File name: Pandora177s1_WestportCT_20240430_L2Fit_fout2c3d20221101p1-8.txt File generation date: 20240810T204021.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 177 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora177_OF_v3d20201002.txt Instrument calibration file used: Pandora177s1_CF_v3d20221101.txt Level 1 file used: Pandora177s1_WestportCT_20240430_L1_smca1c3d20221101p1-8.txt Full location name: Westport - Sherwood Island State Park CTDEEP (USEPA AQS ID 09-001-9003) Short location name: WestportCT Country of location: USA Location latitude [deg]: 41.1183 Location longitude [deg]: -73.3367 Location altitude [m]: 4 Local noon date: 20240430 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: None First and last pixel inside fitting window: 218 360 Nominal wavelengths inside fitting window [nm]: 305.0382 305.1790 305.3198 305.4607 305.6015 305.7423 305.8831 306.0238 306.1646 306.3054 306.4461 306.5868 306.7276 306.8683 307.0090 307.1497 307.2904 307.4310 307.5717 307.7124 307.8530 307.9936 308.1343 308.2749 308.4155 308.5561 308.6967 308.8372 308.9778 309.1184 309.2589 309.3994 309.5400 309.6805 309.8210 309.9615 310.1019 310.2424 310.3829 310.5233 310.6638 310.8042 310.9446 311.0850 311.2254 311.3658 311.5062 311.6466 311.7869 311.9273 312.0676 312.2079 312.3482 312.4885 312.6288 312.7691 312.9094 313.0497 313.1899 313.3302 313.4704 313.6106 313.7508 313.8910 314.0312 314.1714 314.3116 314.4517 314.5919 314.7320 314.8721 315.0123 315.1524 315.2925 315.4325 315.5726 315.7127 315.8527 315.9928 316.1328 316.2728 316.4129 316.5529 316.6928 316.8328 316.9728 317.1128 317.2527 317.3926 317.5326 317.6725 317.8124 317.9523 318.0922 318.2320 318.3719 318.5118 318.6516 318.7914 318.9313 319.0711 319.2109 319.3507 319.4904 319.6302 319.7700 319.9097 320.0494 320.1892 320.3289 320.4686 320.6083 320.7480 320.8876 321.0273 321.1669 321.3066 321.4462 321.5858 321.7254 321.8650 322.0046 322.1442 322.2837 322.4233 322.5628 322.7024 322.8419 322.9814 323.1209 323.2604 323.3998 323.5393 323.6788 323.8182 323.9576 324.0971 324.2365 324.3759 324.5153 324.6546 324.7940 324.9334 --------------------------------------------------------------------------------------- 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 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: 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 20240430T173549.7Z 8886.733215 444 1 12.68 2 27.83 203.98 117.80 259.61 0.00 1 0.00 1 0 17 1.598e-02 1.154e-02 6.493e-03 3.831e-03 1.660354e-01 2.018043e-03 1.944656e-03 -6.000000e+00 9.580481e-03 229.94 -2.00 3.51 -2.00 315.63 0.00e+00 6.734305e-04 1.968265e-04 1.550996e-04 -6.000000e+00 4.207033e-04 282.00 -2.00 20.00 -2.00 314.96 0.00e+00 1.130 0.000 302.00 328.00 3 5.4312e+00 5.2302e-03 1.4131e-02 -6.0000e+00 2.3904e-02 4.0964e-02 5.8377e-03 8.3310e-03 -6.0000e+00 2.5939e-02 -2.9475e-03 3.3284e-03 4.0320e-03 -6.0000e+00 1.5428e-02 -6.5920e-03 1.4455e-03 1.1196e-03 -6.0000e+00 6.3683e-03 6.3424e-04 1.0038e-03 1.2044e-04 1.5248e-05 -6.0000e+00 4.8537e-04 6.2233e-02 9.6586e-05 12 9 9 12 9 1 97.33 23.42 0.40 0.06223 0.06978 3 3 1 5 0 3169.650 26.83 20.00 23.42 20.03 24.5 1002.91 1966 -110 -882 -1443 -4832 3011 3137 2807 -1548 -4323 -5677 -3381 -653 783 -100 256 -8 1462 1747 2370 538 662 2463 1909 833 1309 -1335 -1800 222 -1009 1348 1948 873 -4004 -4677 -3669 -2294 -1206 -352 -597 -144 191 -88 -368 -712 -3 -278 -370 -1475 778 938 582 697 606 377 1800 26 348 191 524 1595 2442 2520 1256 -209 -572 -1968 -462 2175 1307 1559 952 576 1574 -1093 -1448 -1822 -2709 -1792 -1606 -2234 -2435 -2786 -1350 -257 322 1385 723 1550 892 490 4 -733 -345 -662 -854 691 757 -133 -833 -1402 -1890 -883 -481 -1400 -1750 -1053 -1136 1226 1545 1908 629 278 247 736 -363 -92 -113 133 585 467 865 980 562 983 -314 -726 1463 -527 -599 -994 -1155 -39 91 718 -87 611 717 557 315 -552 -1565 -566 509 -30 -240 -364 -1229 682 753 751 -434 -1262 -1663 -995 -204 270 -38 103 -3 608 743 1025 239 292 1081 877 403 636 -644 -821 93 -419 565 862 405 -1924 -2166 -1686 -1145 -699 -221 -422 -108 148 -70 -293 -566 -3 -210 -270 -1057 547 685 450 563 505 322 1535 22 299 163 449 1409 2149 2350 1213 -198 -530 -1711 -392 1940 1220 1554 981 590 1530 -1011 -1287 -1481 -2148 -1481 -1463 -2126 -2506 -3044 -1534 -291 387 1726 923 1937 1071 578 4 -730 -358 -684 -964 841 934 -171 -1048 -1749 -2222 -1017 -579 -1713 -2271 -1414 -1586 1751 2179 2745 903 400 327 949 -453 -115 -140 177 817 667 1213 1328 732 1285 -394 -882 1763 -682 -772 -1325 -1564 -53 130 1072 -129 926 1101 856 476 -860 -2396 -859 SS 20240430T174046.8Z 8886.736652 447 1 48.93 2 28.23 206.38 118.67 260.32 0.00 1 0.00 1 0 17 1.410e-02 1.038e-02 1.688e-03 9.520e-04 1.651013e-01 4.999347e-04 1.959158e-03 -6.000000e+00 8.455975e-03 229.94 -2.00 3.51 -2.00 315.88 0.00e+00 7.788227e-04 5.117425e-05 1.491812e-04 -6.000000e+00 3.712285e-04 282.00 -2.00 20.00 -2.00 315.20 0.00e+00 1.134 0.000 302.00 328.00 3 4.0684e+00 1.2976e-03 1.4180e-02 -6.0000e+00 2.1098e-02 3.3023e-02 1.4501e-03 8.3753e-03 -6.0000e+00 2.2893e-02 -4.3330e-03 8.2535e-04 4.0592e-03 -6.0000e+00 1.3616e-02 -6.3609e-03 3.6408e-04 1.1520e-03 -6.0000e+00 5.6224e-03 2.4810e-03 9.9503e-04 3.0009e-05 1.4912e-05 -6.0000e+00 4.2830e-04 5.9179e-02 5.1558e-05 12 8 8 10 0 0 99.88 23.43 0.39 0.05918 0.06666 76 17 1 5 0 643.530 26.83 20.00 23.43 20.24 24.5 1005.21 2265 86 -547 -3865 -3261 -1830 542 2309 -1427 -3062 -4531 -1529 -535 900 595 -73 -116 1426 1545 1467 837 534 1609 1613 1714 100 -874 -697 -289 719 1709 1701 230 -3569 -4915 -3791 -2676 -766 -115 -965 -944 -410 41 62 585 178 -469 -469 -937 175 1231 1076 1150 775 430 1264 45 -254 115 436 1725 2213 2497 1616 -263 -1386 -939 -45 2203 1229 564 1182 897 1061 -176 -1233 -1866 -2210 -1217 -1852 -2502 -2634 -2853 -1465 -310 64 876 912 1245 1013 306 -638 -903 206 -84 -240 531 832 81 -723 -1334 -1587 -336 -308 -1783 -1829 -1050 -714 831 1320 1141 753 513 105 70 33 224 126 775 191 409 341 855 705 981 -152 -96 1099 -58 -282 -846 -937 -252 271 309 -72 534 614 377 -39 -378 -1308 -729 562 23 -143 -963 -734 -391 120 557 -383 -848 -1260 -424 -161 298 217 -28 -46 571 633 616 356 227 684 714 790 47 -403 -302 -118 282 686 725 103 -1642 -2195 -1677 -1288 -424 -74 -637 -668 -299 30 46 428 129 -332 -319 -624 127 836 772 863 601 342 1011 37 -206 91 349 1421 1936 2311 1545 -247 -1213 -755 -36 1835 1139 564 1207 910 1030 -161 -1024 -1563 -1795 -1028 -1581 -2372 -2701 -3101 -1658 -370 81 1060 1124 1509 1283 360 -686 -898 200 -86 -268 644 1082 109 -961 -1661 -1858 -384 -369 -2315 -2510 -1366 -962 1155 1909 1693 1106 715 148 91 41 280 166 1083 261 568 467 1231 974 1286 -191 -117 1332 -75 -384 -1194 -1344 -367 410 451 -110 834 972 598 -60 -575 -1950 -1080 SS 20240430T174841.8Z 8886.742151 453 1 19.68 2 28.93 210.09 120.07 261.47 0.00 1 0.00 1 0 17 1.404e-02 1.043e-02 3.122e-03 1.880e-03 1.658978e-01 9.935786e-04 1.949352e-03 -6.000000e+00 8.421223e-03 229.94 -2.00 3.51 -2.00 315.62 0.00e+00 8.234183e-04 9.639166e-05 1.184338e-04 -6.000000e+00 3.696980e-04 282.00 -2.00 20.00 -2.00 314.97 0.00e+00 1.142 0.000 302.00 328.00 3 4.6901e+00 2.5733e-03 1.4250e-02 -6.0000e+00 2.1012e-02 3.7051e-02 2.8672e-03 8.4033e-03 -6.0000e+00 2.2799e-02 -3.4228e-03 1.6364e-03 4.0563e-03 -6.0000e+00 1.3560e-02 -7.1314e-03 7.0893e-04 1.1683e-03 -6.0000e+00 5.5993e-03 1.3176e-03 1.0971e-03 5.9392e-05 1.5238e-05 -6.0000e+00 4.2654e-04 5.9081e-02 5.1116e-05 12 9 9 12 1 1 99.94 23.45 0.40 0.05908 0.06733 12 7 1 5 0 1513.700 26.83 20.00 23.45 20.94 24.5 1009.10 2138 272 -739 -3426 -2743 -2152 235 1585 -711 -2270 -5421 -1522 -731 1000 798 -226 -132 1466 1282 1817 581 1247 1983 2158 2100 687 -511 -1443 -413 935 1013 1336 833 -3398 -4843 -3871 -2437 -620 -121 -1219 -863 -560 314 -203 199 187 22 -616 -918 555 929 1182 1381 756 1288 1719 52 -244 -486 432 1485 2323 2605 1344 -610 -1102 -1060 -299 2256 1145 123 869 865 946 -162 -1278 -1592 -2050 -1442 -2173 -2473 -2358 -2703 -1355 29 90 1023 803 1305 782 411 -533 -1146 338 -114 -167 723 889 -228 -928 -1258 -1643 -433 -364 -1770 -1730 -1181 -523 1032 1142 1209 648 558 7 544 302 -100 -80 613 250 432 563 1121 624 697 28 -52 799 -243 -490 -541 -861 -122 222 227 97 417 489 378 -16 -360 -1254 -597 590 80 -215 -945 -682 -513 58 428 -211 -693 -1691 -470 -245 368 294 -89 -53 594 534 770 251 533 851 963 976 327 -238 -638 -187 408 457 638 415 -1583 -2412 -1912 -1188 -348 -79 -901 -625 -419 236 -154 150 138 17 -469 -682 407 707 947 1059 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