File name: Pandora132s1_Berlin_20210723_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T153140.8Z 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_20210723_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: 20210723 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 20210723T045111.2Z 7874.202213 190 1 49.82 2 77.51 73.31 114.78 258.95 0.00 1 0.00 1 0 17 3.006e-01 8.794e-03 2.402e-01 6.848e-03 5.826672e-01 3.806293e-03 7.204221e-03 -6.000000e+00 1.780106e-01 233.64 -2.00 3.85 -2.00 321.07 0.00e+00 2.267038e-03 1.664455e-03 9.154618e-04 -6.000000e+00 7.793476e-03 282.75 -2.00 20.00 -2.00 320.48 0.00e+00 4.492 0.002 302.00 328.00 3 3.1348e+00 1.2555e-02 5.6650e-02 -6.0000e+00 4.4961e-01 8.5647e-02 1.6390e-02 3.5236e-02 -6.0000e+00 4.8578e-01 -8.2016e-02 1.5603e-02 1.8375e-02 -6.0000e+00 2.8668e-01 2.5512e-02 7.5906e-03 6.1650e-03 -6.0000e+00 1.2164e-01 1.4191e-04 -2.0894e-04 2.0869e-04 7.4185e-05 -6.0000e+00 8.3523e-03 4.8912e-02 0.0000e+00 11 8 0 10 0 0 18.08 18.44 0.42 0.04891 0.04734 48 10 4 8 0 1037.710 14.99 18.44 25.99 22.40 22.71 23.3 985.55 -131309 900000 -121265 -64104 -162568 -64272 -67820 900000 50718 -105314 114800 -39848 10983 -49779 -59892 -18092 -50992 46142 17318 42049 -11694 -21502 -34899 -230 -45685 13968 -6618 -11361 -16256 -10871 22188 -20893 16268 -12822 13712 -4992 -15489 -2823 854 4448 5131 16293 -4868 2517 7744 2007 2113 1353 5545 -3919 3102 -3631 9286 4136 1497 2997 1869 -65 -2863 3624 -1112 3135 2602 264 4920 2354 2073 986 -380 -653 2231 -1519 1883 -594 -1866 3484 -1540 -1986 -1507 1481 -2086 -932 639 -1587 297 -1062 1059 -313 1911 -1077 2033 -1081 -378 -193 -948 841 -53 309 -842 376 -1015 -425 252 -956 -695 -1326 -900 -898 1026 -295 -134 627 90 -227 -961 379 365 799 -594 14 233 35 928 455 1133 -383 1354 150 -18 -306 -519 -123 358 857 -427 226 -255 89 -275 -104 49 -380 900000 -1673 900000 -1545 -471 -2762 -472 -589 900000 339 -1757 766 -452 95 -997 -1599 -362 -1566 585 312 617 -297 -617 -1235 -6 -2104 364 -208 -364 -564 -406 711 -1199 706 -736 586 -273 -1106 -219 77 442 551 1653 -630 307 915 256 275 183 759 -585 530 -665 1623 811 315 644 410 -14 -632 763 -265 807 755 84 1475 697 618 321 -144 -277 978 -696 801 -240 -688 1114 -506 -704 -618 691 -1153 -563 406 -1097 215 -828 841 -253 1474 -806 1369 -707 -244 -135 -762 765 -55 354 -1004 422 -1047 -398 231 -944 -731 -1479 -1059 -1140 1416 -454 -219 1026 143 -341 -1383 532 531 1229 -977 23 375 55 1379 653 1550 -510 1792 220 -29 -555 -1003 -247 757 1922 -1028 559 -644 225 -681 -245 109 -810 900000 SS 20210723T045743.5Z 7874.206753 193 1 49.35 2 76.55 74.54 115.71 260.11 0.00 1 0.00 1 0 25 2.698e-01 8.195e-03 1.620e-01 4.600e-03 5.502565e-01 2.501843e-03 6.901122e-03 -6.000000e+00 1.590333e-01 233.64 -2.00 3.85 -2.00 320.86 0.00e+00 3.786053e-03 1.038885e-03 6.064934e-04 -6.000000e+00 6.865896e-03 282.75 -2.00 20.00 -2.00 320.26 0.00e+00 4.194 0.002 302.00 328.00 3 2.8050e+00 8.0307e-03 5.3109e-02 -6.0000e+00 4.0080e-01 6.8503e-02 1.0292e-02 3.3169e-02 -6.0000e+00 4.3268e-01 -5.4519e-02 9.5425e-03 1.7241e-02 -6.0000e+00 2.5631e-01 1.2109e-02 4.6903e-03 6.6685e-03 -6.0000e+00 1.0851e-01 2.6929e-04 -4.5300e-04 1.3806e-04 7.4779e-05 -6.0000e+00 7.4253e-03 4.9337e-02 0.0000e+00 11 8 0 10 0 0 29.19 18.45 0.27 0.04934 0.04593 83 18 4 8 0 594.240 15.01 18.45 26.56 22.40 22.71 23.4 988.99 -49660 -140159 -33688 -131670 -27318 -77284 -51786 -86950 -84137 99291 -80401 -51009 -84129 14750 -53354 -6241 7586 -39478 8587 -8720 13637 -30907 -2339 -12766 -9105 -5446 239 -855 -18766 9578 -9100 6694 -8177 -5189 -4789 -14139 1529 -4905 3293 174 6935 -1377 4364 3899 1893 3800 4236 7711 -2122 7465 1097 5494 1952 2664 2849 578 4495 -852 1170 -1047 2361 2300 2856 2311 726 3367 491 1939 848 1630 -698 827 -678 479 -110 -1231 -597 -934 816 -2583 -947 -1568 -2358 -427 -1484 559 -171 1324 144 384 -423 350 -935 -282 791 -734 459 -276 405 -19 -207 -770 -166 -373 -2274 -187 -1562 -107 258 893 -156 54 249 -513 802 183 482 -445 97 -535 -137 728 257 686 185 672 774 974 -86 286 -427 -243 162 -92 86 -372 444 218 -318 -377 -14 -203 900000 -401 -2800 -257 -2480 -172 -832 -488 -1326 -1359 445 -1406 -801 -2340 192 -1651 -137 160 -1452 208 -262 330 -1192 -72 -475 -347 -205 8 -30 -800 348 -473 345 -535 -326 -290 -996 108 -451 335 21 843 -175 541 494 250 502 568 1131 -327 1135 198 1042 415 596 663 142 1070 -210 278 -259 611 669 925 802 252 1093 163 684 346 739 -343 404 -324 210 -44 -452 -212 -355 353 -1352 -556 -1020 -1649 -311 -1171 459 -147 1129 121 304 -312 240 -643 -208 656 -709 499 -333 497 -23 -222 -756 -160 -383 -2544 -215 -1933 -140 372 1404 -263 91 405 -791 1157 262 713 -706 162 -911 -227 1152 395 1009 263 908 1051 1439 -144 521 -829 -492 345 -208 206 -847 1023 507 -726 -895 -31 -436 900000 SS 20210723T050302.7Z 7874.210448 195 1 49.54 2 75.77 75.55 116.47 261.07 0.00 1 0.00 1 0 17 2.629e-01 8.969e-03 1.858e-01 4.987e-03 5.231508e-01 2.737467e-03 6.537198e-03 -6.000000e+00 1.556135e-01 233.64 -2.00 3.85 -2.00 320.77 0.00e+00 9.894664e-04 1.092482e-03 4.145842e-04 -6.000000e+00 6.881170e-03 282.75 -2.00 20.00 -2.00 320.15 0.00e+00 3.979 0.001 302.00 328.00 3 3.1521e+00 8.6739e-03 5.0364e-02 -6.0000e+00 3.9177e-01 2.1163e-02 1.1029e-02 3.1367e-02 -6.0000e+00 4.2311e-01 -1.2267e-02 1.0171e-02 1.5762e-02 -6.0000e+00 2.5022e-01 -9.5491e-04 5.0311e-03 4.6921e-03 -6.0000e+00 1.0658e-01 2.4488e-04 -4.5761e-04 1.5358e-04 5.5242e-05 -6.0000e+00 7.2544e-03 4.9082e-02 0.0000e+00 11 8 0 10 0 0 99.79 18.45 0.25 0.04908 0.04564 82 17 4 8 0 604.100 15.01 18.45 27.22 22.40 22.71 23.5 992.08 900000 -99163 34060 -134408 900000 -48059 -48971 -51184 -45325 94406 -84778 151815 -60300 9561 -17628 -34878 23233 -1497 24026 -24693 25550 -22009 40076 -16689 -8659 955 -23562 6602 -29165 12577 -24473 34455 -10598 3395 1105 -8159 3304 -1920 9773 -1323 8038 -1732 5792 -3533 6058 -927 -4184 4578 -4124 10155 -1529 7431 1461 2992 2151 -1314 2368 -1376 5284 -3232 5073 -291 1716 2442 596 947 -380 4866 69 2038 -116 261 -276 1424 -182 -1189 24 -2018 2353 -1742 -230 -3214 -1737 -1091 -1863 452 -717 1647 -1277 1276 414 -14 1112 507 97 -122 1395 -478 639 -844 -58 -134 124 -936 -1995 -662 -1615 728 123 532 14 -286 210 188 711 -349 670 -479 383 -591 -344 636 404 340 69 758 374 1059 364 -101 -321 -51 152 -405 259 -696 802 -284 -135 43 -157 -136 900000 900000 -1490 166 -2672 900000 -444 -524 -647 -595 459 -1854 738 -1524 149 -428 -1136 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