File name: Pandora132s1_Berlin_20220903_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T181250.8Z 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_20220903_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: 20220903 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 20220903T051037.2Z 8281.215708 57 1 49.61 2 83.36 86.25 149.18 21.44 0.00 1 0.00 1 0 17 6.159e-01 3.534e-02 4.808e-01 2.986e-02 8.466001e-01 1.737390e-02 9.854687e-03 -6.000000e+00 3.616239e-01 230.22 -2.00 3.85 -2.00 322.29 0.00e+00 1.650260e-03 9.780546e-03 7.897128e-03 -6.000000e+00 1.707206e-02 280.91 -2.00 20.00 -2.00 321.79 0.00e+00 7.857 0.011 302.00 328.00 3 1.4293e+00 6.8087e-02 1.0568e-01 -6.0000e+00 9.0290e-01 1.0475e+00 8.6327e-02 8.5997e-02 -6.0000e+00 9.8331e-01 -1.5041e+00 6.4377e-02 3.1797e-02 -6.0000e+00 5.8480e-01 6.0456e-01 3.0490e-02 9.3004e-03 -6.0000e+00 2.4562e-01 2.5402e-05 -3.5378e-04 8.7757e-04 1.1069e-04 -6.0000e+00 1.7168e-02 -9.9672e-04 0.0000e+00 12 8 8 10 0 0 54.51 16.64 0.70 -0.00100 -0.00366 51 11 4 8 0 972.700 15.01 16.64 19.72 20.96 21.27 26.2 971.78 211975 -98477 900000 -26755 900000 -96717 -25775 -34336 106240 -89965 -143647 900000 -71686 225419 -98665 900000 900000 12006 11832 8821 900000 -44226 900000 -59719 112704 -14745 173087 54686 11448 900000 1151 203566 -17684 2921 602 20118 46696 -20566 240378 51283 900000 123843 54664 -19999 23001 257380 63441 900000 13050 900000 53256 91682 29979 76592 46700 49062 29279 37607 88317 24704 100635 20976 48600 10444 15514 21863 5121 42916 -8674 50112 24045 13984 2911 4180 11882 -16927 -1 -19273 28924 -6322 10877 13800 -11294 6335 5116 16471 -3880 1606 895 -354 -4119 4048 4843 -5969 4473 -6071 -46 -8285 -2083 -1248 -991 -4429 -2018 3319 -1519 35 -5117 -188 -4288 -3743 597 -1258 -148 -4149 2981 -2727 922 -4531 1320 10 2718 1031 2139 2358 2065 3371 340 3506 2055 -472 1417 -216 2237 -1228 2647 -454 -354 901 -1129 -950 1002 269 -3654 6159 -5484 900000 -777 900000 -3576 -749 -998 3087 -3327 -9106 900000 -3030 6549 -7818 900000 900000 381 375 280 900000 -2103 900000 -3470 3275 -545 5029 1589 333 900000 40 5914 -934 123 26 701 1357 -1374 6984 2235 900000 3598 2541 -1918 1403 7478 2581 900000 948 900000 3095 3996 2613 4451 3799 3991 2892 3278 4362 2225 4386 2255 4519 1578 2299 2986 833 5112 -1966 7134 4750 3088 685 886 2071 -3541 0 -4312 4706 -1763 3002 4210 -4823 2411 2096 6365 -1916 760 419 -159 -1807 1564 1871 -2827 2235 -4004 -30 -6827 -1733 -1015 -738 -3041 -1395 2247 -1161 28 -4189 -161 -4361 -4360 746 -1701 -201 -5698 3677 -3515 1183 -6511 1890 15 3776 1389 2757 2959 2525 4339 454 4557 3165 -855 2784 -464 5028 -3081 6838 -1260 -1000 2526 -3168 -2515 2406 608 -8531 SS 20220903T051638.0Z 8281.219884 60 1 49.37 2 82.44 87.43 148.86 23.92 0.00 1 0.00 1 0 17 5.126e-01 2.431e-02 3.653e-01 1.552e-02 8.077627e-01 8.870593e-03 9.422648e-03 -6.000000e+00 2.973600e-01 230.22 -2.00 3.85 -2.00 322.16 0.00e+00 -8.838886e-04 5.116452e-03 1.176019e-03 -6.000000e+00 1.463041e-02 280.91 -2.00 20.00 -2.00 321.66 0.00e+00 7.052 0.008 302.00 328.00 3 1.3400e+00 3.4553e-02 8.5052e-02 -6.0000e+00 7.4346e-01 7.0553e-01 4.5397e-02 4.9273e-02 -6.0000e+00 8.0994e-01 -1.0940e+00 3.9401e-02 2.4688e-02 -6.0000e+00 4.7937e-01 4.5896e-01 1.8294e-02 7.1306e-03 -6.0000e+00 1.9973e-01 6.4259e-05 -9.3342e-04 4.5113e-04 9.9017e-05 -6.0000e+00 1.4197e-02 -7.4143e-04 0.0000e+00 12 8 8 10 0 0 95.62 16.64 0.56 -0.00074 -0.00776 85 18 4 8 0 580.750 15.01 16.64 20.03 20.96 21.27 26.1 972.75 2422 -130153 184727 -122256 900000 -164420 -149868 -61721 -138817 900000 -164160 900000 -97030 900000 -38775 67754 200273 -34252 900000 -41136 93833 -94091 -10295 9537 900000 15221 3982 79173 -58212 100941 -39026 74120 -12250 30262 53829 -5378 69959 -2257 106554 -7635 60102 31682 61638 46469 66558 79232 4425 49340 4735 65958 29950 36428 31874 6345 42149 32827 72031 12696 75462 -6471 36980 22314 22001 24900 9074 34395 2098 32903 1548 22172 8627 8152 11488 7616 14102 -1619 10794 -2919 812 -9885 3502 -2803 -3315 6496 -2467 3941 -4468 2571 -1957 -855 -2766 -3233 2462 -5057 1208 -5076 -127 -3133 -1885 -622 -2251 -1099 -2310 -1121 -7212 -105 -2595 -1057 -1945 842 397 -1070 740 -3042 -315 -1494 702 -592 410 1197 453 2016 532 3893 1525 2040 1307 1689 653 705 628 -233 1082 -999 1055 -289 465 183 -373 45 -208 -501 -2208 37 -4294 2794 -3193 900000 -5425 -4533 -933 -4389 900000 -6996 900000 -2935 900000 -960 1025 3029 -1036 900000 -1357 1419 -4916 -241 216 900000 345 96 1197 -2377 1526 -1712 1233 -537 870 1140 -203 1375 -109 2095 -543 2363 1725 2517 2178 2516 2636 315 2313 365 2992 2174 2754 2748 758 3697 3276 4902 1517 4565 -861 3300 2565 2895 3540 1564 4525 384 4727 346 4594 2205 2133 2797 1774 2751 -333 1894 -627 196 -3199 1165 -1132 -1469 2780 -1119 1777 -2291 1248 -977 -402 -1368 -1530 1102 -2661 631 -3336 -93 -2696 -1721 -553 -1872 -807 -1610 -797 -5860 -85 -2280 -999 -2099 1012 535 -1547 1060 -4396 -426 -2004 948 -856 619 1827 678 2833 734 5047 1962 2524 1626 2295 1039 1279 1255 -503 2463 -2495 2761 -797 1298 515 -1036 119 -505 -1143 -5082 SS 20220903T061520.8Z 8281.260657 87 1 32.14 2 73.54 99.22 144.13 45.72 0.00 1 0.00 1 0 17 1.010e-01 6.120e-03 5.988e-02 3.210e-03 4.357649e-01 1.649118e-03 5.417966e-03 -6.000000e+00 5.813072e-02 230.21 -2.00 3.85 -2.00 320.21 0.00e+00 1.233545e-03 5.570643e-04 4.374664e-04 -6.000000e+00 2.536019e-03 280.91 -2.00 20.00 -2.00 319.55 0.00e+00 3.472 0.001 302.00 328.00 3 2.6671e+00 4.8964e-03 4.2499e-02 -6.0000e+00 1.4530e-01 -2.4992e-02 5.9350e-03 2.5152e-02 -6.0000e+00 1.5792e-01 3.5031e-02 4.9964e-03 1.2449e-02 -6.0000e+00 9.3762e-02 -1.9349e-02 2.5440e-03 3.7269e-03 -6.0000e+00 3.9105e-02 7.3519e-04 6.6967e-06 9.7324e-05 4.1483e-05 -6.0000e+00 2.7657e-03 -1.4444e-03 0.0000e+00 12 1 1 12 1 1 100.00 16.70 0.17 -0.00144 -0.00139 180 60 4 8 0 174.950 15.02 16.70 20.49 21.06 21.27 26.0 974.96 -59040 -16521 -50185 570 -50351 -9156 -33797 -22699 -4765 -25255 -3391 -38516 -3268 -15874 5153 -9470 1521 -4057 -11725 -4509 -11357 2578 -4010 677 -2212 -6759 -271 -7750 -302 -6610 7734 -4207 8327 -4896 2056 -837 -1418 1369 -3226 2192 -1748 2632 -179 228 3206 1003 1417 -1383 1291 -695 1624 249 2830 2309 1029 1450 -1634 299 -819 1681 537 1867 2084 1303 1026 -613 878 -1153 2204 -689 826 57 922 1177 -473 -910 -1165 -268 -1569 -170 -1317 -1806 -2223 -1630 -449 -867 854 -208 1246 353 828 799 -436 660 -314 128 -316 1099 -83 47 -513 -903 60 -413 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