File name: Pandora64s1_NewHavenCT_20240406_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240407T045955.1Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 64 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora64_OF_v3d20190516.txt Instrument calibration file used: Pandora64s1_CF_v4d20190911.txt Level 1 file used: Pandora64s1_NewHavenCT_20240406_L1_smca1c4d20190911p1-8.txt Full location name: New Haven - Criscuolo Park CTDEEP (USEPA AQS ID 34-017-0006) Short location name: NewHavenCT Country of location: USA Location latitude [deg]: 41.3014 Location longitude [deg]: -72.9029 Location altitude [m]: 4 Local noon date: 20240406 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: Mod WL cal slit func 9 First and last pixel inside fitting window: 249 390 Nominal wavelengths inside fitting window [nm]: 305.1279 305.2688 305.4097 305.5506 305.6915 305.8324 305.9732 306.1141 306.2549 306.3958 306.5366 306.6774 306.8182 306.9590 307.0997 307.2405 307.3812 307.5220 307.6627 307.8034 307.9441 308.0848 308.2255 308.3662 308.5068 308.6475 308.7881 308.9287 309.0693 309.2099 309.3505 309.4911 309.6316 309.7722 309.9127 310.0533 310.1938 310.3343 310.4748 310.6153 310.7557 310.8962 311.0366 311.1771 311.3175 311.4579 311.5983 311.7387 311.8791 312.0195 312.1598 312.3002 312.4405 312.5808 312.7211 312.8614 313.0017 313.1420 313.2822 313.4225 313.5627 313.7030 313.8432 313.9834 314.1236 314.2638 314.4039 314.5441 314.6842 314.8244 314.9645 315.1046 315.2447 315.3848 315.5249 315.6649 315.8050 315.9450 316.0851 316.2251 316.3651 316.5051 316.6451 316.7850 316.9250 317.0649 317.2049 317.3448 317.4847 317.6246 317.7645 317.9044 318.0442 318.1841 318.3239 318.4638 318.6036 318.7434 318.8832 319.0230 319.1628 319.3025 319.4423 319.5820 319.7217 319.8614 320.0011 320.1408 320.2805 320.4202 320.5598 320.6995 320.8391 320.9787 321.1183 321.2579 321.3975 321.5371 321.6766 321.8162 321.9557 322.0953 322.2348 322.3743 322.5138 322.6532 322.7927 322.9322 323.0716 323.2110 323.3504 323.4899 323.6292 323.7686 323.9080 324.0474 324.1867 324.3260 324.4654 324.6047 324.7440 324.8833 --------------------------------------------------------------------------------------- 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 20240406T120732.7Z 8862.505240 108 1 5.04 2 71.75 97.18 64.38 130.55 0.00 1 0.00 1 0 25 2.385e-01 1.110e-02 1.927e-01 6.509e-03 6.143686e-01 3.543883e-03 7.085371e-03 -6.000000e+00 1.443413e-01 227.91 -2.00 3.52 -2.00 319.83 0.00e+00 1.510004e-03 1.129390e-03 1.209812e-03 -6.000000e+00 6.268920e-03 279.24 -2.00 20.00 -2.00 319.26 0.00e+00 3.152 0.001 302.00 328.00 3 3.4276e+00 1.0146e-02 4.5339e-02 -6.0000e+00 3.5907e-01 6.6677e-02 1.2296e-02 3.2252e-02 -6.0000e+00 3.8827e-01 -3.3225e-02 1.0901e-02 1.6975e-02 -6.0000e+00 2.3075e-01 6.1984e-03 5.6226e-03 5.6794e-03 -6.0000e+00 9.7901e-02 3.2791e-04 9.6625e-04 1.8773e-04 6.7942e-05 -6.0000e+00 7.0891e-03 -1.8282e-02 -2.9309e-04 12 9 9 12 9 1 20.68 21.50 0.15 -0.01828 -0.01102 3 9 1 5 0 1257.920 26.00 19.99 21.50 11.25 37.6 970.17 61901 -88417 57246 -110029 66722 -48664 -92778 -127423 -2247 -47751 -79330 -57523 -22981 -53520 -10935 -24429 -6574 13072 1679 -886 -1982 -7150 3424 14416 -8403 16823 -17573 3370 -11402 -6685 3209 -4822 -10553 -1226 -3815 2969 -6857 4977 -4383 -279 -1217 7451 -5923 7663 -2019 5506 -2753 6127 -4734 433 -936 7298 2665 3464 -484 2233 842 2654 -1563 -816 -1423 3805 672 4823 1880 -459 -686 -290 -690 2043 1296 183 1101 -1154 -1092 -1389 1761 -3091 540 -1149 191 -2284 -1408 -2678 334 -31 674 -279 1602 -649 1008 464 -178 -962 799 -366 382 1357 505 -625 -403 -2315 -2413 -921 660 -1475 273 -666 -166 154 723 36 852 105 248 -970 530 -107 575 615 -371 -471 1111 139 1003 1191 -1390 779 1054 223 312 -802 -1162 -229 230 -146 -190 562 570 408 -396 -1117 393 -1403 363 -2134 423 -545 -1701 -3774 -23 -774 -1902 -1339 -478 -1887 -308 -865 -227 410 63 -36 -82 -303 150 615 -455 783 -1092 165 -666 -420 216 -403 -1008 -114 -352 274 -759 589 -691 -49 -224 1338 -1269 1450 -429 1110 -616 1307 -1182 111 -273 2155 855 1189 -180 840 326 994 -598 -313 -583 1573 320 2402 968 -235 -359 -152 -410 1272 863 126 720 -722 -646 -754 942 -1744 337 -816 147 -1940 -1265 -2492 324 -32 684 -288 1595 -646 955 420 -160 -897 827 -407 462 1753 679 -821 -505 -2774 -2769 -1094 794 -1886 355 -907 -240 237 1156 59 1394 165 380 -1469 812 -166 935 1012 -601 -734 1704 206 1462 1673 -1980 1178 1672 380 556 -1473 -2193 -453 470 -300 -396 1174 1165 812 -773 -2152 SS 20240406T121202.8Z 8862.508366 111 1 28.77 2 70.91 97.96 63.74 131.53 0.00 1 0.00 1 0 25 2.054e-01 1.088e-02 4.452e-02 2.175e-03 5.914349e-01 1.181590e-03 6.889952e-03 -6.000000e+00 1.241953e-01 227.92 -2.00 3.52 -2.00 319.71 0.00e+00 2.539811e-03 3.612448e-04 7.477677e-04 -6.000000e+00 5.397913e-03 279.24 -2.00 20.00 -2.00 319.14 0.00e+00 3.022 0.000 302.00 328.00 3 3.3827e+00 3.3629e-03 4.3542e-02 -6.0000e+00 3.0894e-01 6.7639e-02 4.0231e-03 3.0892e-02 -6.0000e+00 3.3422e-01 -3.6529e-02 3.4478e-03 1.6002e-02 -6.0000e+00 1.9864e-01 8.7073e-03 1.7876e-03 5.4576e-03 -6.0000e+00 8.4115e-02 3.9717e-04 -6.3886e-04 6.3311e-05 6.4062e-05 -6.0000e+00 6.1079e-03 -1.9725e-03 -3.8113e-05 12 9 9 12 1 1 99.74 21.49 0.07 -0.00197 -0.00677 28 12 1 5 0 991.710 26.00 19.99 21.49 11.23 37.6 970.14 -55774 -41943 -33632 -45212 -182528 -52490 -36612 -70016 -15057 -34372 -42305 -40602 -11515 -23658 -6907 -15931 646 -2068 8412 -2348 3955 -2387 13613 -3800 278 -2524 -2458 -8578 -1599 -11954 5817 -1148 5331 -1040 -1613 -3913 48 870 929 -248 2536 -321 391 -969 1154 1638 1567 2595 851 -678 2663 2597 2405 1747 978 1399 341 295 681 215 155 2196 2160 4241 1713 56 -187 -975 835 1969 116 1357 -573 87 -664 -1172 -908 -2152 -1136 81 -1488 -986 -2150 -2204 -927 -571 300 495 1137 883 174 457 -806 -463 298 439 -466 1066 817 -532 -782 -1639 -2061 362 244 -1573 -816 -615 -121 386 1078 339 403 99 -378 -396 179 -317 694 629 -35 125 898 422 1091 664 -1318 178 993 60 266 -299 -498 -374 375 -65 -407 448 515 -486 45 -967 -765 -557 -433 -614 -8198 -757 -497 -1411 -209 -622 -885 -936 -267 -724 -219 -640 24 -88 342 -112 180 -118 615 -208 15 -151 -147 -533 -95 -878 423 -102 504 -107 -160 -423 6 115 149 -47 506 -70 89 -225 268 387 377 643 212 -185 785 840 844 632 370 547 137 117 263 84 64 991 1035 2169 902 29 -98 -540 512 1278 82 958 -398 56 -412 -668 -501 -1253 -715 59 -1188 -841 -1978 -2063 -919 -593 308 512 1196 880 163 421 -737 -449 309 498 -581 1403 1077 -710 -972 -1937 -2428 421 302 -1989 -1093 -847 -175 593 1763 549 659 154 -580 -593 273 -490 1119 1029 -56 193 1384 622 1598 942 -1879 260 1555 100 463 -547 -931 -718 759 -132 -840 928 1044 -972 88 -1814 SS 20240406T122208.1Z 8862.515371 114 1 48.31 2 69.04 99.73 62.34 133.76 0.00 1 0.00 1 0 25 1.254e-01 8.174e-03 1.580e-02 1.007e-03 5.475839e-01 5.437366e-04 6.410845e-03 -6.000000e+00 7.579790e-02 227.92 -2.00 3.52 -2.00 319.30 0.00e+00 1.406533e-03 1.452908e-04 4.759525e-04 -6.000000e+00 3.294459e-03 279.24 -2.00 20.00 -2.00 318.71 0.00e+00 2.768 0.000 302.00 328.00 3 2.7703e+00 1.5124e-03 4.0080e-02 -6.0000e+00 1.8855e-01 4.4872e-02 1.7683e-03 2.8506e-02 -6.0000e+00 2.0398e-01 -1.5850e-02 1.4212e-03 1.4357e-02 -6.0000e+00 1.2123e-01 -1.4469e-04 7.4686e-04 4.3992e-03 -6.0000e+00 5.1335e-02 9.9424e-04 -6.1043e-04 2.9688e-05 5.1609e-05 -6.0000e+00 3.7279e-03 -2.0338e-03 -5.1325e-05 11 8 0 10 0 0 99.73 21.49 0.11 -0.00203 -0.00662 109 26 1 5 0 443.130 26.00 19.98 21.49 11.48 37.4 971.21 -34715 -31196 -26226 -41233 -105587 -30926 -31383 -28094 -26081 -20196 -25599 -19822 -14077 -9634 -6393 -5463 -3762 -2991 -2628 -2481 -1518 420 716 -1535 -2572 -1724 -2358 -5156 -4106 -6166 1314 -1472 2750 -57 -3795 -3569 -2514 -1414 107 -70 -113 -586 1227 -1450 608 533 860 563 202 -957 2146 639 1776 1578 781 721 1331 404 189 206 595 1454 1891 3212 1426 -722 -78 -1268 520 1868 429 705 -95 103 -256 -1047 -752 -1864 -814 -158 -1483 -845 -1780 -2075 -558 -547 366 247 1066 806 309 446 -868 -55 633 321 -275 1124 585 -232 -650 -1649 -2021 138 295 -1406 -410 -727 -213 395 838 306 193 119 -38 -254 435 -162 658 376 -168 -372 837 307 1073 557 -1226 307 955 327 524 -625 -725 -385 429 -202 -480 472 336 -270 159 -736 -567 -543 -454 -777 -3592 -571 -586 -577 -587 -460 -651 -561 -466 -375 -291 -282 -209 -181 -168 -167 -102 28 52 -112 -202 -140 -193 -419 -334 -564 130 -169 341 -7 -490 -489 -388 -258 22 -16 -29 -158 338 -415 173 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