1.5148e-02 2.5639e-03 5.6208e-03 -6.0000e+00 1.1535e-02 -2.2663e-03 1.1563e-03 1.5423e-03 -6.0000e+00 4.9251e-03 1.3572e-03 -8.0347e-04 8.9099e-05 2.2239e-05 -6.0000e+00 3.5869e-04 -3.3055e-02 2.3301e-04 12 9 1 12 1 1 94.98 23.70 0.36 -0.03305 -0.03909 4 6 1 5 0 1340.220 26.41 20.00 23.70 31.86 4.6 1037.11 -1049 1836 296 457 -3573 -2610 -1192 -1241 -1075 -4355 -2632 -450 -876 -2383 -431 263 -488 843 1563 915 1680 2090 1370 259 1388 2192 61 951 128 -1020 1243 -401 1196 -1805 -1925 -2932 -2628 -2324 -331 55 -797 -56 -32 -825 484 -2 182 210 -125 329 120 684 1009 957 904 744 915 769 29 -71 151 1853 1300 2061 929 -767 -893 -470 115 1429 1179 1120 637 504 270 -652 -1499 -1870 -1832 -1503 -1657 -2393 -2069 -1575 -1183 -594 246 346 573 880 182 -371 -199 -304 -287 410 232 507 608 -139 -961 -1206 -890 -614 -573 -837 -305 -44 390 812 850 882 101 -235 308 -33 313 262 796 212 742 179 490 178 473 -119 -124 992 242 21 -65 -732 -355 65 -82 446 241 139 147 -319 -626 -1035 -252 470 80 118 -870 -590 -271 -307 -292 -1296 -777 -132 -255 -790 -158 105 -190 335 638 387 717 888 594 118 653 1054 30 442 56 -438 537 -187 583 -930 -957 -1442 -1376 -1288 -198 38 -572 -42 -24 -647 374 -2 137 153 -90 235 89 533 778 773 754 632 786 660 25 -60 132 1598 1210 1997 904 -710 -817 -416 106 1359 1159 1153 660 505 267 -590 -1317 -1568 -1583 -1427 -1655 -2500 -2188 -1748 -1395 -708 306 423 698 1077 208 -409 -213 -315 -309 456 272 648 774 -175 -1212 -1423 -1056 -747 -711 -1050 -398 -61 532 1161 1211 1259 146 -316 398 -43 399 334 1073 291 1037 249 664 242 608 -154 -154 1227 317 28 -90 -1004 -496 94 -120 678 379 214 227 -501 -957 -1542 SS 20240726T140714.3Z 8973.588360 328 1 51.44 2 44.50 103.06 69.84 260.01 0.00 1 0.00 1 0 17 1.608e-02 8.951e-03 1.064e-02 4.001e-03 2.075650e-01 2.152938e-03 2.471468e-03 -6.000000e+00 9.941228e-03 232.36 -2.00 3.48 -2.00 317.02 0.00e+00 1.405723e-03 2.921038e-04 2.072223e-04 -6.000000e+00 4.423248e-04 290.74 -2.00 20.00 -2.00 316.19 0.00e+00 1.400 0.000 302.00 328.00 3 5.9126e+00 5.6837e-03 1.7798e-02 -6.0000e+00 2.4889e-02 8.1306e-02 6.3324e-03 1.0802e-02 -6.0000e+00 2.6718e-02 -8.3016e-03 3.7161e-03 5.2355e-03 -6.0000e+00 1.5943e-02 -7.8990e-03 1.7762e-03 1.5897e-03 -6.0000e+00 6.8078e-03 2.6868e-04 -7.0828e-04 1.2813e-04 1.8792e-05 -6.0000e+00 4.9574e-04 -3.3723e-02 2.2494e-04 11 9 0 11 24 0 99.96 23.70 0.35 -0.03372 -0.03904 18 3 1 5 0 2857.370 26.41 19.99 23.70 33.51 4.5 1046.85 -2012 -1275 944 -1085 772 -1035 -2568 93 -9394 -1678 -1565 -3389 440 2362 -1103 19 239 4653 3049 671 1343 2994 2390 533 540 800 -708 466 -1318 -3956 -2961 -541 -1501 424 -5180 -1580 -2772 -1236 -1728 -1322 -799 -528 -42 654 101 545 253 -641 -468 -2222 280 1629 1050 1852 1169 1356 559 480 189 708 244 2510 1787 2214 457 -1243 -1783 -824 754 1256 645 1158 1407 628 -536 -430 -1892 -1738 -2324 -1708 -2069 -2454 -1792 -1037 -906 -800 473 1063 1122 1120 156 137 -663 -1018 -285 -187 629 699 546 -642 -773 -969 -1277 -1013 -814 -1140 -440 -21 160 1080 1125 777 262 -9 -308 -252 -363 -31 914 212 49 433 547 598 434 65 17 527 -749 -397 -203 20 -403 76 707 171 266 279 85 -129 -309 -1249 -285 -197 147 -166 105 -134 -341 13 -1582 -276 -259 -576 78 458 -249 5 61 1175 808 187 378 827 671 157 165 251 -225 140 -376 -1124 -856 -161 -479 150 -1857 -534 -1011 -506 -760 -668 -441 -305 -25 388 60 321 146 -398 -283 -1360 173 1048 714 1305 853 1002 421 360 140 522 186 1990 1528 1974 410 -1060 -1420 -630 593 1084 610 1137 1382 600 -483 -351 -1423 -1238 -1713 -1375 -1855 -2417 -1870 -1131 -1053 -990 552 1272 1475 1416 185 147 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