File name: Pandora177s1_WestportCT_20240502_L2Fit_fout2c3d20221101p1-8.txt File generation date: 20240810T214058.0Z 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_20240502_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: 20240502 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 20240502T162721.6Z 8888.685667 357 1 49.43 2 25.93 167.30 81.84 239.96 0.00 1 0.00 1 0 17 1.512e-02 1.079e-02 5.431e-03 2.626e-03 1.801154e-01 1.376480e-03 2.120135e-03 -6.000000e+00 9.066506e-03 230.10 -2.00 3.51 -2.00 316.43 0.00e+00 9.918022e-04 1.585031e-04 2.110814e-04 -6.000000e+00 3.984415e-04 282.21 -2.00 20.00 -2.00 315.70 0.00e+00 1.112 0.000 302.00 328.00 3 5.5791e+00 3.6014e-03 1.4492e-02 -6.0000e+00 2.2628e-02 5.3040e-02 4.0325e-03 9.0944e-03 -6.0000e+00 2.4554e-02 -5.7702e-03 2.3100e-03 4.4214e-03 -6.0000e+00 1.4603e-02 -7.1217e-03 1.0347e-03 1.2991e-03 -6.0000e+00 6.0251e-03 5.3721e-04 1.3686e-03 8.3959e-05 1.5652e-05 -6.0000e+00 4.5929e-04 6.2258e-02 -3.7323e-06 12 8 8 10 0 0 99.98 23.05 0.35 0.06226 0.07254 22 5 1 5 0 2246.270 26.41 20.00 23.05 22.94 24.4 1022.49 620 346 1813 -2548 -2964 -1219 1450 2991 -1726 -3985 -4787 -3529 711 1382 771 -1145 1941 1303 1568 914 1102 -540 77 2229 2184 -126 -1739 -1594 -1180 -281 1299 439 833 -3504 -4594 -3987 -2319 -471 51 -1123 -962 -315 117 11 353 1305 -36 -766 -1626 -14 661 1156 858 1086 537 1785 662 -346 -744 494 1376 2236 2751 1871 -248 -1067 -1937 582 2738 880 277 1116 570 1203 -651 -1547 -2123 -2420 -1828 -2616 -2585 -3121 -2947 -1079 252 176 1011 1295 1326 769 265 -484 -705 252 -142 67 536 769 -267 -1010 -1725 -1369 -196 -244 -1849 -1694 -1124 -770 828 1205 1587 709 428 -92 189 -39 37 13 480 392 142 629 1016 869 572 -357 -488 865 -368 -832 -1047 -826 -325 340 500 177 732 408 314 91 -616 -985 -509 127 75 376 -509 -541 -212 261 589 -381 -911 -1096 -827 176 381 235 -376 636 441 543 326 395 -196 28 831 848 -50 -682 -589 -410 -95 450 163 320 -1387 -1762 -1529 -967 -227 28 -710 -650 -219 82 8 247 890 -24 -500 -1045 -9 436 802 625 812 412 1373 517 -271 -577 382 1100 1894 2460 1726 -225 -899 -1527 446 2222 802 272 1111 564 1130 -576 -1244 -1569 -1744 -1384 -2211 -2410 -3156 -3146 -1194 293 219 1304 1691 1705 948 303 -504 -682 239 -143 74 641 986 -357 -1318 -2109 -1563 -219 -286 -2353 -2272 -1561 -1109 1231 1867 2509 1114 638 -127 240 -48 45 17 662 570 211 915 1423 1167 733 -437 -580 1029 -468 -1121 -1455 -1164 -467 507 783 290 1221 692 532 151 -999 -1557 -803 SS 20240502T163650.6Z 8888.692253 360 1 3.45 2 25.62 172.50 83.32 241.61 0.00 1 0.00 1 0 17 1.532e-02 1.201e-02 5.464e-03 3.667e-03 1.814000e-01 1.995777e-03 2.199831e-03 -6.000000e+00 9.350196e-03 230.10 -2.00 3.51 -2.00 315.04 0.00e+00 7.654524e-04 1.710757e-04 1.111019e-04 -6.000000e+00 4.064447e-04 282.21 -2.00 20.00 -2.00 314.45 0.00e+00 1.109 0.000 302.00 328.00 3 4.2645e+00 5.1304e-03 1.4601e-02 -6.0000e+00 2.3349e-02 5.7217e-02 5.6647e-03 9.3014e-03 -6.0000e+00 2.5189e-02 -1.1782e-02 3.2497e-03 4.5200e-03 -6.0000e+00 1.4973e-02 -3.9148e-03 1.4318e-03 1.2736e-03 -6.0000e+00 6.3494e-03 1.9914e-03 -3.7123e-04 1.1422e-04 1.8677e-05 -6.0000e+00 4.6673e-04 6.5418e-02 -1.9709e-04 12 9 9 12 1 1 999.00 23.09 0.48 0.06542 0.06263 2 10 1 5 0 1147.380 26.51 20.00 23.09 23.13 24.5 1023.48 1260 1460 -167 -3246 -3951 -1615 -1981 1338 -921 -3851 -3126 -2328 670 1297 1605 -101 -16 1418 2469 1504 410 973 921 2439 2265 982 -1817 -942 -376 522 2670 2286 464 -4696 -4622 -3834 -2582 -1521 -50 -354 -642 -124 12 -94 1129 3 -555 -976 -131 423 1765 1536 920 496 416 554 -30 -778 -451 267 1918 1922 2179 1914 -1104 -1373 -1344 -326 2348 827 1159 1228 989 1585 -120 -1251 -1861 -2725 -1490 -1908 -2169 -2916 -3087 -1882 -410 672 926 950 1307 1300 889 -551 -371 500 246 -852 812 791 189 -265 -1800 -2188 -868 -310 -2165 -1772 -1236 -588 1224 1505 1302 968 624 215 599 -93 517 285 631 384 471 335 1260 777 612 -677 -294 189 108 -580 -1071 -691 -406 192 181 -40 455 800 481 -404 -633 -1290 900000 388 470 -53 -1073 -1197 -462 -607 440 -332 -1327 -1061 -811 249 538 729 -49 -7 662 1171 737 204 480 461 1254 1215 538 -988 -478 -194 261 1360 1149 247 -2591 -2442 -2020 -1484 -944 -36 -265 -515 -103 10 -79 934 2 -446 -760 -99 319 1369 1262 796 444 356 481 -26 -681 -389 230 1698 1817 2180 1851 -1062 -1295 -1174 -300 2128 839 1178 1280 1021 1557 -118 -1120 -1631 -2339 -1333 -1779 -2237 -3080 -3455 -2074 -475 820 1119 1167 1577 1580 1001 -603 -399 527 259 -988 957 1002 235 -340 -2184 -2496 -1023 -360 -2731 -2226 -1610 -791 1696 2070 1838 1353 872 279 752 -112 629 365 814 524 654 459 1652 1035 776 -825 -365 237 135 -770 -1395 -911 -547 268 253 -59 677 1203 724 -602 -914 -1822 900000 SS 20240502T165035.2Z 8888.701796 367 1 40.53 2 25.45 180.17 85.51 243.96 0.00 1 0.00 1 0 25 1.426e-02 1.061e-02 8.077e-04 4.603e-04 1.778637e-01 2.432386e-04 2.081557e-03 -6.000000e+00 8.555479e-03 230.10 -2.00 3.51 -2.00 315.78 0.00e+00 8.451814e-04 2.457538e-05 1.322618e-04 -6.000000e+00 3.759148e-04 282.21 -2.00 20.00 -2.00 315.10 0.00e+00 1.107 0.000 302.00 328.00 3 2.6796e+00 6.3091e-04 1.4379e-02 -6.0000e+00 2.1353e-02 3.3706e-02 7.0378e-04 8.9906e-03 -6.0000e+00 2.3169e-02 -5.3953e-03 4.0193e-04 4.3522e-03 -6.0000e+00 1.3780e-02 -6.8139e-03 1.7538e-04 1.2520e-03 -6.0000e+00 5.6862e-03 9.9220e-03 1.1260e-03 1.4547e-05 1.5709e-05 -6.0000e+00 4.3333e-04 6.2220e-02 3.5900e-05 12 9 9 12 1 1 99.98 23.15 0.37 0.06222 0.07068 253 70 1 5 0 159.520 26.51 20.01 23.15 24.35 24.6 1031.87 2077 84 -930 -3732 -2963 -1861 226 1239 -794 -3555 -4357 -1907 -526 436 659 -242 252 1459 1850 2023 693 1011 1720 1982 1698 621 -939 -886 -66 365 1884 1653 416 -3938 -5088 -3735 -2548 -341 -141 -1027 -943 -292 -19 -2 730 82 -289 -502 -730 381 1114 1032 1114 932 457 1259 308 -279 -7 556 1555 2296 2449 1627 -473 -1272 -963 7 2202 1225 635 1110 856 1026 -166 -1191 -1985 -2303 -1248 -2091 -2504 -2732 -2938 -1396 -328 244 943 971 1270 978 462 -524 -929 188 -26 -75 572 938 16 -781 -1394 -1565 -408 -381 -1844 -1896 -1048 -749 782 1265 1087 634 374 60 -33 223 313 319 811 171 411 494 1020 728 1021 -330 -61 956 71 -356 -940 -1048 -194 143 274 36 636 624 327 -85 -393 -1231 -611 517 22 -244 -930 -667 -400 51 305 -214 -999 -1225 -541 -162 149 247 -97 103 605 713 797 279 404 760 828 742 277 -410 -401 -28 151 797 746 197 -1927 -2414 -1756 -1188 -183 -88 -725 -713 -227 -15 -2 570 64 -218 -366 -521 271 819 802 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