File name: Pandora75s1_EssexMD_20241101_L2Fit_fout2c1d20221230p1-8.txt File generation date: 20241102T050527.2Z 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 v1.8.60 Instrument operation file used: Pandora75_OF_v3d20220127.txt Instrument calibration file used: Pandora75s1_CF_v104d20221230.txt Level 1 file used: Pandora75s1_EssexMD_20241101_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: 20241101 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 20241101T150330.0Z 9071.627431 148 1 1.23 2 59.42 149.92 63.10 151.26 0.00 1 0.00 1 0 17 1.174e-02 8.310e-03 4.297e-03 2.453e-03 2.237961e-01 1.307104e-03 2.736873e-03 -6.000000e+00 7.049622e-03 224.66 -2.00 3.48 -2.00 315.68 0.00e+00 8.091616e-04 1.301393e-04 1.137080e-04 -6.000000e+00 3.128717e-04 283.29 -2.00 20.00 -2.00 315.05 0.00e+00 1.957 0.000 302.00 328.00 3 1.9406e+00 3.3412e-03 2.2481e-02 -6.0000e+00 1.7374e-02 2.0810e-02 3.7085e-03 1.1302e-02 -6.0000e+00 1.8779e-02 -6.4020e-03 2.1404e-03 5.5719e-03 -6.0000e+00 1.1223e-02 -4.7004e-03 9.8073e-04 1.6222e-03 -6.0000e+00 4.8317e-03 8.4177e-03 -8.2335e-04 7.7022e-05 2.2858e-05 -6.0000e+00 3.6096e-04 -3.4206e-02 2.0140e-04 12 9 1 12 1 1 25.92 23.80 0.46 -0.03421 -0.04039 6 48 1 5 0 174.470 26.51 19.99 23.80 29.90 5.4 1022.31 -947 1407 -1649 -453 -2898 -2991 -992 -767 -2037 -2546 -1994 -3021 -2211 -1308 -287 651 1089 78 1918 1025 2344 1093 1222 2186 1487 1576 545 0 -463 939 -640 1019 572 -660 -2044 -3224 -2954 -2654 -477 -1360 -113 -159 -18 -372 295 737 -132 -747 -621 -359 494 568 969 1047 484 1099 540 645 941 13 1416 1171 1773 1616 1146 17 -5 -613 506 1412 399 1025 641 242 64 -1299 -1568 -2215 -1974 -1675 -1872 -2407 -1903 -1413 -1061 -482 500 769 752 632 180 -88 -716 -401 -456 96 591 990 443 -460 -918 -1236 -994 -594 -479 -768 -410 -250 415 1115 900 268 235 14 -187 217 51 588 484 484 -6 727 687 343 592 -20 294 71 369 -94 -273 -209 -129 -23 -231 221 398 320 -76 -50 -865 -1006 -219 350 -438 -114 -681 -660 -219 -184 -544 -725 -571 -887 -698 -426 -104 240 422 32 789 438 1008 476 538 993 663 724 254 0 -209 406 -290 484 271 -325 -985 -1542 -1506 -1447 -282 -890 -81 -113 -13 -276 218 538 -95 -529 -453 -262 371 428 767 825 396 910 456 543 779 11 1201 1011 1635 1499 1062 16 -4 -542 442 1291 401 1027 647 237 62 -1197 -1386 -1877 -1725 -1535 -1827 -2479 -2000 -1560 -1197 -578 600 949 930 754 208 -98 -767 -416 -493 108 705 1237 562 -580 -1141 -1498 -1155 -707 -587 -998 -536 -330 572 1555 1310 394 332 20 -246 280 66 755 664 678 -8 1034 952 475 776 -26 368 90 492 -129 -377 -296 -187 -34 -344 342 613 504 -120 -78 -1352 -1530 SS 20241101T150858.6Z 9071.631234 152 1 1.67 2 58.90 151.34 62.63 152.59 0.00 1 0.00 1 0 17 1.100e-02 7.716e-03 2.588e-03 1.490e-03 2.223114e-01 7.938294e-04 2.718777e-03 -6.000000e+00 6.605967e-03 224.66 -2.00 3.48 -2.00 315.65 0.00e+00 5.863923e-04 7.875128e-05 9.521570e-05 -6.000000e+00 2.932038e-04 283.29 -2.00 20.00 -2.00 315.02 0.00e+00 1.928 0.000 302.00 328.00 3 1.3785e+00 2.0292e-03 2.2199e-02 -6.0000e+00 1.6280e-02 2.3482e-02 2.2534e-03 1.1223e-02 -6.0000e+00 1.7598e-02 -8.2518e-03 1.2993e-03 5.5423e-03 -6.0000e+00 1.0517e-02 -3.3797e-03 5.9470e-04 1.5957e-03 -6.0000e+00 4.5270e-03 1.5230e-02 -9.0103e-04 4.6611e-05 2.2697e-05 -6.0000e+00 3.3830e-04 -3.2914e-02 2.0902e-04 12 9 1 12 17 1 -90.58 23.80 0.42 -0.03291 -0.03968 16 86 1 5 0 98.150 26.51 20.00 23.80 30.34 5.4 1024.66 -546 -81 -140 -1123 -2405 -2327 -2563 -1735 -842 -2724 -2019 -3211 -1362 -862 -267 124 123 641 1921 1105 1828 1666 1464 2222 1626 1147 652 -221 -404 290 136 762 344 -756 -3058 -3116 -2492 -2180 -599 -617 -771 -24 70 -32 268 287 32 -149 5 -61 359 920 984 1184 556 744 900 729 236 362 1012 1286 2224 1448 498 -549 -341 -534 506 1020 477 797 750 234 -64 -934 -1698 -1843 -1930 -1536 -1834 -1581 -1954 -1667 -1253 -466 276 501 650 761 322 -184 -382 -410 -2 431 546 668 143 -242 -663 -1227 -637 -352 -719 -999 -618 -237 505 625 735 537 258 -21 -35 124 216 520 466 430 249 504 400 495 511 247 44 515 376 205 -111 -385 -243 -57 -72 143 427 8 93 -344 -581 -1070 -126 -20 -36 -285 -561 -554 -625 -419 -222 -775 -577 -942 -425 -278 -96 49 48 255 781 466 780 712 636 997 767 523 300 -105 -180 124 60 357 172 -367 -1462 -1566 -1242 -1239 -371 -417 -543 -18 53 -23 205 217 24 -108 4 -43 264 712 761 958 468 605 739 598 192 294 842 1135 1991 1372 474 -494 -300 -459 451 954 466 813 767 232 -62 -875 -1460 -1591 -1636 -1432 -1819 -1638 -2079 -1868 -1431 -541 335 625 811 913 375 -206 -414 -431 -2 490 657 843 182 -306 -827 -1496 -742 -422 -888 -1258 -814 -313 696 876 1072 787 364 -29 -45 160 279 669 618 604 345 718 556 660 672 323 55 652 482 279 -153 -546 -353 -82 -107 220 654 13 147 -531 -901 -1619 SS 20241101T152204.8Z 9071.640333 161 1 51.72 2 57.75 154.81 61.59 155.83 0.00 1 0.00 1 0 17 1.459e-02 7.813e-03 5.220e-03 1.839e-03 2.161683e-01 9.723954e-04 2.632909e-03 -6.000000e+00 8.760977e-03 224.66 -2.00 3.48 -2.00 317.13 0.00e+00 6.235060e-04 1.337746e-04 2.661433e-04 -6.000000e+00 3.888462e-04 283.29 -2.00 20.00 -2.00 316.40 0.00e+00 1.868 0.000 302.00 328.00 3 4.3729e+00 2.5384e-03 2.1539e-02 -6.0000e+00 2.1591e-02 3.3228e-02 2.8382e-03 1.0945e-02 -6.0000e+00 2.3338e-02 -4.6034e-03 1.6962e-03 5.4251e-03 -6.0000e+00 1.3948e-02 -7.0966e-03 8.2437e-04 1.5708e-03 -6.0000e+00 6.0040e-03 8.1409e-04 -9.3591e-04 5.9467e-05 2.0937e-05 -6.0000e+00 4.4863e-04 -3.2742e-02 2.3011e-04 11 9 0 11 24 0 99.99 23.80 0.51 -0.03274 -0.03978 56 9 1 5 0 923.500 26.51 19.99 23.80 30.62 5.4 1025.65 -4622 -3089 -1987 -4291 -3222 -4296 -3513 -1051 -1414 -1667 -2807 -2876 -5079 -1802 -1860 991 688 423 3024 1634 1940 1593 1682 217 1214 -32 950 1111 22 38 -181 672 281 -831 -3416 -2934 -3237 -1753 -1591 -582 -283 192 -116 -275 409 -39 245 -438 -443 282 1018 996 647 1037 1009 967 372 509 -91 -181 411 2063 2190 1397 1022 -255 -834 -765 698 834 790 1071 978 742 84 -905 -1758 -1758 -2330 -2006 -1643 -1999 -1931 -1812 -956 -237 250 711 816 883 718 -275 -997 -746 -262 98 553 765 239 -2 -989 -924 -1214 -640 -995 -861 -834 -383 564 687 1101 597 176 -226 -400 37 -10 390 558 460 356 358 693 437 255 246 -62 245 168 113 -2 -536 -297 -113 91 114 337 416 181 -214 -677 -949 -561 -406 -267 -567 -382 -531 -439 -140 -207 -260 -447 -464 -905 -349 -406 231 169 108 777 438 528 435 465 63 366 -10 297 330 6 10 -51 199 89 -272 -1108 -927 -1096 -669 -715 -300 -160 113 -71 -170 251 -24 147 -257 -254 160 596 617 424 709 712 695 272 371 -66 -131 305 1600 1822 1230 898 -212 -651 -580 546 721 744 957 878 709 76 -745 -1328 -1263 -1737 -1642 -1492 -1997 -2061 -1854 -1036 -272 300 878 1006 1048 792 -309 -1039 -751 -273 112 627 947 311 -3 -1215 -1059 -1478 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