File name: Pandora132s1_Berlin_20220402_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T165647.2Z 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_20220402_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: 20220402 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 20220402T054156.1Z 8127.237455 74 1 50.01 2 81.30 93.24 87.72 82.65 0.00 1 0.00 1 0 17 6.731e-01 3.388e-02 4.826e-01 2.573e-02 9.380699e-01 1.512610e-02 1.080825e-02 -6.000000e+00 3.908877e-01 226.53 -2.00 3.85 -2.00 322.18 0.00e+00 6.350977e-03 7.490186e-03 1.979047e-03 -6.000000e+00 1.774715e-02 270.64 -2.00 20.00 -2.00 321.77 0.00e+00 6.247 0.005 302.00 328.00 3 2.8831e+00 5.2685e-02 8.4836e-02 -6.0000e+00 9.7260e-01 1.0519e+00 6.9759e-02 6.2771e-02 -6.0000e+00 1.0643e+00 -1.4168e+00 6.4340e-02 3.0081e-02 -6.0000e+00 6.2915e-01 5.8542e-01 3.1163e-02 1.3299e-02 -6.0000e+00 2.6222e-01 2.1148e-05 -2.5488e-04 7.0663e-04 1.6884e-04 -6.0000e+00 1.8667e-02 -3.2282e-02 0.0000e+00 12 8 8 10 0 0 -23.90 15.53 0.43 -0.03228 -0.03420 22 5 4 8 0 2272.310 14.99 15.53 7.58 20.14 20.56 24.0 989.25 165829 900000 -91549 -19399 -121677 900000 -101012 62877 -188134 -75321 -106472 -137084 900000 -11563 900000 -6969 900000 -1003 900000 68208 900000 14634 -66917 900000 -46588 900000 -64258 223738 900000 -100161 115333 -52631 90983 10159 210149 -39233 -14706 86191 62320 324184 137838 47619 98556 129582 58907 36868 74518 53787 59659 16670 63127 31657 276751 32192 21152 33064 52614 51800 -10057 26003 -2853 59886 19824 28749 33034 18819 30072 981 77036 -5074 30643 19502 19574 7923 -8814 -8001 -23826 -5578 -7132 5705 -4251 7655 174 -4200 9089 2969 5938 1889 9306 -275 5016 -5085 -4487 -5367 -9851 -399 -3754 2110 -4961 -607 -3579 -4144 -1257 364 1253 -6722 5269 -7387 -1168 -476 185 552 -3164 505 -3447 2937 -1117 -80 46 -266 1164 1298 3638 2013 4871 146 4440 2207 1746 -12 -3021 1675 -677 456 -666 1362 1750 1025 -599 -1048 101 -1742 -2349 4153 900000 -2918 -486 -3878 900000 -2530 1575 -10708 -1886 -2667 -5306 900000 -290 900000 -175 900000 -27 900000 1708 900000 366 -3047 900000 -1803 900000 -2780 5603 900000 -6385 2888 -3116 2279 370 5263 -2054 -636 2159 1873 8119 3452 2147 2715 3245 2360 1847 2613 2425 2689 1252 3320 2537 6931 2983 2071 3229 4217 4022 -1236 2344 -318 4349 2482 3744 4385 2614 4142 174 7910 -1225 5581 4041 3877 1605 -1866 -1494 -4991 -1041 -1591 1364 -1336 2458 66 -1769 3539 1291 2609 877 3941 -122 1976 -2107 -1849 -2432 -5472 -242 -2787 1710 -4721 -555 -3113 -3189 -850 242 879 -5403 3995 -6946 -1176 -553 243 780 -4748 718 -4921 3845 -1551 -116 70 -409 1701 1785 4672 2553 5822 177 5105 2829 2636 -21 -6225 3561 -1579 1131 -1783 3718 4822 2847 -1657 -2748 241 -3867 -5081 SS 20220402T055717.3Z 8127.248117 80 1 35.14 2 78.97 96.32 85.41 85.55 0.00 1 0.00 1 0 17 5.733e-01 1.978e-02 4.101e-01 1.574e-02 7.947532e-01 8.611067e-03 9.547886e-03 -6.000000e+00 3.267503e-01 226.53 -2.00 3.85 -2.00 321.64 0.00e+00 8.241240e-03 4.028899e-03 1.006668e-03 -6.000000e+00 1.432126e-02 270.65 -2.00 20.00 -2.00 321.21 0.00e+00 5.041 0.003 302.00 328.00 3 3.5469e+00 2.8207e-02 6.8843e-02 -6.0000e+00 8.1355e-01 4.7085e-01 3.8258e-02 4.9441e-02 -6.0000e+00 8.8706e-01 -5.8053e-01 3.9608e-02 2.5320e-02 -6.0000e+00 5.2427e-01 2.4164e-01 1.9035e-02 1.2352e-02 -6.0000e+00 2.1992e-01 4.0936e-05 -9.4984e-04 4.2689e-04 1.5051e-04 -6.0000e+00 1.5677e-02 -3.2356e-02 0.0000e+00 12 9 9 12 1 1 9.20 15.55 0.26 -0.03236 -0.03949 12 4 1 8 0 2689.660 15.01 15.55 8.14 20.14 20.56 23.7 990.07 -258043 -147402 -106565 -166012 1928 -212000 -126492 76052 -211631 900000 -186826 -3976 -106333 -16329 188041 -92528 219875 -47492 -46883 -54918 -44360 -41120 900000 -52118 -52745 18737 138409 66666 86517 2537 3163 -12347 32757 -775 39059 -22805 -21634 8653 31115 16816 24388 33851 27526 27238 2477 13072 -725 25682 27486 6928 18088 20546 24263 -300 5531 -823 12752 11714 -230 11919 12269 40563 2765 15367 11394 15559 5747 7894 2939 3315 5471 11951 6750 2783 804 2637 -11968 6182 -2426 -6712 2641 -1081 -2141 -1478 -2780 -736 679 760 2845 -1348 -917 -1501 -1003 -5461 -734 -3574 -1233 1937 -3531 1147 188 -1936 -1573 187 -658 -3660 -35 -1159 -1173 -591 1271 -681 129 -911 -1062 -377 -683 -690 1078 506 1176 1304 2408 2055 1414 -597 134 583 825 320 783 -546 227 722 387 -229 10 392 -189 -502 359 -1279 -1135 -9358 -2262 -1635 -2779 30 -4731 -1941 1167 -5609 900000 -4170 -61 -1632 -251 2885 -2581 3374 -1060 -1112 -1455 -1157 -1009 900000 -1519 -1619 287 2124 1023 1327 51 78 -436 854 -30 959 -1015 -1029 358 1241 903 1347 1818 1647 1672 198 963 -63 1813 2024 680 1776 2006 2504 -43 779 -127 1743 1585 -34 1513 1609 4917 513 2851 2336 3038 1235 1740 763 980 1725 3634 2100 835 221 636 -3172 1431 -707 -2462 1043 -506 -1111 -808 -1632 -448 426 487 1762 -833 -527 -816 -532 -3215 -473 -2797 -1104 1929 -4043 1254 193 -1793 -1323 155 -586 -3548 -34 -1252 -1415 -808 1907 -1109 211 -1458 -1622 -554 -1018 -1079 1743 841 1893 1992 3480 2884 1928 -799 175 807 1307 583 1569 -1187 518 1752 921 -572 26 995 -476 -1207 864 -2902 -2497 SS 20220402T060351.7Z 8127.252682 83 1 49.57 2 77.97 97.64 84.42 86.79 0.00 1 0.00 1 0 17 5.794e-01 1.077e-02 1.987e-01 4.830e-03 7.569555e-01 2.632384e-03 9.085323e-03 -6.000000e+00 3.300148e-01 226.53 -2.00 3.85 -2.00 321.56 0.00e+00 5.198704e-03 1.229920e-03 1.685178e-03 -6.000000e+00 1.402467e-02 270.65 -2.00 20.00 -2.00 321.12 0.00e+00 4.655 0.002 302.00 328.00 3 2.1714e+00 8.5925e-03 6.3943e-02 -6.0000e+00 8.2059e-01 1.9150e-01 1.2450e-02 4.5222e-02 -6.0000e+00 8.9489e-01 -2.3276e-01 1.3989e-02 2.6223e-02 -6.0000e+00 5.2973e-01 9.1781e-02 6.6509e-03 1.0942e-02 -6.0000e+00 2.2339e-01 2.5921e-04 -4.6411e-04 1.3396e-04 1.3972e-04 -6.0000e+00 1.5912e-02 -3.2283e-02 0.0000e+00 12 8 8 10 0 0 6.36 15.55 0.28 -0.03228 -0.03577 113 24 1 8 0 438.590 15.01 15.55 8.15 20.14 20.56 23.8 990.76 900000 -217881 -151707 -197461 -175300 -223531 -241970 -157144 -192498 -16837 -201638 -131620 -153869 -88284 -98612 -90116 -9404 -69896 -50595 -56143 -5803 -43632 -59857 -49148 -43796 -36757 -60949 -29932 -58569 -28318 -31093 -6397 18986 -9161 -1794 -22585 9349 -17459 14143 -409 11328 10084 -8098 8507 7103 6160 1737 7623 4287 13095 11614 9427 11064 5180 12355 -2645 6173 2088 2304 6236 6270 7593 5483 11193 4736 9084 2633 1024 2696 2308 4614 759 3703 -999 -649 -2546 569 -739 -1554 -40 -2505 -53 -3312 -910 -1467 -261 204 491 1035 61 895 -1587 -808 -1371 -615 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