File name: Pandora55s1_QueensNY_20210203_L2Fit_fout2c11d20210101p1-8.txt File generation date: 20260625T175314.4Z Data description: Level 2 spectral fitting results file Data file version: fout2c11p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora55_OF_v4d20190723.txt Instrument calibration file used: Pandora55s1_CF_v11d20210101.txt Level 1 file used: Pandora55s1_QueensNY_20210203_L1_smca1c11d20210101p1-8.txt Full location name: Queens College NYSDEC (USEPA AQS ID 36-081-0124) Short location name: QueensNY Country of location: USA Location latitude [deg]: 40.7361 Location longitude [deg]: -73.8215 Location altitude [m]: 25 Local noon date: 20210203 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: None First and last pixel inside fitting window: 261 404 Nominal wavelengths inside fitting window [nm]: 305.0145 305.1546 305.2946 305.4346 305.5746 305.7145 305.8545 305.9945 306.1344 306.2744 306.4143 306.5542 306.6941 306.8340 306.9739 307.1138 307.2536 307.3935 307.5333 307.6732 307.8130 307.9528 308.0926 308.2324 308.3722 308.5120 308.6517 308.7915 308.9312 309.0710 309.2107 309.3504 309.4901 309.6298 309.7695 309.9091 310.0488 310.1884 310.3281 310.4677 310.6073 310.7469 310.8865 311.0261 311.1657 311.3053 311.4448 311.5844 311.7239 311.8634 312.0029 312.1424 312.2819 312.4214 312.5609 312.7003 312.8398 312.9792 313.1187 313.2581 313.3975 313.5369 313.6763 313.8156 313.9550 314.0944 314.2337 314.3730 314.5124 314.6517 314.7910 314.9303 315.0695 315.2088 315.3481 315.4873 315.6265 315.7658 315.9050 316.0442 316.1834 316.3226 316.4617 316.6009 316.7401 316.8792 317.0183 317.1574 317.2966 317.4357 317.5747 317.7138 317.8529 317.9919 318.1310 318.2700 318.4090 318.5481 318.6871 318.8260 318.9650 319.1040 319.2429 319.3819 319.5208 319.6598 319.7987 319.9376 320.0765 320.2153 320.3542 320.4931 320.6319 320.7708 320.9096 321.0484 321.1872 321.3260 321.4648 321.6036 321.7423 321.8811 322.0198 322.1586 322.2973 322.4360 322.5747 322.7134 322.8520 322.9907 323.1294 323.2680 323.4066 323.5453 323.6839 323.8225 323.9611 324.0996 324.2382 324.3768 324.5153 324.6538 324.7924 324.9309 --------------------------------------------------------------------------------------- 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 100-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-387: 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 20210203T134921.3Z 7704.575941 319 1 50.69 2 73.49 130.00 73.24 242.39 0.00 1 0.00 1 0 25 3.620e-01 1.513e-02 1.236e-01 2.748e-03 5.485840e-01 1.438042e-03 6.398954e-03 -6.000000e+00 2.135646e-01 224.46 -2.00 3.51 -2.00 319.64 0.00e+00 1.642412e-03 4.229653e-04 3.369594e-04 -6.000000e+00 9.325024e-03 275.28 -2.00 20.00 -2.00 319.11 0.00e+00 3.463 0.001 302.00 328.00 3 3.6134e+00 4.0397e-03 4.4487e-02 -6.0000e+00 5.2798e-01 9.5975e-02 4.8206e-03 2.8317e-02 -6.0000e+00 5.7442e-01 -4.6231e-02 4.1226e-03 1.4345e-02 -6.0000e+00 3.4071e-01 1.0319e-02 2.1519e-03 4.5725e-03 -6.0000e+00 1.4305e-01 2.2540e-04 -9.9096e-04 8.1234e-05 5.3448e-05 -6.0000e+00 1.0954e-02 -1.0542e-03 5.2241e-05 12 9 9 12 33 1 99.80 22.82 0.16 -0.00105 -0.00850 20 4 1 5 0 2413.210 25.68 19.99 22.82 5.89 26.2 996.52 -99310 195474 900000 -125329 -3603 43608 -37125 900000 20823 -69556 -99897 -22285 -79688 34401 244219 454 -59421 -17998 96107 29256 62788 8245 5585 -18795 -18852 -13063 57691 -13417 -3955 -14321 -1675 17294 -2804 -10916 -3001 51902 -8813 5239 13128 7922 -5986 -538 -6921 -2970 416 12548 -6868 8485 6605 6981 -546 1613 -1893 5410 7134 3230 6089 3020 3873 2235 -45 6818 -506 -2689 780 -2700 4735 73 4975 1292 -2516 -920 2255 -3045 1435 -1543 1710 3410 -1945 65 -1962 1729 -1741 -684 -1597 -1139 -2187 -541 -2042 -867 -452 -42 835 419 713 851 -334 -345 -432 -1252 -336 -317 -180 1524 209 -812 -380 -63 -543 1211 301 -871 169 -365 -334 629 1024 1420 482 109 -1483 -527 420 1016 -81 364 74 1165 1105 -443 839 510 608 328 505 -350 168 408 -229 -2007 -117 -348 97 -20 -2364 524 900000 -4929 -44 329 -610 900000 250 -2097 -4236 -499 -3510 647 794 17 -4326 -980 1968 1173 1919 425 301 -1344 -1458 -1020 2408 -1074 -285 -1150 -130 1289 -289 -1321 -346 3538 -1083 635 1757 1314 -1285 -120 -1725 -740 102 2809 -1842 2015 1631 1786 -158 497 -654 1886 2601 1267 2419 1244 1576 906 -19 2762 -236 -1398 421 -1526 2470 39 2631 762 -1677 -645 1579 -2190 955 -984 986 1847 -1118 40 -1368 1300 -1466 -606 -1488 -1106 -2235 -566 -2191 -917 -465 -41 769 376 651 831 -359 -407 -550 -1674 -446 -404 -214 1722 240 -975 -474 -81 -732 1698 452 -1387 275 -593 -528 954 1505 2079 728 170 -2404 -851 664 1565 -123 535 106 1626 1568 -672 1346 862 1066 592 938 -677 334 824 -468 -4150 -235 -681 183 -37 SS 20210203T140452.5Z 7704.586718 331 1 50.95 2 71.29 133.14 75.84 245.17 0.00 1 0.00 1 0 25 2.433e-01 1.747e-02 6.057e-02 2.879e-03 4.844627e-01 1.490592e-03 5.706299e-03 -6.000000e+00 1.424889e-01 224.46 -2.00 3.51 -2.00 319.27 0.00e+00 2.950960e-03 3.843856e-04 2.626293e-04 -6.000000e+00 6.267088e-03 275.28 -2.00 20.00 -2.00 318.72 0.00e+00 3.079 0.000 302.00 328.00 3 4.1540e+00 4.1078e-03 3.9391e-02 -6.0000e+00 3.5190e-01 9.6169e-02 4.7832e-03 2.4866e-02 -6.0000e+00 3.8268e-01 -6.9699e-02 3.7193e-03 1.2739e-02 -6.0000e+00 2.2791e-01 2.8098e-02 1.9559e-03 4.6332e-03 -6.0000e+00 9.6092e-02 2.0448e-04 -1.1443e-03 8.6292e-05 5.1668e-05 -6.0000e+00 7.2554e-03 -7.8938e-04 1.1067e-05 12 9 8 11 32 0 99.60 22.82 0.28 -0.00079 -0.00939 20 4 1 5 0 2545.830 25.68 19.99 22.82 6.23 26.3 996.39 -75875 66669 900000 -75781 -17156 12258 -21108 157769 286 -44816 -72021 -19205 -56741 7298 104269 -2263 7988 -71861 59600 27890 41475 18444 11143 -16345 -12879 -11567 37109 1992 -3309 -12826 4060 16729 -1481 -6836 560 43116 -6734 -4611 10818 7865 -4675 -1373 -4201 -1355 84 13561 -2526 9715 6158 1090 178 3147 -1342 6296 8147 2577 4986 2300 2982 978 790 5951 199 1078 1573 -2842 4888 9 5331 1051 -2514 -282 1754 -3727 2353 -2441 577 4050 -1687 114 -1237 -2097 -1302 -1374 -3249 -715 -2570 -1071 -2505 -696 -907 -727 1007 225 695 595 -648 -459 -624 -1170 -316 -239 86 1278 977 -106 -475 118 -450 1597 779 -703 456 -160 -303 313 1052 1299 764 116 -1180 65 840 -349 209 649 -315 971 766 -148 778 508 410 437 597 -518 247 130 -787 -412 -379 -609 -8 -506 -2770 755 900000 -3482 -433 224 -532 815 7 -1845 -3977 -690 -3305 283 1991 -136 486 -9871 2597 1719 2327 1298 850 -1676 -1363 -1272 2663 196 -333 -1412 410 1702 -201 -1057 82 4172 -1057 -790 1896 1662 -1246 -385 -1267 -412 26 3716 -802 2800 1852 352 61 1130 -539 2524 3396 1163 2269 1081 1385 455 369 2766 105 612 943 -1787 2808 5 3047 670 -1801 -212 1325 -2900 1677 -1696 362 2345 -1031 74 -904 -1703 -1142 -1273 -3191 -721 -2744 -1173 -2815 -769 -974 -746 964 209 650 593 -712 -550 -804 -1580 -424 -307 104 1469 1134 -129 -605 155 -616 2265 1176 -1125 739 -260 -476 471 1525 1878 1137 180 -1892 104 1322 -541 315 951 -451 1347 1078 -220 1228 842 704 767 1079 -976 478 256 -1570 -821 -744 -1165 -15 -920 SS 20210203T141058.3Z 7704.590952 334 1 50.52 2 70.45 134.42 76.88 246.23 0.00 1 0.00 1 0 25 1.130e-01 8.439e-03 1.883e-02 1.435e-03 4.777416e-01 7.387033e-04 5.663477e-03 -6.000000e+00 6.618229e-02 224.46 -2.00 3.51 -2.00 318.93 0.00e+00 6.769073e-04 1.728289e-04 3.278461e-04 -6.000000e+00 2.876333e-03 275.28 -2.00 20.00 -2.00 318.37 0.00e+00 2.955 0.000 302.00 328.00 3 3.0324e+00 2.0128e-03 3.8244e-02 -6.0000e+00 1.6344e-01 6.3534e-02 2.3196e-03 2.4467e-02 -6.0000e+00 1.7773e-01 -2.0995e-02 1.7470e-03 1.2236e-02 -6.0000e+00 1.0578e-01 6.7229e-04 9.2512e-04 3.5997e-03 -6.0000e+00 4.4431e-02 7.2111e-04 -8.0329e-04 4.2784e-05 4.3491e-05 -6.0000e+00 3.3671e-03 -9.5610e-04 4.6797e-05 11 8 0 10 0 0 99.65 22.82 0.12 -0.00096 -0.00699 62 12 1 5 0 814.690 25.68 19.99 22.82 6.28 26.2 996.49 -26438 -731 93436 -50127 -14545 -22082 -21808 24480 -9178 -11967 -39475 1590 -24427 10528 12751 1394 -16932 -3007 9382 4587 5646 -1346 5714 -7964 -2313 -6716 10275 -6744 -122 -5291 67 4686 -1345 -5150 -1917 12184 -4605 182 2410 1811 -3099 -984 -3385 -1858 -659 2255 -1285 -21 1296 990 494 420 -77 1268 2591 1205 1276 1008 722 1442 817 3147 632 16 -451 -715 1645 473 2696 1271 -629 -651 293 -1259 200 -616 982 1602 731 834 -594 44 -1737 -1140 -1816 -792 -1497 -444 -1138 -511 -37 88 835 1065 1783 1449 636 392 -209 -984 -446 -358 -21 991 112 -649 -772 -565 -439 537 -205 -594 -286 -81 -86 598 1033 1063 651 -233 -790 -573 -117 39 109 -20 443 1290 1106 266 324 212 261 326 244 -205 69 168 -377 -1148 -144 -255 160 45 -685 -17 1014 -2020 -402 -626 -634 516 -296 -430 -1921 56 -1252 468 663 93 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