File name: Pandora55s1_QueensNY_20210116_L2Fit_fout2c11d20210101p1-8.txt File generation date: 20260625T174323.5Z 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_20210116_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: 20210116 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 20210116T155008.3Z 7686.659819 227 1 0.66 2 63.97 160.45 79.88 117.68 0.00 1 0.00 1 0 25 4.239e-02 1.092e-02 2.760e-02 7.187e-03 3.656848e-01 3.693994e-03 4.414721e-03 -6.000000e+00 2.478222e-02 223.80 -2.00 3.51 -2.00 317.39 0.00e+00 -1.102102e-03 5.459146e-04 1.807195e-04 -6.000000e+00 1.079511e-03 275.32 -2.00 20.00 -2.00 316.80 0.00e+00 2.265 0.000 302.00 328.00 3 1.8725e+00 9.6785e-03 2.9141e-02 -6.0000e+00 6.1113e-02 4.4303e-02 1.0889e-02 1.8481e-02 -6.0000e+00 6.6469e-02 -1.0314e-02 6.6857e-03 9.2164e-03 -6.0000e+00 3.9583e-02 -1.6608e-03 3.3402e-03 2.7845e-03 -6.0000e+00 1.6662e-02 5.2594e-03 -6.6695e-04 2.1742e-04 3.4409e-05 -6.0000e+00 1.2629e-03 -6.2971e-03 1.8760e-05 12 9 9 12 1 1 999.00 22.82 0.23 -0.00630 -0.01131 1 40 1 5 0 237.450 25.68 20.00 22.82 14.33 27.3 1073.93 26529 -13181 7295 -20139 11696 -17083 9635 -2190 375 2337 -962 6385 -9028 -1148 -4013 -181 -7352 -2895 43 1656 3642 6521 6442 5019 2654 -126 1024 -4627 1668 -3525 -333 791 1643 2175 -2177 5847 -3740 1365 -1844 3063 -3820 787 -834 -1331 -1932 -1089 -900 -2759 -1221 -1909 2031 -999 1404 2507 2326 1635 356 281 -247 821 196 3193 -250 891 -476 371 536 706 1155 2116 214 -175 444 -802 -274 -763 -121 476 2056 1673 1154 -1089 -1685 -2177 -1873 -1309 -57 -521 -1542 -1167 -842 570 1175 1840 1660 2185 170 238 -328 -700 -977 -1050 -183 1199 -182 -1106 -428 -593 1037 -137 -824 255 -748 -331 81 1147 1562 1262 524 717 -1283 -251 302 -525 1098 -1082 543 1262 1245 376 -792 563 843 277 -523 -480 -204 268 -454 -955 -194 -252 141 365 1614 -1286 626 -2179 901 -1609 733 -203 38 252 -111 714 -1254 -169 -691 -34 -1559 -623 9 372 826 1465 1466 1204 687 -35 288 -1334 440 -947 -89 226 504 700 -728 1798 -1258 483 -760 1381 -1979 419 -462 -754 -1102 -619 -508 -1572 -685 -1085 1151 -604 879 1629 1567 1134 255 203 -178 581 139 2280 -192 714 -398 308 430 552 906 1740 190 -163 421 -762 -252 -673 -100 374 1588 1350 1007 -1033 -1698 -2291 -2036 -1470 -65 -622 -1877 -1413 -995 644 1260 1895 1708 2328 194 290 -423 -934 -1302 -1354 -225 1418 -219 -1389 -553 -788 1404 -193 -1212 385 -1153 -504 119 1614 2130 1715 730 1030 -1914 -377 449 -772 1566 -1524 741 1676 1660 521 -1154 842 1288 431 -835 -790 -344 459 -787 -1665 -334 -425 231 591 SS 20210116T162122.5Z 7686.681510 261 1 50.97 2 62.38 168.43 74.84 123.26 0.00 1 0.00 1 0 25 4.987e-02 9.315e-03 1.237e-02 2.237e-03 3.457173e-01 1.147473e-03 4.128921e-03 -6.000000e+00 2.920171e-02 223.80 -2.00 3.51 -2.00 318.23 0.00e+00 -4.629201e-04 2.135090e-04 1.556172e-04 -6.000000e+00 1.273999e-03 275.32 -2.00 20.00 -2.00 317.64 0.00e+00 2.146 0.000 302.00 328.00 3 4.4986e+00 3.0576e-03 2.7598e-02 -6.0000e+00 7.2014e-02 5.4842e-02 3.4721e-03 1.7446e-02 -6.0000e+00 7.8334e-02 8.6696e-03 2.2964e-03 8.7607e-03 -6.0000e+00 4.6609e-02 -1.2674e-02 1.1871e-03 2.5374e-03 -6.0000e+00 1.9765e-02 4.3664e-04 7.2352e-04 6.9697e-05 3.1165e-05 -6.0000e+00 1.4959e-03 -8.4077e-03 2.8101e-04 11 8 0 10 0 0 99.99 22.81 0.16 -0.00841 -0.00297 121 23 1 5 0 417.670 25.68 20.00 22.81 14.73 27.4 1077.10 900000 10497 33577 -25179 12022 -194 2819 13310 -415 -3310 -12902 2318 -13001 1475 11568 196 -10504 -10883 3446 7690 644 837 -1162 -2047 -838 -4137 6578 -3471 258 -6766 234 1607 1430 -4171 -799 9270 -1250 -955 3228 1733 -2513 -925 -3938 -2999 -822 2856 -1972 1441 443 455 220 120 -843 2206 3469 522 2594 973 2283 1218 1268 2330 999 -1113 -131 -1538 1297 -817 1896 1845 -1043 -145 373 -1066 331 -380 1306 1800 1364 248 -40 -81 -1374 -1541 -1758 -763 -1305 -701 -1488 -546 11 -37 739 1757 339 1626 356 575 -420 -787 -74 -780 40 877 509 -807 -423 -413 -37 486 245 -568 27 -20 -450 324 755 1240 423 0 -1080 -669 32 404 217 -50 119 852 754 30 507 577 510 293 768 -382 60 319 -178 -1469 -146 -252 -341 340 900000 554 1522 -1914 616 -11 151 708 -28 -247 -1090 176 -1236 140 1161 25 -1564 -1717 500 1120 103 135 -194 -359 -155 -833 1226 -695 48 -1302 43 318 310 -1009 -189 1943 -294 -249 944 600 -1016 -397 -1805 -1394 -376 1271 -911 640 198 204 102 59 -445 1195 1950 310 1554 598 1377 732 762 1435 664 -805 -98 -1164 917 -564 1287 1341 -849 -124 327 -943 279 -304 947 1217 913 176 -32 -70 -1297 -1535 -1838 -830 -1494 -830 -1808 -656 12 -41 759 1700 330 1645 393 691 -546 -1066 -99 -1006 48 1014 600 -1007 -550 -555 -52 703 372 -905 43 -32 -686 468 1044 1696 597 1 -1669 -1046 50 609 320 -72 164 1133 1006 42 751 890 809 476 1276 -662 107 583 -330 -2763 -268 -453 -593 582 SS 20210116T181652.6Z 7686.761720 387 1 51.14 2 63.74 198.70 59.57 148.20 0.00 1 0.00 1 0 25 1.414e-02 6.853e-03 9.101e-04 2.194e-04 3.766111e-01 1.125580e-04 4.556214e-03 -6.000000e+00 8.268102e-03 223.81 -2.00 3.51 -2.00 317.57 0.00e+00 3.514725e-05 1.754276e-05 1.352863e-04 -6.000000e+00 3.601694e-04 275.32 -2.00 20.00 -2.00 316.99 0.00e+00 2.247 0.000 302.00 328.00 3 2.3819e-01 2.9584e-04 2.9405e-02 -6.0000e+00 2.0389e-02 3.5772e-02 3.3311e-04 1.9015e-02 -6.0000e+00 2.2177e-02 -1.7554e-02 2.0767e-04 9.5079e-03 -6.0000e+00 1.3206e-02 2.0269e-03 1.0487e-04 2.7245e-03 -6.0000e+00 5.5584e-03 2.7023e-02 -6.4084e-04 6.6451e-06 3.4974e-05 -6.0000e+00 4.2135e-04 -5.0100e-03 4.6065e-05 11 8 0 10 0 0 79.32 22.81 0.21 -0.00501 -0.00983 1446 273 1 5 0 34.730 25.68 19.99 22.81 15.80 27.7 1084.97 -4649 -4178 -5168 -6332 -5184 -4114 -3544 -2301 -2088 -3256 -2843 -1566 -989 -661 5 -946 -579 -200 187 162 -73 898 1302 899 434 131 -783 -831 169 1540 1160 1539 1310 -1073 -979 179 447 365 610 -711 -1211 -1098 -1186 -1026 -684 -416 -790 -531 -549 538 855 756 953 945 655 665 810 307 605 892 1530 1442 1295 609 -667 -189 265 714 1563 1063 113 -392 -818 -598 -850 -182 380 850 1539 484 82 -739 -1595 -1459 -1140 -1172 -873 -750 -633 -706 -232 340 493 1463 1682 1426 927 830 -345 -717 -544 -559 56 933 151 -885 -432 -783 -184 -64 -186 -409 -384 -142 33 672 1049 998 708 -108 -703 -539 -295 -308 117 257 489 1488 1200 472 396 -38 279 185 312 -245 -226 83 -431 -522 -292 -214 -215 123 -316 -324 -431 -528 -398 -320 -279 -181 -185 -318 -287 -162 -113 -88 1 -157 -105 -39 38 34 -16 197 289 209 101 32 -200 -207 40 377 295 399 378 -340 -311 55 139 119 236 -312 -573 -564 -640 -567 -359 -231 -416 -292 -301 295 458 435 592 594 435 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