File name: Pandora75s1_EssexMD_20240731_L2Fit_fout2c1d20221230p1-8.txt File generation date: 20240801T051941.8Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 75 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora75_OF_v3d20220127.txt Instrument calibration file used: Pandora75s1_CF_v104d20221230.txt Level 1 file used: Pandora75s1_EssexMD_20240731_L1_smca1c1d20221230p1-8.txt Full location name: MDE Essex Monitoring Site Short location name: EssexMD Country of location: United States Location latitude [deg]: 39.3109 Location longitude [deg]: -76.4745 Location altitude [m]: 12 Local noon date: 20240731 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are latency correction, matrix method stray light correction (replaced by simple method) Data caveats: OoB-data based on session 103 First and last pixel inside fitting window: 196 337 Nominal wavelengths inside fitting window [nm]: 305.0663 305.2078 305.3493 305.4908 305.6322 305.7737 305.9151 306.0566 306.1980 306.3394 306.4807 306.6221 306.7635 306.9048 307.0461 307.1874 307.3287 307.4700 307.6112 307.7524 307.8937 308.0349 308.1761 308.3172 308.4584 308.5996 308.7407 308.8818 309.0229 309.1640 309.3051 309.4461 309.5872 309.7282 309.8692 310.0102 310.1512 310.2921 310.4331 310.5740 310.7149 310.8558 310.9967 311.1376 311.2784 311.4193 311.5601 311.7009 311.8417 311.9825 312.1233 312.2640 312.4048 312.5455 312.6862 312.8269 312.9676 313.1083 313.2489 313.3896 313.5302 313.6708 313.8114 313.9520 314.0925 314.2331 314.3736 314.5141 314.6547 314.7951 314.9356 315.0761 315.2165 315.3570 315.4974 315.6378 315.7782 315.9186 316.0590 316.1993 316.3397 316.4800 316.6203 316.7606 316.9009 317.0411 317.1814 317.3216 317.4619 317.6021 317.7423 317.8825 318.0227 318.1628 318.3030 318.4431 318.5832 318.7233 318.8634 319.0035 319.1436 319.2836 319.4237 319.5637 319.7037 319.8437 319.9837 320.1237 320.2636 320.4036 320.5435 320.6834 320.8233 320.9632 321.1031 321.2430 321.3828 321.5227 321.6625 321.8023 321.9421 322.0819 322.2217 322.3615 322.5012 322.6409 322.7807 322.9204 323.0601 323.1998 323.3395 323.4791 323.6188 323.7584 323.8980 324.0376 324.1772 324.3168 324.4564 324.5960 324.7355 324.8750 --------------------------------------------------------------------------------------- Column 1: Two letter code of measurement routine Column 2: UT date and time for center-time of measurement, yyyymmddThhmmssZ (ISO 8601) Column 3: Fractional days since 1-Jan-2000 midnight for center-time of measurement Column 4: Routine count (1 for the first routine of the day, 2 for the second, etc.) Column 5: Repetition count (1 for the first set in the routine, 2 for the second, etc.) Column 6: Total duration of measurement set in seconds Column 7: Data processing type index Column 8: Solar zenith angle for center-time of measurement in degree Column 9: Solar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 10: Lunar zenith angle for center-time of measurement in degree Column 11: Lunar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 12: Pointing zenith angle in degree, absolute or relative (see next column), 999=tracker not used Column 13: Zenith pointing mode: zenith angle is... 0=absolute, 1=relative to sun, 2=relative to moon Column 14: Pointing azimuth in degree, increases clockwise, absolute (0=north) or relative (see next column), 999=tracker not used Column 15: Azimuth pointing mode: like zenith angle mode but also fixed scattering angles relative to sun (3) or moon (4) Column 16: Fitting result index: 0=no error or warning, 1, 2=warning, >2=error Column 17: Number of function evaluations used, 0=linear fitting or fitting not successful or no fitting done Column 18: rms of unweighted fitting residuals, -9=fitting not successful Column 19: Normalized rms of fitting residuals weighted with independent uncertainty, -9=fitting not successful or no uncertainty used Column 20: Expected rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 21: Expected normalized weighted rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 22: Ozone slant column amount [moles per square meter], -9e99=fitting not successful Column 23: Independent uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 24: Structured uncertainty of ozone slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 25: Common uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 26: rms-based uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 27: Ozone effective temperature [K] Column 28: Independent uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 29: Structured uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 30: Common uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 31: Effective ozone fitting wavelength [nm], -9=fitting not successful Column 32: Diffuse correction applied before fitting at effective fitting wavelength for ozone [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 33: Sulfur dioxide slant column amount [moles per square meter], -9e99=fitting not successful Column 34: Independent uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 35: Structured uncertainty of sulfur dioxide slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 36: Common uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 37: rms-based uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 38: Sulfur dioxide effective temperature [K] Column 39: Independent uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 40: Structured uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 41: Common uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 42: Effective sulfur dioxide fitting wavelength [nm], -9=fitting not successful Column 43: Diffuse correction applied before fitting at effective fitting wavelength for sulfur dioxide [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 44: Molecular scattering air mass factor used for molecular scattering subtraction before the fitting Column 45: Estimated uncertainty of molecular scattering air mass factor, -9=molecular scattering was not subtracted before the fitting Column 46: Lower limit used for wavelength scaling [nm] Column 47: Upper limit used for wavelength scaling [nm] Column 48: Order of smoothing polynomial Column 49: Smoothing polynomial coefficient, order 0 Column 50: Independent uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 51: Structured uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 52: Common uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 53: rms-based uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 54: Smoothing polynomial coefficient, order 1 Column 55: Independent uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 56: Structured uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 57: Common uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 58: rms-based uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 59: Smoothing polynomial coefficient, order 2 Column 60: Independent uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 61: Structured uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 62: Common uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 63: rms-based uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 64: Smoothing polynomial coefficient, order 3 Column 65: Independent uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 66: Structured uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 67: Common uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 68: rms-based uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 69: Mean value of measured data inside fitting window [same units as measurements] Column 70: Wavelength change polynomial coefficient, order 0 Column 71: Independent uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 72: Structured uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 73: Common uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 74: rms-based uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 75: L1 based wavelength change coefficient, order 0, -9=no L1 wavelength change determination Column 76: L1 based wavelength change coefficient, order 1, -9=no L1 wavelength change determination Column 77: L2Fit data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 78: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ1 limit, 0=L1 data quality above 0, 1=Spectral fitting was not successful, 2=Wavelength shift too large, 3=Normalized rms of fitting residuals weighted with independent uncertainty too large Column 79: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 80: L1 data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 81: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ1 limit, 0=Saturated data, 1=Too few dark counts measurements, 2=No temperature given or effective temperature too different from the reference temperature, 3=Dark count too high, 4=Unsuccessful dark background fitting, 5=The dark count differs significantly from the dark map for too many pixels, 6=Absolute value of estimated average residual stray light level too high, 7=Although attempted, no wavelength change could be retrieved, 8=Absolute value of retrieved wavelength shift too large, 9=Retrieved wavelength shift differs too much from the shift predicted by the effective temperature Column 82: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 83: Atmospheric variability [%], 999=no atmospheric variability was determined Column 84: Wavelength effective temperature [°C], 999=no effective temperature given Column 85: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 86: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 87: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 88: Number of bright count cycles Column 89: Number of dark count cycles Column 90: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 91: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 92: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 93: Integration time [ms] Column 94: Temperature at electronics board [°C], 999=no temperature signal Column 95: Spectrometer control temperature [°C], 999=no temperature signal Column 96: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 97: Temperature in head sensor [°C], 999=no temperature signal Column 98: Humidity in head sensor [%], -9=no humidity signal Column 99: Pressure in head sensor [hPa], -9=no pressure signal Columns 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: Normalized slant column residuals weighted with independent instrumental uncertainty for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting, 0=no independent instrumental uncertainty was given --------------------------------------------------------------------------------------- SS 20240731T122008.5Z 8978.513988 238 1 0.64 2 65.74 85.96 22.12 114.37 0.00 1 0.00 1 0 17 2.411e-02 1.109e-02 2.374e-02 7.156e-03 3.264325e-01 3.885421e-03 3.890633e-03 -6.000000e+00 1.489987e-02 232.19 -2.00 3.48 -2.00 317.29 0.00e+00 1.274113e-03 5.659558e-04 5.164942e-04 -6.000000e+00 6.636057e-04 290.85 -2.00 20.00 -2.00 316.44 0.00e+00 2.416 0.000 302.00 328.00 3 2.1892e+00 1.0289e-02 2.9624e-02 -6.0000e+00 3.7286e-02 9.7191e-03 1.1467e-02 1.6935e-02 -6.0000e+00 4.0027e-02 -1.2940e-02 6.8576e-03 8.1790e-03 -6.0000e+00 2.3891e-02 4.7226e-04 3.3802e-03 2.2497e-03 -6.0000e+00 1.0209e-02 3.4985e-03 -6.4596e-04 2.2424e-04 2.8182e-05 -6.0000e+00 7.4321e-04 -3.5222e-02 2.3695e-04 12 9 9 12 1 1 999.00 23.65 0.40 -0.03522 -0.04008 1 27 1 5 0 317.150 26.32 20.00 23.65 34.91 4.5 1055.71 -6157 -6879 -1494 -478 -2655 -10036 -8344 5163 -4935 345 -2433 1563 591 -3332 -6106 -3424 -1832 -2090 642 1048 7197 2267 3021 -598 2681 -4681 675 -39 -3522 -4076 -55 -560 -3309 4257 -4769 -2330 -7552 1241 -1816 -1287 1158 318 964 40 2116 869 -63 686 -1427 -593 2003 2604 1126 1524 1510 1130 -121 2220 210 3088 -1526 2853 2299 2106 1129 -1185 708 -487 1179 1599 244 -56 295 0 -266 -1594 -3185 -570 -1937 -985 -2186 -3050 -1443 -1766 -1266 -839 -535 565 1513 -350 1006 -386 594 -1101 -1587 -264 146 382 527 -173 -1179 -820 -1454 -496 -572 -1359 147 229 306 1199 1767 907 1119 -340 138 -468 335 399 259 965 744 942 617 299 -425 -376 -223 -600 461 802 -112 -1400 -704 -37 276 -422 687 625 102 592 -1518 -768 -589 -749 -163 -50 -263 -1015 -856 508 -596 42 -316 203 87 -537 -1174 -723 -411 -497 156 265 1753 584 790 -156 714 -1396 193 -11 -963 -1114 -15 -172 -1135 1413 -1689 -795 -2696 468 -839 -643 628 172 538 23 1196 499 -36 386 -817 -343 1192 1655 726 1037 1070 776 -85 1535 146 2217 -1114 2137 1778 1739 950 -970 571 -393 938 1411 226 -52 272 0 -233 -1356 -2525 -451 -1541 -869 -2083 -3084 -1473 -1916 -1394 -982 -629 676 1796 -408 1126 -422 632 -1173 -1712 -297 175 483 701 -229 -1491 -1002 -1784 -590 -727 -1766 198 313 441 1763 2619 1376 1644 -496 194 -629 466 555 369 1434 1127 1406 899 435 -595 -523 -300 -826 641 1193 -171 -2161 -1113 -58 461 -715 1186 1099 180 1013 -2557 -1286 SS 20240731T122815.6Z 8978.519626 243 1 51.90 2 64.17 87.21 20.74 117.30 0.00 1 0.00 1 0 17 1.639e-02 7.782e-03 6.100e-04 2.149e-04 3.116698e-01 1.168818e-04 3.725969e-03 -6.000000e+00 1.012610e-02 232.19 -2.00 3.48 -2.00 316.99 0.00e+00 8.502718e-04 1.568274e-05 3.227767e-04 -6.000000e+00 4.510646e-04 290.85 -2.00 20.00 -2.00 316.13 0.00e+00 2.281 0.000 302.00 328.00 3 4.4642e-01 3.0839e-04 2.8107e-02 -6.0000e+00 2.5340e-02 1.0781e-02 3.4323e-04 1.6211e-02 -6.0000e+00 2.7206e-02 -1.3732e-02 2.0243e-04 7.8438e-03 -6.0000e+00 1.6238e-02 -9.2531e-04 9.7919e-05 2.1509e-03 -6.0000e+00 6.9361e-03 2.3335e-02 -1.0401e-03 6.7290e-06 2.7787e-05 -6.0000e+00 5.0533e-04 -3.3770e-02 1.8604e-04 11 8 0 10 0 0 97.45 23.65 0.41 -0.03377 -0.04159 1148 187 1 5 0 44.930 26.32 20.00 23.65 35.14 4.6 1058.17 -3218 -1490 -1499 -2755 -4622 -5736 -5264 -4493 -3679 -4046 -4763 -5005 -3942 -2354 -705 277 689 1366 1953 2097 2067 1838 1688 1533 1236 1210 603 -424 -598 -603 -112 497 269 -1159 -3076 -3626 -3443 -2282 -768 -573 -354 -33 181 428 524 596 217 -102 -297 1 504 985 1106 1181 979 1010 819 484 183 339 934 1563 2093 1758 903 13 -385 -345 560 1079 806 830 737 352 -121 -1028 -1708 -2064 -2021 -1763 -1823 -1943 -1937 -1648 -815 -339 287 705 703 591 319 -76 -572 -433 -266 48 500 586 165 -340 -958 -1443 -931 -571 -841 -1022 -605 -224 429 893 889 669 403 35 -78 16 239 442 545 370 395 560 608 580 406 97 59 279 279 15 -210 -439 -322 55 36 100 301 263 -21 -195 -591 -1001 -377 -175 -185 -370 -581 -691 -651 -606 -546 -587 -714 -779 -675 -459 -156 62 166 345 514 573 579 519 488 467 398 405 205 -140 -188 -187 -37 162 95 -434 -1141 -1335 -1361 -954 -376 -305 -196 -19 109 262 322 367 132 -61 -178 1 322 631 753 850 693 734 607 360 135 248 701 1248 1709 1455 758 11 -309 -274 466 945 736 794 707 326 -111 -903 -1384 -1709 -1661 -1534 -1699 -1914 -2052 -1764 -925 -392 347 840 838 707 372 -82 -604 -447 -290 55 611 756 217 -443 -1236 -1742 -1113 -696 -1055 -1307 -810 -303 610 1301 1315 1005 589 49 -107 21 324 600 786 543 590 826 872 827 573 131 77 370 395 22 -312 -679 -495 88 60 165 512 456 -37 -331 -969 -1649 SS 20240731T123335.8Z 8978.523331 246 1 51.95 2 63.14 88.03 19.85 119.40 0.00 1 0.00 1 0 17 1.507e-02 7.776e-03 5.414e-04 2.008e-04 3.018044e-01 1.092421e-04 3.606934e-03 -6.000000e+00 9.309979e-03 232.19 -2.00 3.48 -2.00 316.86 0.00e+00 8.052326e-04 1.429497e-05 3.019708e-04 -6.000000e+00 4.146939e-04 290.85 -2.00 20.00 -2.00 316.02 0.00e+00 2.201 0.000 302.00 328.00 3 3.9812e-01 2.8798e-04 2.7153e-02 -6.0000e+00 2.3298e-02 1.1829e-02 3.2012e-04 1.5691e-02 -6.0000e+00 2.5013e-02 -1.3010e-02 1.8775e-04 7.5856e-03 -6.0000e+00 1.4929e-02 -1.4693e-03 9.0282e-05 2.0778e-03 -6.0000e+00 6.3776e-03 2.6860e-02 -9.0398e-04 6.2852e-06 2.7481e-05 -6.0000e+00 4.6455e-04 -3.4082e-02 2.0179e-04 11 8 0 10 0 0 69.13 23.66 0.39 -0.03408 -0.04087 1368 223 1 5 0 37.720 26.32 20.00 23.66 35.72 4.6 1062.95 -2506 -1258 -1182 -2342 -4332 -4693 -4706 -3904 -2775 -3611 -4461 -4586 -3377 -2122 -501 291 723 1457 1818 1964 1973 1639 1570 1678 1206 1179 573 -240 -619 -533 -19 521 293 -1229 -3096 -3765 -3367 -2218 -805 -568 -404 -71 122 376 417 560 159 -143 -350 -14 536 890 1009 1175 1028 951 847 415 206 367 926 1514 2084 1730 853 -22 -329 -323 524 1131 809 844 680 392 -141 -1050 -1659 -2074 -2024 -1706 -1826 -1933 -1935 -1609 -793 -316 303 740 691 577 313 -29 -523 -340 -169 53 543 636 166 -337 -958 -1436 -957 -609 -817 -1016 -593 -236 442 869 864 631 353 75 -107 7 255 457 542 394 382 525 562 559 418 98 50 262 266 20 -214 -422 -322 64 54 107 335 268 -40 -227 -587 -1004 -318 -161 -159 -309 -589 -606 -626 -566 -401 -563 -718 -764 -616 -440 -118 70 185 389 506 567 583 489 478 536 408 382 188 -83 -203 -173 -7 176 107 -476 -1187 -1433 -1372 -955 -406 -311 -230 -43 76 237 263 353 100 -89 -215 -9 347 579 698 857 737 699 634 312 153 272 703 1222 1718 1518 759 -19 -265 -256 436 989 775 806 652 363 -128 -922 -1343 -1713 -1656 -1552 -1774 -1979 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