File name: Pandora55s1_QueensNY_20211115_L2Fit_fout2c19d20211111p1-8.txt File generation date: 20250606T105022.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c19p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora55_OF_v4d20190723.txt Instrument calibration file used: Pandora55s1_CF_v19d20211111.txt Level 1 file used: Pandora55s1_QueensNY_20211115_L1_smca1c19d20211111p1-8.txt Full location name: Queens College NYSDEC (USEPA AQS ID 36-081-0124) Short location name: QueensNY Country of location: USA Location latitude [deg]: 40.7361 Location longitude [deg]: -73.8215 Location altitude [m]: 25 Local noon date: 20211115 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: 261 404 Nominal wavelengths inside fitting window [nm]: 305.0379 305.1778 305.3178 305.4578 305.5977 305.7376 305.8776 306.0175 306.1574 306.2973 306.4372 306.5770 306.7169 306.8567 306.9966 307.1364 307.2762 307.4160 307.5558 307.6956 307.8354 307.9752 308.1149 308.2547 308.3944 308.5341 308.6738 308.8135 308.9532 309.0929 309.2326 309.3723 309.5119 309.6515 309.7912 309.9308 310.0704 310.2100 310.3496 310.4892 310.6287 310.7683 310.9079 311.0474 311.1869 311.3264 311.4659 311.6054 311.7449 311.8844 312.0239 312.1633 312.3028 312.4422 312.5816 312.7210 312.8604 312.9998 313.1392 313.2786 313.4179 313.5573 313.6966 313.8360 313.9753 314.1146 314.2539 314.3932 314.5324 314.6717 314.8110 314.9502 315.0895 315.2287 315.3679 315.5071 315.6463 315.7855 315.9246 316.0638 316.2030 316.3421 316.4812 316.6204 316.7595 316.8986 317.0377 317.1767 317.3158 317.4549 317.5939 317.7329 317.8720 318.0110 318.1500 318.2890 318.4280 318.5669 318.7059 318.8449 318.9838 319.1227 319.2617 319.4006 319.5395 319.6784 319.8172 319.9561 320.0950 320.2338 320.3726 320.5115 320.6503 320.7891 320.9279 321.0667 321.2054 321.3442 321.4830 321.6217 321.7604 321.8991 322.0379 322.1766 322.3152 322.4539 322.5926 322.7312 322.8699 323.0085 323.1471 323.2857 323.4243 323.5629 323.7015 323.8401 323.9786 324.1172 324.2557 324.3943 324.5328 324.6713 324.8098 324.9483 --------------------------------------------------------------------------------------- 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 100-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-387: 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 20211115T145133.9Z 7989.619142 247 1 17.20 2 64.50 151.43 137.61 16.83 0.00 1 0.00 1 0 25 1.625e-02 6.763e-03 4.777e-03 1.055e-03 3.667135e-01 5.391867e-04 4.442897e-03 -6.000000e+00 9.460602e-03 223.27 -2.00 3.51 -2.00 317.75 0.00e+00 9.086171e-07 9.014457e-05 1.511845e-04 -6.000000e+00 4.225230e-04 280.53 -2.00 20.00 -2.00 317.06 0.00e+00 2.308 0.000 302.00 328.00 3 2.0600e+00 1.4247e-03 2.9557e-02 -6.0000e+00 2.3259e-02 1.7395e-02 1.6115e-03 1.8553e-02 -6.0000e+00 2.5304e-02 -4.3619e-03 1.0125e-03 9.2514e-03 -6.0000e+00 1.5120e-02 -2.6528e-03 5.1476e-04 2.6348e-03 -6.0000e+00 6.3878e-03 4.2088e-03 -4.8379e-04 3.1973e-05 3.3601e-05 -6.0000e+00 4.8447e-04 -5.4323e-03 1.2084e-04 12 9 1 12 1 1 99.96 22.70 0.21 -0.00543 -0.00907 80 44 1 5 0 210.120 25.58 19.99 22.70 12.77 29.8 977.40 -4329 -6336 -1224 -10989 -3967 -5053 -2082 -339 -1413 -3310 -4606 -1385 -2813 -183 1280 1061 -2461 510 609 305 -82 740 974 447 691 -180 533 -1087 275 584 1856 1269 1992 -1397 -520 721 -62 580 -70 -715 -1735 -1079 -1521 -927 -819 -313 -1302 -519 -361 719 830 247 1210 628 1053 640 1124 420 824 874 1452 1582 1370 403 -576 31 50 734 1504 905 14 -404 -629 -821 -762 -100 576 1154 1249 413 7 -927 -1676 -1291 -1202 -1133 -931 -522 -376 -610 -325 381 527 1472 1679 1287 769 940 -363 -569 -577 -563 158 692 -151 -1010 -402 -852 -66 57 -90 -334 -229 -23 92 689 900 827 390 -339 -730 -677 -304 -192 302 260 548 1417 1049 359 553 -27 427 446 211 -303 -211 122 -527 -586 -336 -206 -174 189 -276 -468 -90 -874 -273 -333 -137 -25 -116 -300 -437 -133 -307 -23 172 162 -425 91 114 60 -17 151 201 98 151 -42 126 -253 60 125 410 312 538 -415 -152 203 -18 181 -26 -302 -796 -533 -788 -489 -434 -166 -695 -272 -188 375 451 138 723 383 672 425 763 290 561 585 972 1108 997 308 -468 25 37 551 1143 726 12 -362 -581 -747 -685 -85 464 859 924 334 6 -854 -1645 -1352 -1282 -1241 -1083 -612 -449 -723 -380 427 564 1470 1681 1392 866 1140 -473 -756 -756 -713 196 816 -184 -1282 -520 -1159 -90 81 -133 -509 -356 -36 134 990 1228 1126 556 -499 -1100 -1033 -454 -287 431 367 760 1876 1413 504 814 -41 672 703 348 -515 -366 218 -933 -1039 -597 -350 -291 318 SS 20211115T145638.5Z 7989.622668 250 1 4.06 2 64.05 152.67 137.31 18.58 0.00 1 0.00 1 0 25 2.698e-02 8.180e-03 1.915e-02 4.441e-03 3.641079e-01 2.274182e-03 4.418721e-03 -6.000000e+00 1.569738e-02 223.27 -2.00 3.51 -2.00 317.68 0.00e+00 -2.761479e-04 3.718910e-04 1.543939e-04 -6.000000e+00 7.014712e-04 280.53 -2.00 20.00 -2.00 316.99 0.00e+00 2.271 0.000 302.00 328.00 3 3.2291e+00 5.9932e-03 2.9190e-02 -6.0000e+00 3.8592e-02 2.5254e-02 6.7797e-03 1.8410e-02 -6.0000e+00 4.1997e-02 -7.5244e-03 4.2348e-03 9.2006e-03 -6.0000e+00 2.5094e-02 -2.8789e-03 2.1408e-03 2.6266e-03 -6.0000e+00 1.0593e-02 1.3569e-03 -1.2418e-03 1.3460e-04 3.3465e-05 -6.0000e+00 8.0466e-04 -3.2101e-03 -1.7897e-05 12 9 1 12 1 1 -43.31 22.69 0.24 -0.00321 -0.01254 3 10 1 5 0 972.170 25.58 20.00 22.69 12.93 29.9 978.48 -2923 -4523 3770 -9594 -1311 7449 -19575 2729 -5003 2695 -9283 1838 -3932 -1308 4949 164 -2374 -2084 5836 -2109 1944 -635 6237 -2172 -1684 -589 2923 268 -3748 -3010 956 2670 926 610 -1066 2116 -2506 -312 496 -950 -1438 -762 -2211 -1788 435 -212 -1219 -444 -1079 2524 -901 472 15 2275 697 1956 1675 1408 789 729 1596 2636 1819 -413 -778 -1202 780 182 1962 973 591 -1091 -522 -1171 -1343 -693 352 2275 515 -288 -654 -326 -979 -932 -1677 -826 -590 -8 86 -574 -610 276 57 1167 1423 943 802 -48 -582 -629 -164 -298 254 733 -402 -521 -676 -205 73 716 -150 -1010 -333 113 -245 736 482 1026 648 -362 -1093 -708 122 -564 318 453 854 2126 694 -246 575 -143 472 534 279 -45 146 99 -532 -663 -573 -35 -242 -54 -198 -349 283 -796 -94 473 -1644 207 -454 244 -969 181 -451 -168 695 27 -426 -393 1077 -432 394 -133 1253 -491 -403 -146 713 65 -909 -715 228 680 261 180 -319 604 -765 -104 188 -414 -689 -385 -1164 -955 229 -113 -651 -234 -570 1314 -496 270 9 1419 456 1299 1140 965 540 493 1078 1825 1339 -325 -635 -977 603 138 1489 791 515 -1005 -488 -1089 -1209 -591 281 1710 391 -231 -570 -305 -976 -967 -1811 -922 -682 -9 103 -688 -713 308 61 1190 1455 1012 918 -59 -758 -844 -217 -381 308 867 -487 -656 -880 -273 100 1017 -222 -1555 -516 172 -361 1040 663 1407 910 -529 -1650 -1076 183 -835 458 637 1167 2822 937 -348 846 -218 733 843 452 -76 250 172 -941 -1175 -1004 -59 -404 -90 SS 20211115T150055.5Z 7989.625642 253 1 49.37 2 63.68 153.72 137.04 20.04 0.00 1 0.00 1 0 25 1.790e-02 6.798e-03 4.938e-03 1.008e-03 3.580296e-01 5.148315e-04 4.322481e-03 -6.000000e+00 1.042342e-02 223.27 -2.00 3.51 -2.00 317.92 0.00e+00 2.869934e-05 9.025144e-05 1.479453e-04 -6.000000e+00 4.654341e-04 280.53 -2.00 20.00 -2.00 317.23 0.00e+00 2.242 0.000 302.00 328.00 3 3.0312e+00 1.3641e-03 2.8770e-02 -6.0000e+00 2.5626e-02 1.7024e-02 1.5472e-03 1.8111e-02 -6.0000e+00 2.7878e-02 2.0085e-03 9.8768e-04 9.0416e-03 -6.0000e+00 1.6658e-02 -6.4384e-03 5.0491e-04 2.5858e-03 -6.0000e+00 7.0386e-03 1.7154e-03 -2.4875e-04 3.0743e-05 3.2508e-05 -6.0000e+00 5.3362e-04 -5.6038e-03 1.6528e-04 11 8 0 10 0 0 99.99 22.69 0.29 -0.00560 -0.00747 136 26 1 5 0 362.950 25.58 20.00 22.69 13.25 30.0 980.93 -2631 -2367 3585 -12186 -3183 -125 -3935 5311 639 -3691 -7180 -980 -2895 -767 2141 -1929 -4846 -1616 2855 21 485 865 1731 -304 77 -168 1762 -526 -2 -370 762 2190 1190 -2464 -839 1639 232 -311 819 -1188 -1671 -1099 -1455 -1717 -517 -58 -1364 -442 -272 985 604 552 349 1183 1148 614 1175 556 663 726 1467 1622 1305 31 -277 -436 702 629 1654 1072 -89 -255 -486 -986 -352 -30 380 1660 1500 529 -76 -411 -1361 -1168 -1367 -1263 -936 -772 -545 -723 -92 361 490 1619 1585 1300 607 847 -429 -658 -623 -635 60 838 -89 -844 -540 -624 -158 137 -88 -473 -60 -178 124 604 851 915 523 -242 -756 -684 -243 -167 109 288 541 1377 1070 292 473 111 348 343 261 -362 -33 73 -357 -595 -276 -252 -142 48 -156 -157 236 -909 -205 -7 -251 343 48 -310 -643 -87 -287 -86 270 -283 -785 -269 479 4 88 160 322 -60 16 -37 388 -116 0 -77 162 501 300 -675 -227 423 62 -94 283 -478 -745 -520 -715 -860 -258 -29 -685 -219 -134 487 309 299 201 707 714 394 766 367 435 471 949 1085 929 23 -219 -343 527 459 1215 843 -76 -229 -446 -899 -309 -25 294 1208 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