File name: Pandora132s1_Berlin_20240312_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T212645.8Z Data description: Level 2 spectral fitting results file Data file version: fout2c13p1-8 Local principal investigator: Thomas Ruhtz Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 132 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora132_OF_v1d20200910.txt Instrument calibration file used: Pandora132s1_CF_v13d20210422.txt Level 1 file used: Pandora132s1_Berlin_20240312_L1_smca1c13d20210422p1-8.txt Full location name: Institute of Space Sciences FU Berlin Short location name: Berlin Country of location: Germany Location latitude [deg]: 52.4600 Location longitude [deg]: 13.3100 Location altitude [m]: 100 Local noon date: 20240312 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: Modification of session 11, but different RefDay (April 2021). First and last pixel inside fitting window: 243 385 Nominal wavelengths inside fitting window [nm]: 305.1071 305.2480 305.3889 305.5298 305.6707 305.8116 305.9524 306.0932 306.2341 306.3749 306.5157 306.6565 306.7973 306.9380 307.0788 307.2195 307.3603 307.5010 307.6417 307.7824 307.9231 308.0638 308.2044 308.3451 308.4857 308.6264 308.7670 308.9076 309.0482 309.1888 309.3293 309.4699 309.6104 309.7510 309.8915 310.0320 310.1725 310.3130 310.4534 310.5939 310.7344 310.8748 311.0152 311.1556 311.2960 311.4364 311.5768 311.7172 311.8575 311.9979 312.1382 312.2785 312.4188 312.5591 312.6994 312.8397 312.9800 313.1202 313.2604 313.4007 313.5409 313.6811 313.8213 313.9615 314.1016 314.2418 314.3819 314.5221 314.6622 314.8023 314.9424 315.0825 315.2225 315.3626 315.5026 315.6427 315.7827 315.9227 316.0627 316.2027 316.3427 316.4827 316.6226 316.7626 316.9025 317.0424 317.1823 317.3222 317.4621 317.6020 317.7418 317.8817 318.0215 318.1613 318.3012 318.4410 318.5807 318.7205 318.8603 319.0000 319.1398 319.2795 319.4192 319.5589 319.6986 319.8383 319.9780 320.1177 320.2573 320.3969 320.5366 320.6762 320.8158 320.9554 321.0949 321.2345 321.3741 321.5136 321.6531 321.7927 321.9322 322.0717 322.2111 322.3506 322.4901 322.6295 322.7689 322.9084 323.0478 323.1872 323.3266 323.4659 323.6053 323.7447 323.8840 324.0233 324.1627 324.3020 324.4413 324.5805 324.7198 324.8591 324.9983 --------------------------------------------------------------------------------------- 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: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Temperature at electronics board 1 [°C], 999=no temperature signal Column 98: Temperature at electronics board 2 [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: 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 20240312T064728.0Z 8837.282963 86 1 49.34 2 78.90 110.22 86.04 83.73 0.00 1 0.00 1 0 17 6.316e-01 1.309e-02 2.851e-01 5.406e-03 8.375233e-01 3.009770e-03 1.003926e-02 -6.000000e+00 3.591559e-01 224.94 -2.00 3.85 -2.00 321.80 0.00e+00 8.184803e-03 1.422274e-03 2.465286e-03 -6.000000e+00 1.512951e-02 268.26 -2.00 20.00 -2.00 321.39 0.00e+00 5.016 0.003 302.00 328.00 3 1.9019e+00 9.9594e-03 7.2156e-02 -6.0000e+00 8.9067e-01 3.0975e-01 1.5060e-02 5.6699e-02 -6.0000e+00 9.7134e-01 -3.8324e-01 1.7509e-02 2.8663e-02 -6.0000e+00 5.7482e-01 1.5584e-01 8.2658e-03 1.1672e-02 -6.0000e+00 2.4395e-01 2.1876e-04 -1.7478e-03 1.4747e-04 1.3207e-04 -6.0000e+00 1.7345e-02 7.4464e-02 0.0000e+00 12 9 8 11 4 0 -33.65 11.97 0.34 0.07446 0.06133 111 24 4 8 0 444.390 15.04 11.97 14.67 31.63 31.97 29.0 964.67 -90520 -304041 -138740 -270862 66630 -267385 -100441 -175438 -199401 -228873 -206886 -64763 -167493 -51065 -88886 -94420 -50682 -9097 -43995 -85146 26136 -85027 25770 -10545 -39722 -87713 -35223 -37288 -26788 -43076 -32577 -13980 -33388 7987 -12990 3612 -1141 3413 6637 973 5215 -14411 6810 -2233 11353 -4102 15759 9850 12302 24746 15459 24512 8809 20719 10459 16104 6439 10649 7346 5918 12170 8289 10715 5140 11328 10145 3285 6316 4200 2377 4430 4384 567 3037 -1168 -1987 -2192 528 -94 -293 -132 -547 -1333 -3064 -1827 112 -716 -47 1834 865 -1018 -860 -2473 -1421 -1336 -107 -482 117 -803 114 -1384 -197 282 -1583 -2463 -2009 -293 -916 -585 -308 -130 -169 -332 -88 -137 1346 -48 621 -75 -30 980 1025 675 447 983 547 1458 598 389 562 -591 240 55 69 -552 -43 280 311 -350 -225 -112 -658 900000 -477 -6848 -731 -4024 351 -3716 -529 -1295 -1997 -2961 -2726 -341 -2737 -350 -1125 -1493 -588 -77 -557 -1661 165 -1658 177 -111 -586 -2127 -501 -550 -395 -931 -807 -346 -1109 173 -336 84 -32 113 255 45 253 -904 359 -132 604 -266 889 633 843 1683 1312 2119 975 2173 1268 1893 828 1269 879 733 1559 1280 1870 946 2192 1984 652 1347 1055 675 1293 1265 159 752 -269 -473 -537 143 -28 -106 -55 -256 -673 -1667 -1039 66 -436 -28 1047 468 -527 -431 -1314 -849 -944 -88 -463 124 -884 118 -1289 -162 223 -1348 -2246 -1923 -296 -1035 -753 -448 -205 -275 -531 -135 -201 1947 -73 991 -124 -49 1501 1491 953 611 1290 699 1928 910 688 1112 -1279 548 134 181 -1398 -111 724 798 -948 -565 -260 -1462 900000 SS 20240312T065414.2Z 8837.287665 89 1 49.66 2 77.94 111.64 85.03 85.00 0.00 1 0.00 1 0 25 6.284e-01 8.481e-03 1.620e-01 3.388e-03 7.893115e-01 1.846567e-03 9.462490e-03 -6.000000e+00 3.573345e-01 224.94 -2.00 3.85 -2.00 321.55 0.00e+00 5.203506e-03 8.482055e-04 2.108085e-03 -6.000000e+00 1.505233e-02 268.26 -2.00 20.00 -2.00 321.16 0.00e+00 4.644 0.002 302.00 328.00 3 1.5334e+00 5.9775e-03 6.6318e-02 -6.0000e+00 8.8615e-01 1.7729e-01 9.0554e-03 5.0677e-02 -6.0000e+00 9.6641e-01 -2.0133e-01 1.0668e-02 2.6560e-02 -6.0000e+00 5.7190e-01 7.7827e-02 5.0698e-03 9.8496e-03 -6.0000e+00 2.4272e-01 4.8159e-04 -1.4719e-03 9.2616e-05 1.0989e-04 -6.0000e+00 1.7257e-02 7.4213e-02 0.0000e+00 11 9 0 11 4 0 -5.21 11.97 0.21 0.07421 0.06315 207 44 4 8 0 238.700 14.97 11.97 15.00 31.63 31.97 29.0 966.00 -235310 -175430 -179841 -209404 -241185 -226287 -191616 -204797 -221612 -145369 -108815 -157373 -134790 -54457 -115706 -58707 -90380 -32901 -26480 -26238 -72469 -76506 -31150 -52337 -13726 -52662 -58440 -55954 -36320 -4402 -11063 4181 -8149 1904 -10422 -8190 12098 -7029 2091 3661 -2001 -1695 3045 12770 5670 4570 -973 8871 3288 11087 6879 8585 7235 8385 6136 5097 3036 1450 5249 4560 5757 6228 6972 5032 3757 4595 -335 3506 1775 723 2245 668 -2 -917 -761 -444 -1159 550 1883 312 -1281 -2244 -1594 -1866 -609 -184 -220 496 395 787 1010 -1274 -631 429 -1145 -232 145 122 -296 -324 -195 -388 195 -1082 -1729 -697 -792 -264 266 -30 -318 30 -26 349 98 659 84 231 -233 -333 460 571 427 159 345 61 1163 381 137 99 -294 251 -381 94 -186 -112 447 -45 -288 37 -158 -298 900000 -2190 -1001 -1080 -1572 -2390 -2038 -1519 -2097 -2662 -960 -575 -1767 -1647 -396 -1949 -659 -1582 -359 -289 -295 -1293 -1466 -412 -933 -177 -1026 -1197 -1127 -660 -71 -241 94 -229 48 -289 -238 340 -295 97 191 -121 -109 193 751 369 312 -74 656 280 981 722 990 843 1035 812 704 427 201 682 670 835 1038 1327 1065 814 982 -78 872 518 237 762 229 -1 -272 -202 -109 -293 154 625 126 -606 -1193 -900 -1120 -383 -121 -150 333 256 478 573 -714 -365 277 -882 -208 149 139 -347 -359 -193 -343 168 -996 -1701 -715 -871 -319 363 -46 -487 47 -40 553 150 996 132 384 -402 -567 741 875 633 229 476 82 1601 599 248 184 -589 530 -864 228 -473 -293 1166 -117 -725 87 -343 -620 900000 SS 20240312T065929.5Z 8837.291314 91 1 50.46 2 77.19 112.75 84.23 85.98 0.00 1 0.00 1 0 25 5.280e-01 8.306e-03 1.698e-01 2.630e-03 7.494174e-01 1.426035e-03 9.043501e-03 -6.000000e+00 3.002117e-01 224.94 -2.00 3.85 -2.00 321.41 0.00e+00 3.335486e-03 6.395873e-04 1.385281e-03 -6.000000e+00 1.264565e-02 268.26 -2.00 20.00 -2.00 321.01 0.00e+00 4.394 0.002 302.00 328.00 3 1.4158e+00 4.5354e-03 6.1911e-02 -6.0000e+00 7.4450e-01 1.1119e-01 6.6906e-03 4.5782e-02 -6.0000e+00 8.1191e-01 -1.1176e-01 7.8217e-03 2.4962e-02 -6.0000e+00 4.8047e-01 3.9328e-02 3.7566e-03 8.7677e-03 -6.0000e+00 2.0392e-01 7.2271e-04 -1.3448e-03 7.3164e-05 9.5799e-05 -6.0000e+00 1.4498e-02 7.3929e-02 0.0000e+00 11 9 0 11 4 0 7.91 11.97 0.17 0.07393 0.06382 270 57 1 8 0 183.440 14.98 11.97 15.14 31.63 31.85 29.1 967.11 -197851 -114458 -192458 -69356 -239947 -123421 -212941 -107525 -167173 -194696 -166258 -147429 -27350 -86392 -16923 -73870 30999 -61295 -25851 -24196 -59190 -15471 -41767 10136 -53463 -4378 -56164 -24737 -44654 -13885 4529 -21069 -1383 -19054 -2658 -28584 9629 -8640 7537 949 -146 5869 145 14718 -3280 12429 -3658 7876 7619 6436 8700 5631 7288 1302 8711 -280 4353 1607 4165 1138 2715 4976 3016 4677 770 4730 -268 3759 1465 920 1377 108 1850 -1678 1569 -1654 491 -2404 562 -1491 -1582 -1673 -2142 -388 -1408 442 -584 878 127 446 872 -316 91 -752 29 -265 748 142 -279 -108 -463 48 193 -593 -2247 -352 -1364 -63 153 116 -47 -113 86 -230 707 615 677 105 -231 -495 332 543 -114 749 31 357 962 716 -178 132 -540 115 119 -81 -186 -389 595 -329 -106 20 -114 -8 900000 -1430 -400 -1480 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