File name: Pandora75s1_EssexMD_20250102_L2Fit_fout2c1d20221230p1-8.txt File generation date: 20250103T051657.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 75 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora75_OF_v3d20220127.txt Instrument calibration file used: Pandora75s1_CF_v104d20221230.txt Level 1 file used: Pandora75s1_EssexMD_20250102_L1_smca1c1d20221230p1-8.txt Full location name: MDE Essex Monitoring Site Short location name: EssexMD Country of location: United States Location latitude [deg]: 39.3109 Location longitude [deg]: -76.4745 Location altitude [m]: 12 Local noon date: 20250102 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: OoB-data based on session 103 First and last pixel inside fitting window: 196 337 Nominal wavelengths inside fitting window [nm]: 305.0663 305.2078 305.3493 305.4908 305.6322 305.7737 305.9151 306.0566 306.1980 306.3394 306.4807 306.6221 306.7635 306.9048 307.0461 307.1874 307.3287 307.4700 307.6112 307.7524 307.8937 308.0349 308.1761 308.3172 308.4584 308.5996 308.7407 308.8818 309.0229 309.1640 309.3051 309.4461 309.5872 309.7282 309.8692 310.0102 310.1512 310.2921 310.4331 310.5740 310.7149 310.8558 310.9967 311.1376 311.2784 311.4193 311.5601 311.7009 311.8417 311.9825 312.1233 312.2640 312.4048 312.5455 312.6862 312.8269 312.9676 313.1083 313.2489 313.3896 313.5302 313.6708 313.8114 313.9520 314.0925 314.2331 314.3736 314.5141 314.6547 314.7951 314.9356 315.0761 315.2165 315.3570 315.4974 315.6378 315.7782 315.9186 316.0590 316.1993 316.3397 316.4800 316.6203 316.7606 316.9009 317.0411 317.1814 317.3216 317.4619 317.6021 317.7423 317.8825 318.0227 318.1628 318.3030 318.4431 318.5832 318.7233 318.8634 319.0035 319.1436 319.2836 319.4237 319.5637 319.7037 319.8437 319.9837 320.1237 320.2636 320.4036 320.5435 320.6834 320.8233 320.9632 321.1031 321.2430 321.3828 321.5227 321.6625 321.8023 321.9421 322.0819 322.2217 322.3615 322.5012 322.6409 322.7807 322.9204 323.0601 323.1998 323.3395 323.4791 323.6188 323.7584 323.8980 324.0376 324.1772 324.3168 324.4564 324.5960 324.7355 324.8750 --------------------------------------------------------------------------------------- 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 20250102T142014.0Z 9133.597385 99 1 52.28 2 73.75 139.60 94.53 112.45 0.00 1 0.00 1 0 17 1.850e-01 1.208e-02 1.669e-01 6.759e-03 4.984686e-01 3.674503e-03 5.812077e-03 -6.000000e+00 1.105180e-01 223.56 -2.00 3.48 -2.00 320.33 0.00e+00 3.284251e-03 1.283304e-03 7.900539e-04 -6.000000e+00 4.812857e-03 277.44 -2.00 20.00 -2.00 319.80 0.00e+00 3.515 0.001 302.00 328.00 3 4.2662e+00 1.0855e-02 4.3317e-02 -6.0000e+00 2.7225e-01 1.3487e-01 1.3286e-02 2.5777e-02 -6.0000e+00 2.9494e-01 -9.0302e-02 1.1895e-02 1.4073e-02 -6.0000e+00 1.7577e-01 2.4223e-02 6.0747e-03 5.4659e-03 -6.0000e+00 7.5307e-02 1.1734e-04 -1.5474e-03 2.1827e-04 7.1165e-05 -6.0000e+00 5.6886e-03 -2.6077e-02 1.6837e-04 12 9 8 11 24 0 72.19 22.89 0.98 -0.02608 -0.03771 14 2 1 5 0 3733.800 25.79 20.00 22.89 11.04 5.7 902.69 -96856 -3589 -38613 15433 -15480 -8595 -79999 -61975 -99116 41491 -65957 -18111 -25404 -28525 -26338 -33988 6355 -26484 10814 -17455 -19700 -24772 5646 11330 -8373 -18599 6941 -10353 -30124 -19719 -5307 8296 11306 -864 -6285 2266 195 7278 495 -2570 537 -1290 5057 6476 2052 -1024 1938 2879 5946 325 -1148 5596 1661 6135 1343 431 3466 -234 497 6526 4349 671 2234 3368 -261 -2549 1437 -1605 1658 2327 -604 4095 1180 3365 -108 -3920 -5523 -230 -2425 -3637 -1877 -1865 -1370 -1778 -692 -1876 1144 316 1192 3071 -16 1686 -3711 -877 -1146 -2212 781 362 228 1369 -2075 -492 -623 535 -1475 -2950 103 287 1128 432 271 1333 250 -495 -1166 -94 -403 -314 777 298 577 593 483 542 -293 -691 444 882 1210 -731 -416 -933 62 202 -274 318 75 499 712 155 -196 -1650 -1968 -34 -551 139 -176 -88 -1725 -1225 -3147 348 -1699 -315 -563 -803 -884 -1446 202 -1269 382 -857 -1015 -1350 233 468 -446 -1148 337 -583 -2021 -1240 -324 507 752 -69 -520 171 16 654 57 -359 81 -213 821 1063 357 -204 379 565 1160 70 -272 1357 453 1714 413 138 1096 -77 158 1944 1370 238 864 1403 -116 -1129 596 -696 751 1173 -342 2307 679 1801 -55 -1881 -2508 -99 -1156 -2013 -1169 -1302 -1032 -1428 -587 -1709 1059 302 1125 2732 -14 1320 -2927 -682 -972 -2146 835 434 291 1706 -2519 -540 -644 554 -1652 -3542 126 376 1582 665 449 2250 419 -798 -1781 -136 -589 -477 1233 492 951 953 752 809 -422 -959 596 1227 1831 -1234 -751 -1782 122 419 -605 727 177 1183 1669 351 -425 -3480 SS 20250102T142539.4Z 9133.601150 102 1 51.00 2 73.08 140.70 93.59 113.24 0.00 1 0.00 1 0 17 2.039e-01 1.010e-02 1.527e-01 6.201e-03 4.802626e-01 3.362894e-03 5.660984e-03 -6.000000e+00 1.218348e-01 223.56 -2.00 3.48 -2.00 320.22 0.00e+00 1.198163e-03 1.141758e-03 1.236794e-03 -6.000000e+00 5.305112e-03 277.44 -2.00 20.00 -2.00 319.69 0.00e+00 3.384 0.001 302.00 328.00 3 4.2704e+00 9.8725e-03 4.1976e-02 -6.0000e+00 3.0013e-01 9.4444e-02 1.2017e-02 2.5576e-02 -6.0000e+00 3.2512e-01 -3.6117e-02 1.0729e-02 1.3221e-02 -6.0000e+00 1.9376e-01 -3.2605e-03 5.5097e-03 3.9924e-03 -6.0000e+00 8.3028e-02 1.3736e-04 -1.6236e-03 2.0164e-04 5.7438e-05 -6.0000e+00 6.2696e-03 -2.6269e-02 2.1238e-04 12 9 8 11 24 0 -27.24 22.90 0.43 -0.02627 -0.03847 15 2 1 5 0 3399.520 25.79 20.00 22.90 11.19 5.8 903.79 -70731 -75843 -54229 156094 -83518 -29334 -24614 -29925 -18323 -29808 -53287 -3539 23379 -28184 -23398 -2772 1363 -17230 2811 -2996 -15297 6285 -20983 -2860 -11297 14759 -20776 -5906 2184 -9757 2569 -6217 -10306 -6182 8057 -3527 -2574 1433 3092 -4467 1898 7886 2825 4507 620 1613 -6257 7716 3520 1197 -5018 5358 6553 1737 -601 -997 2930 -2867 2187 -1819 55 4913 1370 3611 1646 2273 -2522 -453 -777 2070 2339 -219 598 425 -434 -2068 -2028 -5548 -2869 -4076 -428 -2586 -320 -927 356 -165 1251 1125 1737 1676 -645 1057 -3235 -637 -792 -938 1627 1016 1036 -500 -1181 -1981 25 315 -2361 -1020 -1376 -176 31 1154 423 363 331 -28 -378 -815 -463 278 115 883 798 436 481 449 100 445 94 514 -535 -245 -792 -323 -235 521 -387 -240 341 620 92 188 -233 -792 -1105 -1452 -902 944 -1882 -371 -311 -444 -272 -541 -1289 -56 334 -821 -785 -88 46 -767 110 -130 -774 259 -1176 -143 -658 698 -1428 -341 113 -585 151 -455 -878 -537 598 -293 -229 143 364 -670 300 1261 497 877 127 330 -1392 1507 732 266 -1284 1351 1767 527 -196 -339 978 -1013 721 -619 19 1744 556 1559 745 994 -1124 -200 -371 1078 1328 -133 359 243 -231 -1014 -923 -2593 -1410 -2319 -269 -1856 -243 -755 305 -152 1184 1093 1671 1551 -570 853 -2595 -503 -679 -907 1738 1216 1316 -638 -1430 -2224 26 330 -2695 -1214 -1735 -233 44 1769 700 619 555 -46 -571 -1186 -673 417 183 1445 1310 701 750 672 144 611 127 715 -817 -407 -1421 -606 -459 1062 -843 -546 790 1454 216 424 -503 -1651 SS 20250102T143114.4Z 9133.605028 105 1 50.84 2 72.40 141.84 92.62 114.07 0.00 1 0.00 1 0 25 1.661e-01 1.221e-02 4.000e-02 3.097e-03 4.537762e-01 1.636599e-03 5.451148e-03 -6.000000e+00 9.925179e-02 223.56 -2.00 3.48 -2.00 319.25 0.00e+00 1.097511e-03 4.210854e-04 1.473307e-03 -6.000000e+00 4.321855e-03 277.44 -2.00 20.00 -2.00 318.68 0.00e+00 3.262 0.001 302.00 328.00 3 4.3209e+00 4.5159e-03 4.0080e-02 -6.0000e+00 2.4450e-01 5.8191e-02 5.2570e-03 2.4079e-02 -6.0000e+00 2.6486e-01 -5.2028e-02 4.0961e-03 1.2197e-02 -6.0000e+00 1.5785e-01 1.4799e-02 2.1607e-03 3.5602e-03 -6.0000e+00 6.7637e-02 1.5551e-04 -1.1423e-03 9.6313e-05 4.7295e-05 -6.0000e+00 5.1077e-03 -2.6566e-02 1.9022e-04 12 9 8 11 40 0 42.83 22.91 0.39 -0.02657 -0.03515 16 3 1 5 0 3176.910 25.79 20.00 22.91 11.35 5.7 904.87 -107710 -14988 -1717 -17221 -85261 -47921 45345 -22612 -51236 -39515 -43572 -33327 23867 42590 -19110 5356 -11925 -9635 24449 12377 15910 26062 -3661 8836 -14749 2872 15508 -1380 -6518 -3514 -1736 -1222 -1523 1946 6747 5460 -11563 1045 -5066 -637 -1443 2008 1870 1356 2758 2805 3251 -137 3430 3269 319 -440 7207 3299 -156 920 1989 1071 422 -1054 221 2875 1970 920 156 -1274 -2027 113 1595 3707 -762 1374 1618 -709 484 -518 -3989 -2996 -1869 -2981 -616 -2237 -1985 -113 -625 -368 611 857 277 578 -452 -932 -1334 -2136 -1899 -35 535 687 879 246 -676 -1570 -894 -523 -712 -1011 -78 274 702 1136 1176 338 265 -631 -510 292 418 396 583 170 425 1222 1698 621 394 -937 200 -632 -357 -90 -402 -1179 11 -473 -316 -212 748 940 -143 0 -81 -754 -5056 -321 -38 -437 -3965 -1476 575 -628 -2120 -1575 -1895 -1409 663 1183 -1177 299 -875 -745 1432 856 1091 1629 -318 723 -1630 279 1349 -138 -663 -355 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