File name: Pandora55s1_QueensNY_20240924_L2Fit_fout2c18d20230426p1-8.txt File generation date: 20240925T045705.8Z Data description: Level 2 spectral fitting results file Data file version: fout2c18p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora55_OF_v5d20190723.txt Instrument calibration file used: Pandora55s1_CF_v18d20230426.txt Level 1 file used: Pandora55s1_QueensNY_20240924_L1_smca1c18d20230426p1-8.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: 20240924 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: Based on session 17 for new VP from 20230426 First and last pixel inside fitting window: 261 404 Nominal wavelengths inside fitting window [nm]: 305.0111 305.1511 305.2911 305.4311 305.5710 305.7110 305.8510 305.9909 306.1308 306.2708 306.4107 306.5506 306.6905 306.8303 306.9702 307.1101 307.2499 307.3897 307.5296 307.6694 307.8092 307.9490 308.0888 308.2286 308.3683 308.5081 308.6478 308.7876 308.9273 309.0670 309.2067 309.3464 309.4861 309.6257 309.7654 309.9050 310.0447 310.1843 310.3239 310.4635 310.6031 310.7427 310.8823 311.0219 311.1614 311.3010 311.4405 311.5800 311.7195 311.8590 311.9985 312.1380 312.2775 312.4169 312.5564 312.6958 312.8352 312.9747 313.1141 313.2535 313.3929 313.5322 313.6716 313.8110 313.9503 314.0896 314.2290 314.3683 314.5076 314.6469 314.7861 314.9254 315.0647 315.2039 315.3432 315.4824 315.6216 315.7608 315.9000 316.0392 316.1784 316.3175 316.4567 316.5958 316.7350 316.8741 317.0132 317.1523 317.2914 317.4305 317.5695 317.7086 317.8476 317.9867 318.1257 318.2647 318.4037 318.5427 318.6817 318.8207 318.9596 319.0986 319.2375 319.3765 319.5154 319.6543 319.7932 319.9321 320.0710 320.2098 320.3487 320.4875 320.6264 320.7652 320.9040 321.0428 321.1816 321.3204 321.4592 321.5979 321.7367 321.8754 322.0141 322.1529 322.2916 322.4303 322.5689 322.7076 322.8463 322.9849 323.1236 323.2622 323.4008 323.5394 323.6780 323.8166 323.9552 324.0938 324.2323 324.3709 324.5094 324.6479 324.7864 324.9249 --------------------------------------------------------------------------------------- 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 20240924T134813.4Z 9033.575155 326 1 50.35 2 58.05 123.98 41.13 268.14 0.00 1 0.00 1 0 25 1.778e-02 7.047e-03 4.469e-03 1.539e-03 2.471076e-01 7.989566e-04 2.998994e-03 -6.000000e+00 1.056857e-02 228.16 -2.00 3.51 -2.00 317.13 0.00e+00 -1.483991e-04 1.123130e-04 7.270452e-05 -6.000000e+00 4.746537e-04 286.76 -2.00 20.00 -2.00 316.33 0.00e+00 1.883 0.000 302.00 328.00 3 4.2811e+00 2.1038e-03 2.2747e-02 -6.0000e+00 2.6221e-02 1.5003e-02 2.3630e-03 1.2820e-02 -6.0000e+00 2.8374e-02 1.5225e-02 1.3946e-03 6.2797e-03 -6.0000e+00 1.6957e-02 -9.7196e-03 6.7106e-04 1.7472e-03 -6.0000e+00 7.1561e-03 8.2914e-04 -2.9956e-04 4.7881e-05 2.2703e-05 -6.0000e+00 5.3049e-04 -1.2798e-03 0.0000e+00 11 8 0 10 0 0 100.00 22.51 0.33 -0.00128 -0.00353 177 33 1 5 0 284.410 26.21 19.96 22.51 24.92 37.6 1042.73 -2198 -6943 3717 -9139 -1068 1193 1044 9911 3200 836 -3044 364 -3157 991 3408 -495 -2951 427 2637 772 -2070 1424 1993 -1601 1212 -714 3088 -2189 -518 -1021 977 2518 1129 -1706 -1288 3492 -1143 -238 658 378 -1871 -991 -1818 -1483 -1186 236 -1628 -365 -85 788 628 -52 119 1081 1371 662 1173 376 1279 890 678 2031 885 125 -171 -894 408 87 1307 1292 -73 -86 43 -852 -102 -298 600 758 1448 369 -128 -216 -1480 -1079 -1310 -845 -975 -478 -712 -717 -373 181 360 1630 1316 1399 632 705 -202 -682 -348 -722 114 1122 385 -789 -446 -562 -192 359 55 -537 -238 -236 -256 402 860 885 818 -118 -919 -421 -76 -28 161 15 226 1188 835 374 423 354 319 332 280 -278 -282 107 -298 -503 -183 -310 -145 73 -261 -950 480 -1293 -130 134 119 1135 433 123 -473 56 -531 180 678 -112 -726 106 662 204 -573 387 543 -464 361 -226 957 -693 -153 -293 277 745 363 -586 -438 1103 -383 -88 277 183 -1024 -573 -1095 -904 -724 143 -990 -216 -50 451 366 -32 77 722 947 470 848 276 929 640 491 1507 701 105 -148 -773 329 67 996 1048 -65 -81 41 -824 -95 -264 489 576 1072 286 -109 -199 -1472 -1121 -1422 -958 -1160 -589 -894 -900 -455 209 388 1647 1314 1448 704 844 -259 -911 -460 -919 137 1300 458 -992 -584 -760 -268 516 82 -834 -372 -361 -373 554 1137 1161 1101 -167 -1365 -637 -114 -42 231 20 304 1537 1084 503 596 516 475 502 434 -447 -469 181 -515 -874 -315 -524 -239 119 SS 20240924T140532.0Z 9033.587176 336 1 51.60 2 55.40 128.07 44.32 270.88 0.00 1 0.00 1 0 17 8.854e-02 2.127e-02 1.285e-02 4.498e-03 2.317445e-01 2.342161e-03 2.781373e-03 -6.000000e+00 5.262384e-02 228.16 -2.00 3.51 -2.00 317.00 0.00e+00 -1.594841e-03 3.161066e-04 1.071468e-04 -6.000000e+00 2.363700e-03 286.76 -2.00 20.00 -2.00 316.19 0.00e+00 1.756 0.000 302.00 328.00 3 6.3904e+00 6.1465e-03 2.1223e-02 -6.0000e+00 1.3056e-01 3.4279e-02 6.9017e-03 1.2125e-02 -6.0000e+00 1.4129e-01 5.7951e-03 4.0501e-03 5.8731e-03 -6.0000e+00 8.4439e-02 -1.5858e-04 1.9225e-03 2.0914e-03 -6.0000e+00 3.5625e-02 1.1661e-04 -8.7437e-04 1.4064e-04 2.4036e-05 -6.0000e+00 2.6420e-03 1.0864e-04 0.0000e+00 12 9 8 11 32 0 99.97 22.51 0.79 0.00011 -0.00646 20 4 1 5 0 2579.340 26.21 19.98 22.51 25.18 37.7 1043.55 -9720 -21585 70111 -22006 6001 13832 -9678 36261 8132 -1657 -8816 -4075 -13092 819 24425 -1508 -12660 4395 24533 11947 -3103 4698 1792 -13271 2279 -1817 6767 -579 -5706 -5877 423 6369 -3253 -2481 -2350 16552 -5286 -8377 3746 5148 -3176 4623 -3507 -1912 503 7820 -4795 4714 1791 1621 -1068 -1840 -2966 6343 -1472 1196 1267 3180 4180 -569 -1820 3994 239 1635 1677 -4705 3191 -3287 89 386 -787 1090 2568 -2712 3824 -2314 1043 3725 -1170 -1930 -808 2768 -3099 -130 -2779 -1063 -2904 81 -1906 180 -311 -1082 279 -62 247 -496 -1649 -171 752 86 -594 -494 204 1973 1258 -376 -42 -1128 -421 2539 1512 -1461 1393 -32 -1631 -147 465 1568 -464 -643 -2696 185 1818 3185 73 342 -1744 127 -624 -361 1324 1118 1288 573 1415 -325 197 535 140 -1148 -583 -1035 -69 -1090 -1401 -3807 5484 -3918 763 1529 -1350 3616 1175 -281 -1625 -727 -2671 163 4368 -373 -3653 1122 5364 3022 -923 1318 519 -4569 721 -623 2182 -193 -1887 -1848 125 1876 -1118 -882 -828 4750 -1880 -3383 1581 2483 -1828 2658 -2233 -1222 314 4585 -3080 2738 1041 935 -638 -1158 -1988 4113 -1057 860 934 2324 3022 -422 -1370 2953 193 1379 1457 -4249 2539 -2612 68 315 -705 1026 2452 -2696 3498 -2098 849 2754 -874 -1505 -682 2476 -3117 -134 -3062 -1212 -3545 101 -2451 227 -382 -1271 302 -63 246 -515 -1857 -205 961 115 -790 -627 243 2261 1484 -470 -55 -1542 -591 3615 2258 -2299 2168 -49 -2409 -203 610 2024 -624 -907 -4035 278 2694 4588 105 472 -2355 164 -805 -480 1824 1601 1878 852 2149 -517 324 899 239 -1993 -999 -1744 -113 -1764 SS 20240924T141450.3Z 9033.593638 342 1 20.19 2 54.04 130.38 46.03 272.30 0.00 1 0.00 1 0 25 1.120e-02 6.902e-03 2.563e-03 1.414e-03 2.238618e-01 7.424801e-04 2.742922e-03 -6.000000e+00 6.654470e-03 228.15 -2.00 3.51 -2.00 315.80 0.00e+00 -9.208341e-05 7.664505e-05 3.507801e-05 -6.000000e+00 2.989206e-04 286.76 -2.00 20.00 -2.00 315.07 0.00e+00 1.698 0.000 302.00 328.00 3 3.7881e+00 1.9177e-03 2.0528e-02 -6.0000e+00 1.6510e-02 7.6984e-03 2.1359e-03 1.1567e-02 -6.0000e+00 1.7867e-02 1.3899e-03 1.2241e-03 5.6759e-03 -6.0000e+00 1.0678e-02 -1.8853e-03 5.5202e-04 1.5808e-03 -6.0000e+00 4.5045e-03 1.7061e-03 -5.3524e-04 4.3306e-05 2.2251e-05 -6.0000e+00 3.3413e-04 8.4444e-04 0.0000e+00 12 9 1 12 9 1 98.09 22.50 0.16 0.00084 -0.00318 19 9 1 5 0 1009.140 26.21 19.99 22.50 25.00 37.7 1042.62 -1568 -3876 1760 -5998 -1111 1360 -587 4302 765 -994 -1852 1224 -1260 1564 1032 259 -1607 -1370 1031 588 -36 378 1637 -324 740 -331 1136 -752 -105 674 1274 2072 1576 -681 -1264 1972 -659 608 530 21 -1686 -542 -1598 -1292 -662 -544 -1193 -663 -423 359 1056 151 863 684 1048 817 1076 244 751 759 1251 1644 917 86 -730 -185 118 428 1311 896 -71 -151 -427 -815 -308 -563 262 798 1316 245 -197 -735 -1512 -1225 -1231 -953 -1048 -439 -818 -472 -244 153 72 1214 1562 1168 563 678 -250 -504 -385 -610 -60 762 254 -624 -243 -778 125 373 26 -404 -348 -26 -163 598 787 1061 529 -97 -768 -427 -71 -370 350 307 322 1160 910 477 621 42 291 134 185 -71 -158 73 -399 -579 -351 -265 -273 43 -349 -954 425 -1504 -251 284 -125 948 190 -264 -502 326 -359 476 347 94 -618 -539 408 240 -15 158 681 -140 330 -154 526 -344 -46 284 534 901 723 -327 -605 900 -310 307 300 13 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