File name: Pandora272s1_Lauder_20251211_L2Fit_fout2c6d20241202p1-8.txt File generation date: 20260704T063747.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 Local principal investigator: Richard Querel Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 272 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora272_OF_v3d20240829.txt Instrument calibration file used: Pandora272s1_CF_v6d20241202.txt Level 1 file used: Pandora272s1_Lauder_20251211_L1_smca1c6d20241202p1-8.txt Full location name: Lauder Atmospheric Research Station Short location name: Lauder Country of location: New Zealand Location latitude [deg]: -45.0380 Location longitude [deg]: 169.6840 Location altitude [m]: 370 Local noon date: 20251211 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: 196 338 Nominal wavelengths inside fitting window [nm]: 305.0455 305.1861 305.3267 305.4672 305.6077 305.7483 305.8888 306.0293 306.1697 306.3102 306.4507 306.5911 306.7315 306.8720 307.0124 307.1528 307.2931 307.4335 307.5739 307.7142 307.8545 307.9949 308.1352 308.2755 308.4158 308.5560 308.6963 308.8365 308.9768 309.1170 309.2572 309.3974 309.5376 309.6778 309.8179 309.9581 310.0982 310.2383 310.3784 310.5185 310.6586 310.7987 310.9388 311.0788 311.2189 311.3589 311.4989 311.6389 311.7789 311.9189 312.0589 312.1988 312.3388 312.4787 312.6186 312.7585 312.8984 313.0383 313.1782 313.3180 313.4579 313.5977 313.7375 313.8773 314.0171 314.1569 314.2967 314.4364 314.5762 314.7159 314.8556 314.9954 315.1351 315.2747 315.4144 315.5541 315.6937 315.8334 315.9730 316.1126 316.2522 316.3918 316.5314 316.6710 316.8105 316.9501 317.0896 317.2291 317.3686 317.5081 317.6476 317.7871 317.9265 318.0660 318.2054 318.3448 318.4842 318.6236 318.7630 318.9024 319.0417 319.1811 319.3204 319.4598 319.5991 319.7384 319.8777 320.0169 320.1562 320.2955 320.4347 320.5739 320.7131 320.8523 320.9915 321.1307 321.2699 321.4090 321.5482 321.6873 321.8264 321.9655 322.1046 322.2437 322.3828 322.5219 322.6609 322.7999 322.9390 323.0780 323.2170 323.3560 323.4949 323.6339 323.7729 323.9118 324.0507 324.1896 324.3285 324.4674 324.6063 324.7452 324.8840 --------------------------------------------------------------------------------------- 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 20251210T192848.4Z 9475.811672 716 1 54.09 2 64.57 97.79 59.27 333.05 0.00 1 0.00 1 0 17 2.473e-02 8.503e-03 3.975e-03 1.373e-03 2.906353e-01 7.083820e-04 3.623562e-03 -6.000000e+00 1.447543e-02 231.60 -2.00 3.69 -2.00 317.01 0.00e+00 2.859468e-04 9.176004e-05 1.266216e-04 -6.000000e+00 6.143451e-04 277.31 -2.00 20.00 -2.00 316.38 0.00e+00 2.314 0.000 302.00 328.00 3 4.7686e+00 1.8746e-03 2.7229e-02 -6.0000e+00 3.6369e-02 4.1506e-02 2.0910e-03 1.5885e-02 -6.0000e+00 3.9308e-02 -1.3430e-02 1.2476e-03 7.7290e-03 -6.0000e+00 2.3265e-02 4.3187e-03 6.0726e-04 2.1488e-03 -6.0000e+00 9.8456e-03 3.4535e-04 7.6223e-05 3.9460e-05 2.4554e-05 -6.0000e+00 6.8033e-04 5.1557e-03 0.0000e+00 11 8 0 10 0 0 99.99 25.33 0.31 0.00516 0.00573 64 7 1 8 0 845.070 19.99 25.33 17.84 35.00 33.75 1.0 955.49 -6391 -247 -2173 -153 15821 -5660 -2533 -11570 -2285 -7928 -8074 -4288 25 -1987 -1959 2226 -2375 2944 -704 2134 -433 1577 874 605 876 2416 761 1525 -201 -612 -1735 1377 460 3881 -5816 1218 -3462 -3538 -900 84 -1411 2335 -1327 254 207 1016 -179 871 -2678 -215 1503 1042 1125 897 629 570 1319 165 -669 1521 2038 1500 1604 1287 158 -312 466 -2007 450 482 514 945 -221 1092 22 -298 -710 -1476 -1417 -911 -1481 -823 -1709 -2581 -1456 -435 -375 215 765 113 130 94 -200 -780 -825 -5 30 1463 646 993 135 -1173 -2075 -298 28 -611 -596 -232 -366 134 712 493 53 657 -157 -159 -403 342 47 374 137 20 667 407 1021 699 -68 352 460 -23 333 -75 -18 -314 18 -118 -230 478 316 -170 -305 -623 -760 -786 -31 -292 -19 1498 -637 -292 -1622 -326 -1274 -1297 -681 4 -363 -410 498 -587 720 -187 570 -121 430 246 181 274 775 251 473 -59 -177 -541 449 165 1406 -2012 415 -1230 -1448 -429 43 -818 1369 -835 160 129 632 -111 524 -1642 -129 933 649 742 628 461 426 998 127 -508 1116 1522 1121 1303 1130 143 -264 365 -1565 355 427 474 917 -219 1035 20 -258 -558 -1177 -1154 -769 -1331 -818 -1746 -2788 -1658 -498 -453 268 963 139 149 105 -205 -812 -887 -5 35 1870 854 1308 170 -1472 -2435 -342 34 -768 -784 -320 -504 195 1045 749 80 967 -226 -212 -528 457 67 542 206 31 975 575 1428 934 -92 465 605 -33 474 -113 -28 -495 29 -198 -380 803 542 -287 -497 -1031 -1218 SS 20251210T193037.9Z 9475.812939 718 1 54.08 2 64.25 97.49 59.41 332.56 0.00 1 0.00 1 0 17 4.907e-02 1.254e-02 7.385e-03 2.212e-03 2.896526e-01 1.138723e-03 3.596451e-03 -6.000000e+00 2.871120e-02 231.60 -2.00 3.69 -2.00 317.39 0.00e+00 2.668797e-04 1.632880e-04 2.286194e-04 -6.000000e+00 1.218893e-03 277.31 -2.00 20.00 -2.00 316.76 0.00e+00 2.288 0.000 302.00 328.00 3 5.5565e+00 3.0243e-03 2.6993e-02 -6.0000e+00 7.2134e-02 5.7316e-02 3.3816e-03 1.5825e-02 -6.0000e+00 7.7972e-02 -3.0031e-02 2.0495e-03 7.7047e-03 -6.0000e+00 4.6149e-02 1.5252e-02 1.0099e-03 2.1408e-03 -6.0000e+00 1.9523e-02 1.6049e-04 -1.0329e-04 6.3805e-05 2.3758e-05 -6.0000e+00 1.3499e-03 7.5534e-03 0.0000e+00 12 8 8 10 0 0 99.98 25.33 0.21 0.00755 0.00678 48 5 1 8 0 1126.580 20.00 25.33 17.96 35.25 33.75 1.0 956.02 -9072 3277 747 11508 33820 -5622 -6058 -24078 -1944 -13917 -12811 -7636 4207 -2947 -5274 1009 -9589 7274 -3985 3124 134 3569 -1146 1777 167 3432 2148 6953 527 -1777 -1722 3652 26 9040 -12430 7436 -3329 -4401 -1441 1555 -1624 3777 -1205 633 1042 2828 228 -1606 -4384 1420 2646 2281 1056 73 -333 -282 1425 -348 -1429 3175 3293 2482 728 1831 -1294 -465 3420 -2530 1472 102 -53 559 -331 1109 -263 -749 -484 -1949 -1794 -1319 -1519 -88 -1302 -2575 -1787 147 -322 -23 437 -613 -20 -442 26 -1015 -1126 -578 -662 1926 289 2070 446 -970 -2997 375 825 -671 -303 388 -771 167 625 291 -271 1037 -101 139 -903 579 -211 965 86 -115 1148 214 1692 1010 -608 -35 15 -209 469 -91 -158 -381 33 -259 -448 402 416 2 -306 -481 -749 -1008 354 85 1114 2327 -549 -629 -3313 -239 -2047 -1857 -1077 592 -511 -1072 214 -2166 1589 -924 769 35 884 -276 441 44 913 584 1876 140 -477 -491 1065 8 2577 -4146 2165 -1065 -1637 -621 769 -841 1944 -674 352 575 1533 125 -876 -2419 808 1436 1334 662 49 -233 -201 1021 -254 -1034 2167 2296 1861 557 1492 -1105 -368 2624 -2001 1160 84 -49 540 -326 1041 -234 -606 -381 -1465 -1376 -1124 -1351 -86 -1292 -2711 -1990 172 -402 -27 531 -733 -24 -481 28 -1044 -1198 -624 -796 2354 388 2732 567 -1248 -3645 439 1040 -854 -402 537 -1134 243 962 464 -425 1514 -146 187 -1197 779 -304 1475 129 -171 1658 321 2366 1355 -788 -47 20 -299 706 -135 -240 -594 53 -425 -760 691 728 4 -508 -822 -1242 SS 20251210T193330.5Z 9475.814936 724 1 10.78 2 63.74 97.01 59.63 331.80 0.00 1 0.00 1 0 17 4.597e-02 1.252e-02 1.498e-02 5.069e-03 2.826852e-01 2.614876e-03 3.517281e-03 -6.000000e+00 2.691162e-02 231.60 -2.00 3.69 -2.00 317.10 0.00e+00 -4.322530e-04 3.464429e-04 1.329960e-04 -6.000000e+00 1.141738e-03 277.31 -2.00 20.00 -2.00 316.47 0.00e+00 2.247 0.000 302.00 328.00 3 5.3797e+00 6.9064e-03 2.6458e-02 -6.0000e+00 6.7615e-02 4.3655e-02 7.7046e-03 1.5459e-02 -6.0000e+00 7.3069e-02 -1.7963e-02 4.6080e-03 7.5090e-03 -6.0000e+00 4.3247e-02 8.0273e-03 2.2450e-03 2.1006e-03 -6.0000e+00 1.8312e-02 2.0243e-04 4.8638e-04 1.4582e-04 2.3428e-05 -6.0000e+00 1.2640e-03 1.9551e-03 0.0000e+00 12 9 9 12 1 1 999.00 25.33 0.26 0.00196 0.00561 2 2 1 8 0 3592.290 20.00 25.33 18.21 35.25 33.75 1.1 957.51 14117 2052 4729 3309 31644 -11936 -3982 -23219 -3110 -15864 -6172 -3651 3184 -4416 -6322 1287 -7146 2293 -803 3068 193 -976 -1090 3393 3284 1007 4051 4264 2334 -1664 -3502 2764 686 5824 -11159 7071 -2857 -2464 -2978 1305 -1365 2127 -702 1044 1291 2601 654 1652 -3043 2748 1491 1038 5 -154 -992 139 1086 -1065 -2278 4069 1708 3313 597 2079 -780 -645 2102 -2967 812 617 803 1133 -679 1081 -271 -912 -768 -1620 -3120 -702 -2241 -145 -2099 -2776 -1449 -329 329 -215 407 -965 -272 209 435 -908 -254 -959 -273 1672 677 2448 44 -1115 -2178 893 1120 -761 93 314 -602 62 318 445 -97 544 813 -213 -432 -285 -235 599 -295 -114 671 475 1030 554 -316 28 -545 187 567 -325 -145 -799 512 -100 -280 915 469 -106 -391 -537 -787 1451 262 605 406 2597 -1451 -474 -3730 -457 -2566 -995 -587 534 -830 -1381 289 -1837 557 -210 800 53 -268 -308 973 992 324 1278 1269 653 -475 -1080 861 236 1994 -4277 2186 -1059 -960 -1395 693 -762 1203 -422 624 766 1521 384 937 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