File name: Pandora64s1_NewHavenCT_20240831_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240901T050203.6Z 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_20240831_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: 20240831 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 20240831T130716.9Z 9009.546723 216 1 10.40 2 59.34 107.25 32.30 118.48 0.00 1 0.00 1 0 17 1.596e-02 8.100e-03 4.807e-03 1.933e-03 2.681481e-01 1.047670e-03 3.237644e-03 -6.000000e+00 9.752194e-03 230.43 -2.00 3.52 -2.00 316.65 0.00e+00 1.616641e-04 1.306424e-04 1.167415e-04 -6.000000e+00 4.367129e-04 288.76 -2.00 20.00 -2.00 315.85 0.00e+00 1.953 0.000 302.00 328.00 3 3.7306e+00 2.7465e-03 2.4117e-02 -6.0000e+00 2.4326e-02 2.1664e-02 3.0615e-03 1.4004e-02 -6.0000e+00 2.6218e-02 1.4149e-03 1.7836e-03 6.8139e-03 -6.0000e+00 1.5641e-02 -4.8503e-03 8.4201e-04 1.8773e-03 -6.0000e+00 6.6553e-03 1.2886e-03 -5.7661e-05 5.9919e-05 2.3898e-05 -6.0000e+00 4.7518e-04 -4.0481e-03 6.1977e-05 12 9 1 12 1 1 99.77 21.85 0.21 -0.00405 -0.00448 14 17 1 5 0 693.140 26.21 20.00 21.85 30.52 40.4 1046.19 -407 24 -253 -2467 -12993 1003 -1373 2439 50 871 -4764 660 -1507 2218 -28 1667 -1479 390 -615 1249 -358 566 533 1797 -429 1602 390 -1202 -1735 -2 602 697 2154 344 -5186 -2290 -1548 -307 174 137 -936 -977 -337 -1035 -621 -7 -456 277 -503 -450 1414 1170 1357 1214 383 727 1161 813 142 331 776 924 1487 2243 992 -1429 71 -1675 688 1491 427 94 -47 304 220 -963 -283 -2198 -472 -453 -1222 -953 -1930 -1953 -784 -910 190 -4 1155 188 303 75 -541 24 1122 182 -121 1050 661 -493 35 -1429 -1717 -130 412 -1446 -125 -614 -381 414 935 361 -41 114 -8 -178 595 -88 483 463 -171 -130 490 171 872 1073 -743 766 912 706 399 -391 -796 -282 340 -26 -415 287 -118 -462 -56 -691 -59 4 -38 -349 -1880 128 -194 369 9 151 -867 123 -326 525 -7 445 -421 115 -188 391 -114 179 176 620 -158 592 142 -416 -579 -1 215 264 807 130 -2098 -877 -660 -152 95 79 -583 -632 -223 -687 -411 -5 -293 174 -315 -289 953 839 962 906 294 569 915 637 110 260 636 770 1316 2055 885 -1208 57 -1373 607 1375 422 96 -47 288 202 -810 -234 -1823 -396 -425 -1211 -980 -2109 -2149 -920 -1080 232 -5 1404 228 339 82 -554 25 1235 212 -148 1326 856 -650 44 -1743 -2059 -156 528 -1874 -169 -833 -546 598 1392 534 -61 156 -11 -239 774 -120 676 675 -252 -188 686 238 1152 1415 -963 1018 1238 1014 576 -580 -1173 -433 530 -41 -688 482 -197 -749 -88 -1099 SS 20240831T131141.1Z 9009.549782 219 1 48.45 2 58.55 108.13 31.60 119.83 0.00 1 0.00 1 0 25 1.216e-02 8.080e-03 2.907e-03 1.186e-03 2.605808e-01 6.415665e-04 3.148105e-03 -6.000000e+00 7.428173e-03 230.43 -2.00 3.52 -2.00 316.62 0.00e+00 2.700360e-04 7.968786e-05 1.091721e-04 -6.000000e+00 3.326629e-04 288.76 -2.00 20.00 -2.00 315.82 0.00e+00 1.909 0.000 302.00 328.00 3 4.3782e+00 1.6780e-03 2.3529e-02 -6.0000e+00 1.8529e-02 2.7551e-02 1.8707e-03 1.3607e-02 -6.0000e+00 1.9971e-02 3.4546e-03 1.0900e-03 6.6212e-03 -6.0000e+00 1.1914e-02 -5.7310e-03 5.1493e-04 1.8289e-03 -6.0000e+00 5.0688e-03 7.1008e-04 -1.2684e-04 3.6684e-05 2.3235e-05 -6.0000e+00 3.6201e-04 -3.8541e-03 3.1446e-05 11 9 0 11 8 0 99.96 21.83 0.18 -0.00385 -0.00481 38 9 1 5 0 1274.770 26.21 20.00 21.83 30.87 40.4 1048.13 1303 -2208 688 -3979 -2235 -3274 -1404 -283 1384 -103 -3846 -2541 62 -986 1473 -23 -239 633 164 1159 1741 -142 2013 1095 561 1435 179 -1337 -964 -1994 1036 -293 2266 -351 -4899 -2397 -2045 -1347 63 50 -767 -877 204 -1416 -243 37 -432 64 -728 -806 1559 674 1216 1203 444 758 1359 750 377 539 558 1581 1452 2305 825 -1479 -298 -1153 526 1489 244 448 -267 387 -80 -794 -582 -1975 -915 -289 -1312 -721 -2091 -1841 -566 -395 43 160 922 568 195 518 -1022 -12 961 368 -257 1093 805 -433 -507 -1498 -1772 82 321 -1498 -205 -457 -246 336 904 403 196 83 -138 -272 507 -250 455 240 -107 -177 699 55 1062 623 -777 709 1001 403 780 -627 -475 -363 546 -204 -458 299 247 -551 -38 -879 190 -349 106 -584 -297 -444 -202 -45 235 -18 -704 -495 13 -243 371 -6 -68 187 50 366 549 -46 661 382 205 532 66 -464 -319 -679 367 -112 908 -142 -1960 -982 -874 -670 34 31 -477 -567 134 -944 -160 24 -277 40 -455 -516 1043 482 909 892 338 589 1061 582 290 419 455 1301 1278 2095 731 -1239 -251 -980 459 1431 239 448 -264 363 -73 -694 -473 -1603 -799 -266 -1282 -766 -2255 -2094 -654 -482 52 197 1111 677 226 551 -1083 -12 1039 420 -324 1417 1068 -559 -644 -1791 -2084 101 404 -1994 -272 -635 -346 498 1376 607 281 115 -187 -355 673 -336 649 344 -154 -250 994 75 1428 804 -981 918 1379 564 1138 -908 -707 -566 860 -334 -741 489 401 -905 -60 -1366 SS 20240831T131627.6Z 9009.553097 222 1 1.70 2 57.70 109.10 30.85 121.36 0.00 1 0.00 1 0 17 1.380e-02 8.606e-03 6.813e-03 3.196e-03 2.544048e-01 1.735083e-03 3.079415e-03 -6.000000e+00 8.431751e-03 230.43 -2.00 3.52 -2.00 316.30 0.00e+00 3.514672e-04 1.989131e-04 6.084835e-05 -6.000000e+00 3.775973e-04 288.76 -2.00 20.00 -2.00 315.52 0.00e+00 1.865 0.000 302.00 328.00 3 2.9279e+00 4.5198e-03 2.2978e-02 -6.0000e+00 2.1032e-02 1.6029e-02 5.0184e-03 1.3286e-02 -6.0000e+00 2.2669e-02 8.8816e-04 2.9022e-03 6.4646e-03 -6.0000e+00 1.3523e-02 -3.5165e-03 1.3472e-03 1.7928e-03 -6.0000e+00 5.7539e-03 3.2140e-03 -2.0097e-04 9.8881e-05 2.3572e-05 -6.0000e+00 4.1090e-04 -4.2843e-03 2.7148e-05 12 9 1 12 1 1 94.83 21.83 0.42 -0.00428 -0.00579 4 34 1 5 0 338.470 26.21 20.00 21.83 31.26 40.4 1049.99 -1244 -258 -363 -3024 -7025 -857 -2341 -2034 429 -2056 -2930 -2492 1035 -1579 2661 -1516 1472 965 1786 1022 1828 -1982 3184 74 1814 136 1785 -340 1034 -1247 2765 -954 2639 -1513 -2408 -4523 -642 -2114 218 -565 446 -1512 -255 -1017 -344 557 727 -309 -437 -729 1269 836 1356 610 -219 274 846 989 571 717 893 1300 601 1833 296 -1377 -599 -1170 777 1900 199 624 -805 516 66 -630 -1377 -1481 185 -296 -1211 -614 -2138 -2040 -658 -204 -49 489 577 777 64 1014 -1464 439 700 708 -229 1095 745 -763 -271 -960 -2044 380 -115 -1175 -677 -698 -518 334 852 595 106 364 -169 -483 360 64 511 853 -186 -465 563 -143 1394 1005 -726 1010 995 299 342 -764 -325 -393 529 -356 -337 70 415 -567 51 -908 -224 -48 -68 -529 -1177 -136 -407 -393 88 -445 -634 -578 263 -430 781 -498 484 335 633 352 628 -705 1123 28 709 56 698 -127 364 -456 1041 -394 1136 -670 -1013 -2036 -291 -1139 127 -354 294 -1057 -181 -725 -244 389 493 -208 -291 -499 910 602 1021 486 -170 216 671 774 468 563 733 1144 540 1695 267 -1226 -510 -1001 681 1834 197 632 -809 489 60 -555 -1137 -1204 161 -274 -1193 -628 -2335 -2250 -771 -241 -61 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