File name: Pandora75s1_EssexMD_20240514_L2Fit_fout2c1d20221230p1-8.txt File generation date: 20240515T051309.1Z 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_20240514_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: 20240514 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 20240514T123954.5Z 8900.527715 150 1 52.08 2 59.54 89.88 114.62 29.54 0.00 1 0.00 1 0 17 1.767e-02 7.879e-03 3.969e-03 1.284e-03 2.972365e-01 6.925751e-04 3.541403e-03 -6.000000e+00 1.087476e-02 231.17 -2.00 3.48 -2.00 317.12 0.00e+00 5.570085e-04 9.530226e-05 2.677777e-04 -6.000000e+00 4.736535e-04 284.60 -2.00 20.00 -2.00 316.39 0.00e+00 1.964 0.000 302.00 328.00 3 4.2184e+00 1.8279e-03 2.5121e-02 -6.0000e+00 2.7205e-02 2.6454e-02 2.0361e-03 1.5386e-02 -6.0000e+00 2.9264e-02 -6.3884e-03 1.2172e-03 7.4940e-03 -6.0000e+00 1.7412e-02 -5.9449e-03 5.9402e-04 2.0734e-03 -6.0000e+00 7.4054e-03 7.3528e-04 -1.0885e-03 4.0363e-05 2.6869e-05 -6.0000e+00 5.4449e-04 -3.4973e-02 1.7072e-04 11 9 0 11 8 0 99.92 23.53 0.50 -0.03497 -0.04315 39 6 1 5 0 1335.260 26.21 19.99 23.53 28.06 4.0 1020.23 -4505 -124 -3177 1452 -6145 -3330 -2335 -5443 -3567 -6459 -4721 -5665 -2792 -3607 -2443 1122 1222 1003 3150 2492 2108 3813 453 2073 75 2964 2006 455 -393 -1357 489 -262 967 -1944 -2549 -2536 -4248 -2002 -150 -834 -1076 -398 -818 275 136 357 -119 119 -201 289 224 548 1426 1387 798 774 751 499 462 500 838 1642 1915 1468 622 -229 -861 -259 376 1683 616 894 545 712 199 -704 -1477 -2467 -2020 -1748 -1463 -2608 -1846 -1209 -604 -415 487 569 573 889 139 57 -349 -502 -330 205 629 823 510 -253 -715 -1430 -546 -559 -812 -1139 -673 -193 463 1053 894 630 129 -89 -380 50 149 351 464 219 279 486 633 374 284 4 144 383 92 -68 -390 -514 -243 12 -43 185 398 536 -183 -131 -462 -873 -473 -14 -387 164 -688 -343 -245 -647 -461 -921 -677 -847 -448 -670 -515 232 271 234 752 621 540 965 121 572 22 887 610 135 -111 -382 142 -83 327 -703 -901 -882 -1613 -784 -68 -447 -592 -230 -492 166 82 215 -71 70 -117 170 138 360 988 942 566 563 555 369 338 364 625 1299 1525 1245 535 -188 -718 -212 300 1474 558 846 518 652 182 -588 -1219 -1975 -1681 -1507 -1411 -2634 -1987 -1288 -683 -500 577 694 698 1041 162 61 -370 -522 -360 230 740 1063 659 -325 -922 -1727 -661 -693 -1017 -1514 -886 -267 670 1531 1365 976 195 -133 -527 70 205 477 669 318 411 707 941 535 386 5 191 513 124 -98 -596 -773 -374 20 -69 312 688 899 -309 -226 -771 -1415 SS 20240514T125932.1Z 8900.541344 159 1 52.17 2 55.74 93.05 112.75 33.90 0.00 1 0.00 1 0 17 3.222e-02 1.144e-02 1.015e-02 3.069e-03 2.749903e-01 1.653517e-03 3.273764e-03 -6.000000e+00 1.983719e-02 231.18 -2.00 3.48 -2.00 317.31 0.00e+00 2.097818e-04 2.375431e-04 2.990577e-04 -6.000000e+00 8.639182e-04 284.60 -2.00 20.00 -2.00 316.56 0.00e+00 1.771 0.000 302.00 328.00 3 5.8632e+00 4.3787e-03 2.2903e-02 -6.0000e+00 4.9626e-02 5.9893e-02 4.8860e-03 1.4275e-02 -6.0000e+00 5.3377e-02 -7.0570e-03 2.9367e-03 6.9258e-03 -6.0000e+00 3.1759e-02 -8.0677e-03 1.4392e-03 1.9192e-03 -6.0000e+00 1.3512e-02 1.7520e-04 -7.1270e-04 9.7588e-05 2.4692e-05 -6.0000e+00 9.9285e-04 -3.5798e-02 2.2228e-04 12 9 8 11 32 0 99.74 23.53 0.47 -0.03580 -0.04115 17 3 1 5 0 3068.470 26.32 20.01 23.53 28.28 4.0 1021.86 8263 597 -612 5137 -19946 -6554 6885 1523 -14901 -11269 -8223 -1089 1000 1853 -5266 1204 -166 -3288 6573 3809 109 4698 -142 1306 -1804 1129 6273 1513 2160 -3446 833 -1733 3421 -1579 81 858 -4360 -3082 -1267 -860 -2050 559 -1316 168 53 1598 -505 -842 133 -1227 -104 516 2692 3230 779 997 451 561 986 -949 -212 1885 2675 663 -456 -1522 -1637 77 1645 3318 884 846 -66 1160 766 407 -2358 -3032 -2701 -3201 -677 -4575 -1647 -958 -160 -854 812 949 842 1694 -875 357 307 -1754 -1107 -111 1115 885 916 527 -717 -2033 104 -832 -807 -1387 -854 106 210 1650 1415 867 491 -492 -1011 -274 -263 50 251 406 336 961 963 105 74 -406 247 274 -219 135 -780 -682 10 78 28 -167 205 945 -76 -173 -570 -552 734 64 -69 530 -2418 -655 618 158 -2020 -1575 -1137 -144 142 296 -1029 245 -37 -777 1467 904 27 1133 -37 348 -521 328 1742 422 563 -929 224 -515 1036 -520 25 263 -1506 -1206 -525 -413 -1103 309 -766 97 31 910 -289 -473 73 -686 -60 316 1710 2148 550 719 332 411 709 -693 -158 1466 2226 545 -379 -1206 -1330 60 1333 2688 800 802 -64 1058 653 345 -1870 -2316 -2136 -2822 -596 -4614 -1730 -1055 -187 -987 970 1166 1034 1986 -978 391 312 -1775 -1167 -127 1292 1128 1224 698 -908 -2426 126 -1041 -994 -1819 -1169 151 314 2396 2155 1338 734 -749 -1430 -365 -349 68 367 625 491 1484 1448 153 102 -536 312 350 -299 194 -1193 -1075 15 121 45 -286 361 1680 -136 -303 -968 -908 SS 20240514T131742.4Z 8900.553963 178 1 2.86 2 52.23 96.13 110.81 37.77 0.00 1 0.00 1 0 17 1.839e-02 1.048e-02 1.180e-02 5.755e-03 2.443731e-01 3.129919e-03 2.925642e-03 -6.000000e+00 1.131778e-02 231.18 -2.00 3.48 -2.00 316.16 0.00e+00 5.067171e-04 3.393443e-04 1.679305e-04 -6.000000e+00 4.929422e-04 284.60 -2.00 20.00 -2.00 315.46 0.00e+00 1.629 0.000 302.00 328.00 3 4.1000e+00 8.1482e-03 2.0721e-02 -6.0000e+00 2.8313e-02 2.9089e-02 9.0181e-03 1.2564e-02 -6.0000e+00 3.0456e-02 -6.2608e-03 5.2125e-03 6.1171e-03 -6.0000e+00 1.8121e-02 -6.1793e-03 2.4094e-03 1.6947e-03 -6.0000e+00 7.7074e-03 1.2566e-03 -7.9660e-04 1.8059e-04 2.3501e-05 -6.0000e+00 5.6664e-04 -3.5252e-02 1.7040e-04 12 9 9 12 17 1 999.00 23.53 0.34 -0.03525 -0.04124 1 6 1 5 0 1427.490 26.32 19.98 23.53 28.57 4.0 1023.60 4701 -2799 -128 -59 -3706 1807 2293 -3102 -583 -4204 -7042 -474 -7495 390 1732 2911 138 1201 1831 1919 2517 2425 2012 177 689 4353 2254 -160 1868 -1716 747 3085 -214 -2246 -3819 -4710 -5900 -3341 -1832 -838 -1282 -924 601 -2362 -224 42 451 600 -624 100 -542 109 -127 927 1192 2072 57 1453 820 1319 -197 2665 1550 1823 2181 -144 -1055 -292 1240 1662 250 76 1220 1038 96 -1123 -2080 -1758 -1261 -1059 -1744 -1579 -2382 -1193 -666 -832 -334 1563 358 1568 513 -881 -944 -465 330 -124 1537 781 534 -565 -985 -1826 -1293 -207 -565 -921 -799 458 -318 -91 1232 198 382 -239 -27 256 113 -14 59 904 -23 811 619 1172 231 327 -530 317 -306 27 -993 -562 244 293 226 246 509 751 182 -346 -962 -1075 852 -550 -25 -11 -736 319 413 -644 -118 -942 -1645 -106 -1950 106 526 964 46 407 641 692 921 889 753 70 285 1796 952 -66 710 -659 290 1249 -96 -1055 -1759 -2150 -2692 -1703 -1010 -531 -840 -635 420 -1718 -160 30 311 403 -416 66 -377 80 -99 703 932 1637 46 1169 655 1046 -163 2285 1361 1681 1995 -127 -930 -250 1095 1523 240 76 1213 998 92 -1049 -1787 -1437 -1061 -983 -1712 -1606 -2613 -1293 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