File name: Pandora64s1_NewHavenCT_20230416_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240224T095742.3Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 64 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora64_OF_v3d20190516.txt Instrument calibration file used: Pandora64s1_CF_v4d20190911.txt Level 1 file used: Pandora64s1_NewHavenCT_20230416_L1_smca1c4d20190911p1-8.txt Full location name: New Haven - Criscuolo Park CTDEEP (USEPA AQS ID 34-017-0006) Short location name: NewHavenCT Country of location: USA Location latitude [deg]: 41.3014 Location longitude [deg]: -72.9029 Location altitude [m]: 4 Local noon date: 20230416 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: Mod WL cal slit func 9 First and last pixel inside fitting window: 249 390 Nominal wavelengths inside fitting window [nm]: 305.1279 305.2688 305.4097 305.5506 305.6915 305.8324 305.9732 306.1141 306.2549 306.3958 306.5366 306.6774 306.8182 306.9590 307.0997 307.2405 307.3812 307.5220 307.6627 307.8034 307.9441 308.0848 308.2255 308.3662 308.5068 308.6475 308.7881 308.9287 309.0693 309.2099 309.3505 309.4911 309.6316 309.7722 309.9127 310.0533 310.1938 310.3343 310.4748 310.6153 310.7557 310.8962 311.0366 311.1771 311.3175 311.4579 311.5983 311.7387 311.8791 312.0195 312.1598 312.3002 312.4405 312.5808 312.7211 312.8614 313.0017 313.1420 313.2822 313.4225 313.5627 313.7030 313.8432 313.9834 314.1236 314.2638 314.4039 314.5441 314.6842 314.8244 314.9645 315.1046 315.2447 315.3848 315.5249 315.6649 315.8050 315.9450 316.0851 316.2251 316.3651 316.5051 316.6451 316.7850 316.9250 317.0649 317.2049 317.3448 317.4847 317.6246 317.7645 317.9044 318.0442 318.1841 318.3239 318.4638 318.6036 318.7434 318.8832 319.0230 319.1628 319.3025 319.4423 319.5820 319.7217 319.8614 320.0011 320.1408 320.2805 320.4202 320.5598 320.6995 320.8391 320.9787 321.1183 321.2579 321.3975 321.5371 321.6766 321.8162 321.9557 322.0953 322.2348 322.3743 322.5138 322.6532 322.7927 322.9322 323.0716 323.2110 323.3504 323.4899 323.6292 323.7686 323.9080 324.0474 324.1867 324.3260 324.4654 324.6047 324.7440 324.8833 --------------------------------------------------------------------------------------- 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 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: 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 20230416T165224.6Z 8506.703063 317 1 5.41 2 31.10 180.46 65.77 225.21 0.00 1 0.00 1 0 17 1.625e-02 1.118e-02 7.324e-03 5.294e-03 1.626264e-01 2.881506e-03 2.020587e-03 -6.000000e+00 9.860429e-03 228.64 -2.00 3.52 -2.00 314.66 0.00e+00 5.050389e-04 2.296753e-04 3.742856e-05 -6.000000e+00 4.289386e-04 280.23 -2.00 20.00 -2.00 314.14 0.00e+00 1.167 0.000 302.00 328.00 3 5.4055e+00 7.3725e-03 1.4474e-02 -6.0000e+00 2.4563e-02 4.2637e-02 8.1400e-03 8.4701e-03 -6.0000e+00 2.6545e-02 -3.4350e-03 4.6605e-03 4.1443e-03 -6.0000e+00 1.5776e-02 -8.3822e-05 2.0277e-03 1.1787e-03 -6.0000e+00 6.6850e-03 6.2973e-04 -3.1784e-04 1.6207e-04 1.7258e-05 -6.0000e+00 4.8312e-04 -8.7192e-03 -6.4851e-06 12 9 9 12 1 1 999.00 21.61 -0.15 -0.00872 -0.01111 1 4 1 5 0 2614.880 26.11 20.00 21.61 23.62 37.6 1030.88 -546 1245 498 -1406 -10556 -1363 -1101 1812 393 2800 -5569 -1804 -1400 3558 1265 1531 23 1836 -450 2174 1164 820 853 8 957 2569 1279 -372 -733 -946 1431 -435 2797 147 -4523 -1690 -2348 -705 568 116 -843 -1844 -580 -813 -1253 76 -283 -410 -1393 -576 1901 381 -110 436 978 286 1534 -105 -468 652 10 1373 1940 2396 2179 -1965 -318 -1918 824 1808 1209 453 725 -160 627 -1223 -267 -3941 -1009 -42 -709 -562 -1984 -1979 149 -1052 505 270 1016 969 426 -12 -1509 -247 -161 -369 -811 1983 782 -423 90 -1594 -2596 -361 420 -724 -670 -471 -508 871 1161 564 268 -67 -951 -463 -24 -604 1375 1367 -186 -279 771 900 968 686 -993 393 579 1007 271 -564 -255 -110 407 182 -323 105 -243 -385 -1062 -237 -199 458 192 -495 -3689 -453 -369 650 154 1088 -2176 -709 -604 1611 617 783 12 976 -239 1158 627 438 469 5 561 1506 736 -201 -390 -500 769 -247 1562 82 -2584 -973 -1450 -476 412 92 -708 -1557 -494 -690 -1062 65 -234 -329 -1133 -468 1527 326 -95 389 876 262 1399 -97 -425 593 9 1335 1914 2422 2168 -1852 -289 -1743 766 1785 1271 477 749 -166 611 -1131 -233 -3444 -914 -40 -724 -602 -2186 -2227 172 -1263 623 340 1255 1164 487 -13 -1575 -253 -175 -410 -957 2464 973 -527 105 -1827 -2960 -430 516 -908 -858 -624 -683 1209 1602 787 363 -87 -1175 -563 -28 -761 1775 1803 -253 -373 1022 1128 1192 832 -1171 468 706 1275 348 -738 -340 -148 563 261 -463 153 -355 -546 -1521 -327 SS 20230416T165716.7Z 8506.706443 320 1 48.36 2 31.12 182.78 66.39 226.28 0.00 1 0.00 1 0 17 1.063e-02 8.268e-03 5.087e-04 3.759e-04 1.572016e-01 2.047550e-04 1.932363e-03 -6.000000e+00 6.449322e-03 228.64 -2.00 3.52 -2.00 314.54 0.00e+00 3.694670e-04 1.600440e-05 1.531916e-05 -6.000000e+00 2.805297e-04 280.23 -2.00 20.00 -2.00 314.04 0.00e+00 1.168 0.000 302.00 328.00 3 3.1138e+00 5.2313e-04 1.4279e-02 -6.0000e+00 1.6066e-02 1.9725e-02 5.7740e-04 8.1424e-03 -6.0000e+00 1.7360e-02 5.1596e-04 3.3104e-04 3.9853e-03 -6.0000e+00 1.0318e-02 -3.3430e-03 1.4349e-04 1.1328e-03 -6.0000e+00 4.3732e-03 6.3563e-03 1.7210e-05 1.1516e-05 1.6516e-05 -6.0000e+00 3.1582e-04 -8.7715e-03 6.0945e-05 11 8 0 10 0 0 99.99 21.62 0.19 -0.00877 -0.00864 260 63 1 5 0 185.960 26.11 19.94 21.62 23.57 37.6 1030.12 1213 -746 870 -2499 -4269 -1277 -59 1130 1603 596 -2676 -1515 25 -97 1055 716 -770 706 563 1758 1299 -204 867 895 491 1049 574 -863 -585 236 1649 186 2495 273 -4165 -2060 -1497 -1032 174 108 -1125 -1244 -502 -1030 -647 59 -812 -211 -820 -399 1132 1023 714 1382 176 769 1046 651 154 429 450 1229 1067 2097 637 -1390 -431 -1588 449 1607 286 406 -133 625 314 -494 -639 -1919 -511 -104 -1103 -662 -1945 -2038 -508 -443 -28 57 792 414 307 397 -826 -41 910 395 27 1145 759 -451 -323 -1337 -1544 158 556 -1307 -248 -733 -351 190 738 380 192 90 -242 -153 483 -235 580 470 114 -173 633 46 869 979 -729 517 938 352 543 -463 -675 -410 468 -52 -556 256 123 -464 -21 -703 463 -299 339 -906 -1546 -446 -22 417 634 242 -1088 -635 11 -45 533 382 -421 392 298 947 704 -111 480 515 292 631 336 -473 -322 127 915 108 1406 154 -2450 -1232 -923 -689 127 88 -930 -1061 -435 -890 -554 49 -662 -175 -664 -323 951 851 619 1239 161 712 974 602 141 398 412 1193 1040 2081 641 -1298 -398 -1461 418 1636 297 433 -140 628 307 -462 -551 -1712 -453 -96 -1128 -696 -2166 -2280 -603 -533 -35 70 989 490 351 434 -841 -44 962 434 32 1405 952 -550 -389 -1525 -1740 186 671 -1669 -315 -969 -464 260 1031 521 260 117 -292 -186 593 -291 732 626 154 -231 818 59 1059 1190 -863 620 1127 444 708 -589 -880 -556 639 -74 -811 363 174 -670 -29 -969 SS 20230416T170143.5Z 8506.709531 323 1 48.20 2 31.18 184.89 66.96 227.25 0.00 1 0.00 1 0 17 1.116e-02 8.273e-03 8.415e-04 5.932e-04 1.577505e-01 3.226116e-04 1.930888e-03 -6.000000e+00 6.776297e-03 228.64 -2.00 3.52 -2.00 314.78 0.00e+00 3.672441e-04 2.611449e-05 1.914252e-05 -6.000000e+00 2.947489e-04 280.23 -2.00 20.00 -2.00 314.24 0.00e+00 1.168 0.000 302.00 328.00 3 3.9287e+00 8.2664e-04 1.4290e-02 -6.0000e+00 1.6880e-02 2.8159e-02 9.1206e-04 8.1471e-03 -6.0000e+00 1.8240e-02 2.7724e-04 5.2204e-04 3.9865e-03 -6.0000e+00 1.0841e-02 -3.3780e-03 2.2801e-04 1.1337e-03 -6.0000e+00 4.5950e-03 2.8006e-03 1.1742e-04 1.8238e-05 1.6284e-05 -6.0000e+00 3.3181e-04 -8.6632e-03 7.2839e-05 11 8 0 10 0 0 99.99 21.59 0.23 -0.00866 -0.00778 181 44 1 5 0 266.230 26.11 20.01 21.59 23.30 37.7 1029.45 1119 -547 504 -2864 -5395 -1157 264 1101 1852 413 -2761 -1658 106 -33 1150 706 -884 799 526 1709 1360 -283 1077 815 364 952 608 -976 -576 81 1828 -128 2433 177 -4217 -2203 -1313 -1028 176 -3 -1061 -1312 -504 -948 -635 21 -715 -215 -814 -449 1004 1030 693 1443 99 740 1116 535 196 560 471 1317 1042 1983 655 -1450 -481 -1519 523 1639 358 431 -190 761 325 -616 -726 -2047 -681 -140 -1054 -699 -2008 -1955 -512 -488 11 93 821 488 263 337 -829 -118 809 424 -133 1199 681 -364 -274 -1280 -1672 153 432 -1336 -223 -617 -283 273 860 421 184 131 -246 -166 501 -237 561 424 27 -259 714 -24 874 869 -806 469 937 294 593 -578 -674 -451 453 6 -468 360 181 -544 52 -777 399 -204 184 -972 -1701 -347 83 379 682 157 -1047 -649 45 -14 538 349 -448 411 276 914 731 -153 591 466 215 568 353 -531 -294 41 937 -69 1360 99 -2295 -1220 -801 -674 125 -2 -846 -1081 -421 -790 -525 17 -599 -173 -640 -354 820 882 580 1247 87 660 1001 478 173 500 439 1299 1023 1983 630 -1376 -428 -1344 494 1596 374 462 -202 767 323 -555 -642 -1771 -619 -132 -1029 -738 -2249 -2178 -606 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