File name: Pandora25s1_HoustonTX_20230124_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20240927T054223.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 Local principal investigator: Jimmy Flynn Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 25 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora25_OF_v7d20190903.txt Instrument calibration file used: Pandora25s1_CF_v6d20220503.txt Level 1 file used: Pandora25s1_HoustonTX_20230124_L1_smca1c6d20220503p1-8.txt Full location name: University Of Houston Short location name: HoustonTX Country of location: United States Location latitude [deg]: 29.7200 Location longitude [deg]: -95.3400 Location altitude [m]: 19 Local noon date: 20230124 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: Update session 4 for SO2 First and last pixel inside fitting window: 281 423 Nominal wavelengths inside fitting window [nm]: 305.1116 305.2524 305.3931 305.5338 305.6745 305.8152 305.9558 306.0965 306.2371 306.3777 306.5183 306.6589 306.7995 306.9401 307.0806 307.2212 307.3617 307.5022 307.6427 307.7832 307.9236 308.0641 308.2045 308.3449 308.4853 308.6257 308.7661 308.9065 309.0468 309.1872 309.3275 309.4678 309.6081 309.7484 309.8886 310.0289 310.1691 310.3093 310.4495 310.5897 310.7299 310.8701 311.0102 311.1504 311.2905 311.4306 311.5707 311.7108 311.8509 311.9909 312.1310 312.2710 312.4110 312.5510 312.6910 312.8310 312.9709 313.1109 313.2508 313.3907 313.5306 313.6705 313.8104 313.9503 314.0901 314.2300 314.3698 314.5096 314.6494 314.7892 314.9290 315.0687 315.2085 315.3482 315.4879 315.6276 315.7673 315.9070 316.0466 316.1863 316.3259 316.4656 316.6052 316.7448 316.8843 317.0239 317.1635 317.3030 317.4425 317.5821 317.7216 317.8611 318.0005 318.1400 318.2794 318.4189 318.5583 318.6977 318.8371 318.9765 319.1159 319.2552 319.3946 319.5339 319.6732 319.8125 319.9518 320.0911 320.2304 320.3696 320.5089 320.6481 320.7873 320.9265 321.0657 321.2049 321.3441 321.4832 321.6223 321.7615 321.9006 322.0397 322.1788 322.3178 322.4569 322.5960 322.7350 322.8740 323.0130 323.1520 323.2910 323.4300 323.5689 323.7079 323.8468 323.9857 324.1246 324.2635 324.4024 324.5413 324.6801 324.8190 324.9578 --------------------------------------------------------------------------------------- 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 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: 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 20230124T221623.6Z 8424.928052 314 1 49.70 2 72.54 234.94 40.72 199.43 0.00 1 0.00 1 0 17 2.477e-01 1.781e-02 9.509e-02 4.932e-03 4.079285e-01 2.492574e-03 4.432391e-03 -6.000000e+00 1.416036e-01 224.60 -2.00 3.24 -2.00 318.91 0.00e+00 4.063297e-04 5.808245e-04 5.348497e-04 -6.000000e+00 6.339314e-03 284.91 -2.00 20.00 -2.00 318.17 0.00e+00 3.286 0.000 302.00 328.00 3 5.2686e+00 6.8420e-03 3.7870e-02 -6.0000e+00 3.4908e-01 1.7653e-01 7.9402e-03 1.9318e-02 -6.0000e+00 3.7933e-01 -4.0983e-02 5.6605e-03 9.6230e-03 -6.0000e+00 2.2605e-01 8.0031e-03 2.9833e-03 2.7904e-03 -6.0000e+00 9.6977e-02 5.8670e-05 8.0914e-04 1.4234e-04 3.0387e-05 -6.0000e+00 6.7879e-03 -2.9687e-02 5.1022e-04 12 9 8 11 40 0 99.86 22.70 0.20 -0.02969 -0.02361 14 3 1 5 0 3549.490 25.47 19.99 22.70 16.18 27.2 1090.74 -60571 26084 -13241 14161 -8427 4749 900000 -1215 256205 -28236 -8293 58247 -40070 1350 -21306 -6220 -14344 23538 3038 27626 6146 -4918 10356 4882 -4238 -2384 -807 -8876 24460 -30642 26308 11819 4272 -3154 -13481 -193 9553 28593 -4674 -2301 -5068 4508 5348 5665 -4486 2913 -5895 -6345 6752 -920 4575 -1763 3175 3200 7903 524 5112 -7140 2777 1067 4593 -860 -1473 2235 1394 -2204 -3154 -1419 1222 740 2216 4498 527 689 1195 1032 -5774 -2110 -1020 -1025 -2578 -3248 -2031 3220 -812 -1988 449 -828 -668 1085 890 -347 -1371 929 -3468 488 -455 1185 1602 -235 -45 -1593 -1379 -2017 1609 850 -1031 -2253 1423 349 1197 1277 1389 -342 -469 -877 -1025 -913 -1151 106 -229 1005 1340 1457 195 1485 -1309 468 -1251 1402 130 264 -1847 1303 -207 -380 1139 136 -95 -363 453 -813 -871 -3505 762 -574 456 -303 147 900000 -48 1232 -1685 -417 1699 -3330 90 -2058 -586 -1567 1916 315 2371 656 -580 1095 581 -585 -338 -113 -1280 2463 -5238 2904 1667 714 -588 -2632 -33 1613 4713 -1254 -703 -1744 1496 1821 1945 -1693 1032 -2257 -2430 2307 -346 1749 -772 1418 1513 3723 271 2583 -4011 1398 539 2305 -485 -912 1441 921 -1430 -1968 -868 779 529 1696 3506 423 532 860 678 -3714 -1281 -648 -731 -2085 -2903 -1915 3034 -833 -2176 502 -959 -773 1203 932 -343 -1289 846 -3467 518 -536 1505 2145 -318 -58 -1936 -1580 -2342 1923 1070 -1367 -3138 2022 532 1913 2091 2246 -538 -697 -1251 -1451 -1330 -1759 168 -367 1573 2045 2160 282 2049 -1781 630 -1808 2127 210 439 -3190 2266 -380 -724 2190 268 -187 -707 848 -1483 -1552 SS 20230124T222735.2Z 8424.935824 317 1 49.41 2 74.55 236.74 41.54 203.36 0.00 1 0.00 1 0 25 3.240e-02 4.147e-03 7.239e-03 5.822e-04 4.472218e-01 2.944068e-04 4.871844e-03 -6.000000e+00 1.834179e-02 224.60 -2.00 3.24 -2.00 319.29 0.00e+00 7.516664e-04 7.812284e-05 1.923748e-04 -6.000000e+00 8.256315e-04 284.91 -2.00 20.00 -2.00 318.57 0.00e+00 3.685 0.001 302.00 328.00 3 1.0343e+00 8.2354e-04 4.2274e-02 -6.0000e+00 4.5211e-02 2.0722e-02 9.6793e-04 2.1324e-02 -6.0000e+00 4.9153e-02 -1.2420e-03 7.4609e-04 1.0540e-02 -6.0000e+00 2.9391e-02 -6.8268e-03 3.9414e-04 3.1320e-03 -6.0000e+00 1.2631e-02 2.8641e-03 -7.1572e-04 1.6728e-05 3.4374e-05 -6.0000e+00 8.8026e-04 -2.4861e-02 6.3297e-05 10 0 0 10 0 0 100.00 22.68 0.23 -0.02486 -0.03024 845 179 1 5 0 58.460 25.47 19.99 22.68 16.75 27.2 1094.67 -26892 -7228 -6285 -7361 -7357 -12057 787 -8191 -3045 -6495 -8006 -5327 -6345 -2725 -4008 732 -2067 392 -1 2558 -400 -393 -772 -622 -1340 -1591 -755 -2078 -2072 -2813 640 697 1309 -159 -1839 -2104 -2328 -1169 -1095 -901 -1196 -940 -624 -336 -376 -175 -639 -165 -364 47 381 654 745 965 861 672 707 188 501 309 747 768 1170 1536 916 102 7 -440 388 681 375 564 239 530 335 80 -358 -625 -477 -591 -873 -991 -1500 -1439 -904 -651 -157 142 435 669 596 582 318 461 428 310 296 586 278 -182 -295 -746 -558 -187 -468 -843 -567 -612 -213 356 145 106 106 72 -37 97 205 124 25 -25 -332 -110 65 209 240 432 160 650 486 268 162 -20 -107 1 -18 4 -133 193 43 -115 -90 -190 -364 -681 -170 -153 -172 -171 -266 18 -218 -87 -205 -263 -187 -270 -136 -225 45 -142 28 0 202 -33 -33 -68 -59 -138 -173 -82 -218 -209 -298 74 92 179 -23 -257 -294 -362 -213 -244 -221 -327 -272 -187 -102 -116 -54 -200 -52 -116 15 137 257 316 411 385 311 335 89 232 142 354 397 670 902 553 59 4 -263 235 470 270 423 179 399 233 50 -220 -378 -294 -421 -676 -864 -1348 -1365 -912 -666 -168 157 478 707 618 557 286 436 416 324 351 742 362 -238 -379 -922 -639 -216 -559 -1071 -754 -823 -305 530 235 170 168 114 -54 141 294 187 39 -41 -545 -177 101 312 359 616 229 897 732 426 265 -35 -192 2 -34 7 -264 392 87 -228 -171 -359 -667 SS 20230124T223715.2Z 8424.942537 320 1 49.41 2 76.32 238.23 42.37 206.64 0.00 1 0.00 1 0 25 4.991e-02 4.273e-03 9.559e-03 5.461e-04 4.958713e-01 2.766653e-04 5.368732e-03 -6.000000e+00 2.825181e-02 224.60 -2.00 3.24 -2.00 319.53 0.00e+00 9.635107e-04 8.036935e-05 2.704380e-04 -6.000000e+00 1.271702e-03 284.91 -2.00 20.00 -2.00 318.83 0.00e+00 4.129 0.001 302.00 328.00 3 5.1771e-01 7.8660e-04 4.7257e-02 -6.0000e+00 6.9638e-02 2.8256e-02 9.3678e-04 2.3741e-02 -6.0000e+00 7.5709e-02 -1.2568e-02 7.6208e-04 1.1734e-02 -6.0000e+00 4.5271e-02 -3.2336e-03 4.0135e-04 3.5962e-03 -6.0000e+00 1.9456e-02 2.9762e-03 -7.0963e-04 1.5427e-05 3.8174e-05 -6.0000e+00 1.3558e-03 -2.4917e-02 7.0798e-05 10 0 0 10 0 0 99.97 22.67 0.26 -0.02492 -0.03025 663 141 1 5 0 74.510 25.47 20.00 22.67 17.35 27.2 1097.76 19907 -20853 -13456 -17597 -17294 -22223 -11185 -16057 -9406 -11788 -14098 -9724 -12464 -5267 -5352 558 -2464 -732 -2779 783 -1601 -1048 -1164 -2631 -2493 -3072 -1679 -3676 -2774 -4021 -52 -298 346 -808 -3830 -3353 -3153 -799 -1365 -1281 -989 -528 -358 -339 13 142 -478 -188 66 -207 721 751 969 1141 969 729 951 434 709 388 529 639 1290 1565 1165 259 -53 -480 362 659 505 609 287 501 395 -34 -662 -982 -539 -707 -840 -937 -1510 -1538 -971 -586 -184 223 482 645 692 638 499 347 259 171 399 598 271 -145 -198 -692 -508 -230 -518 -830 -573 -686 -315 298 189 237 184 18 -49 19 98 85 -38 27 -323 -89 82 173 278 433 60 629 437 361 279 -10 -93 32 20 24 -181 114 -1 -184 -111 -160 -256 232 -379 -239 -311 -279 -374 -185 -321 -199 -275 -349 -256 -412 -200 -227 26 -129 -41 -170 49 -105 -68 -80 -200 -205 -268 -146 -312 -227 -351 -5 -33 43 -99 -501 -436 -420 -124 -261 -291 -232 -131 -93 -90 3 38 -131 -52 19 -62 234 269 376 444 398 311 417 190 303 165 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