File name: Pandora55s1_QueensNY_20220222_L2Fit_fout2c19d20211111p1-8.txt File generation date: 20250606T112922.4Z Data description: Level 2 spectral fitting results file Data file version: fout2c19p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora55_OF_v4d20190723.txt Instrument calibration file used: Pandora55s1_CF_v19d20211111.txt Level 1 file used: Pandora55s1_QueensNY_20220222_L1_smca1c19d20211111p1-8.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: 20220222 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]: 305.0379 305.1778 305.3178 305.4578 305.5977 305.7376 305.8776 306.0175 306.1574 306.2973 306.4372 306.5770 306.7169 306.8567 306.9966 307.1364 307.2762 307.4160 307.5558 307.6956 307.8354 307.9752 308.1149 308.2547 308.3944 308.5341 308.6738 308.8135 308.9532 309.0929 309.2326 309.3723 309.5119 309.6515 309.7912 309.9308 310.0704 310.2100 310.3496 310.4892 310.6287 310.7683 310.9079 311.0474 311.1869 311.3264 311.4659 311.6054 311.7449 311.8844 312.0239 312.1633 312.3028 312.4422 312.5816 312.7210 312.8604 312.9998 313.1392 313.2786 313.4179 313.5573 313.6966 313.8360 313.9753 314.1146 314.2539 314.3932 314.5324 314.6717 314.8110 314.9502 315.0895 315.2287 315.3679 315.5071 315.6463 315.7855 315.9246 316.0638 316.2030 316.3421 316.4812 316.6204 316.7595 316.8986 317.0377 317.1767 317.3158 317.4549 317.5939 317.7329 317.8720 318.0110 318.1500 318.2890 318.4280 318.5669 318.7059 318.8449 318.9838 319.1227 319.2617 319.4006 319.5395 319.6784 319.8172 319.9561 320.0950 320.2338 320.3726 320.5115 320.6503 320.7891 320.9279 321.0667 321.2054 321.3442 321.4830 321.6217 321.7604 321.8991 322.0379 322.1766 322.3152 322.4539 322.5926 322.7312 322.8699 323.0085 323.1471 323.2857 323.4243 323.5629 323.7015 323.8401 323.9786 324.1172 324.2557 324.3943 324.5328 324.6713 324.8098 324.9483 --------------------------------------------------------------------------------------- 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 20220222T135319.8Z 8088.578701 312 1 49.33 2 67.87 126.82 82.12 239.99 0.00 1 0.00 1 0 17 9.586e-02 1.083e-02 1.455e-02 2.346e-03 3.425496e-01 1.202563e-03 4.038105e-03 -6.000000e+00 5.627441e-02 225.23 -2.00 3.51 -2.00 318.14 0.00e+00 -9.118252e-05 2.185434e-04 3.000388e-04 -6.000000e+00 2.444953e-03 275.77 -2.00 20.00 -2.00 317.53 0.00e+00 2.632 0.000 302.00 328.00 3 4.2710e+00 3.2080e-03 3.1370e-02 -6.0000e+00 1.3919e-01 2.4229e-02 3.6362e-03 1.7423e-02 -6.0000e+00 1.5131e-01 7.8174e-05 2.3780e-03 8.6182e-03 -6.0000e+00 9.0026e-02 -4.6343e-03 1.2197e-03 2.4917e-03 -6.0000e+00 3.7734e-02 3.5401e-04 1.2502e-03 7.2779e-05 2.9754e-05 -6.0000e+00 2.8581e-03 -3.9718e-03 4.0723e-04 12 9 8 11 8 0 99.99 22.70 0.45 -0.00397 0.00542 26 5 1 5 0 1896.740 25.58 19.99 22.70 10.53 30.5 1048.07 -4074 13706 74581 -28227 15769 20010 13044 52589 2335 -1987 -22534 -7650 -16053 -6517 17498 -289 -15683 1927 10303 8679 8101 -3092 4695 -10581 -1522 -3939 11556 -1994 -2166 -3383 307 3076 281 -8256 -355 13505 -2176 -2826 3497 2672 -3395 -235 -4293 -2180 -172 2023 -2629 2075 766 1787 -74 -1345 -1346 2971 1026 1245 3215 1256 2260 651 1624 2951 678 -1325 583 -1756 1006 -1152 911 1092 -839 -635 251 -1110 1744 67 931 2696 576 244 -1653 248 -1082 -718 -2044 -798 -1432 -275 -1144 -160 -257 34 487 841 756 1028 357 144 -363 -737 -575 -493 421 1733 246 -245 -207 -788 149 1096 268 -1003 -293 -340 -474 441 814 1175 306 -360 -1073 -449 -191 630 -168 -218 251 1025 323 -135 595 584 788 607 435 -109 364 -53 -354 -443 -450 -591 72 -295 -227 726 2344 -2256 784 911 655 2023 161 -152 -2150 -662 -1660 -711 1763 -39 -2582 286 1483 1319 1272 -545 784 -2124 -300 -831 2154 -410 -427 -662 60 642 66 -2182 -88 2871 -550 -804 1102 978 -1450 -104 -2040 -1040 -81 942 -1262 952 353 826 -36 -699 -742 1664 609 756 1971 789 1399 404 1008 1880 468 -987 444 -1345 722 -816 645 830 -698 -557 223 -987 1464 54 691 1869 406 182 -1376 221 -1041 -722 -2162 -876 -1648 -325 -1377 -190 -297 37 503 833 752 1075 403 175 -473 -992 -765 -629 507 2016 296 -308 -271 -1066 208 1578 406 -1584 -464 -531 -711 629 1125 1623 437 -536 -1656 -698 -294 945 -248 -313 348 1381 443 -194 893 907 1252 984 725 -188 646 -97 -650 -815 -818 -1051 123 -507 SS 20220222T155954.9Z 8088.666607 385 1 0.71 2 53.20 158.67 104.05 259.57 0.00 1 0.00 1 0 25 1.035e-02 7.293e-03 6.554e-03 4.049e-03 2.130871e-01 2.105413e-03 2.642619e-03 -6.000000e+00 6.063173e-03 225.23 -2.00 3.51 -2.00 315.42 0.00e+00 1.959098e-04 1.944272e-04 5.317452e-05 -6.000000e+00 2.638756e-04 275.77 -2.00 20.00 -2.00 314.89 0.00e+00 1.665 0.000 302.00 328.00 3 1.8705e+00 5.3898e-03 1.9785e-02 -6.0000e+00 1.4996e-02 1.0750e-02 6.0084e-03 1.0878e-02 -6.0000e+00 1.6314e-02 -1.8385e-03 3.4405e-03 5.3934e-03 -6.0000e+00 9.7055e-03 -1.5045e-03 1.5209e-03 1.5341e-03 -6.0000e+00 4.0597e-03 1.2336e-02 -1.4295e-03 1.2413e-04 2.2292e-05 -6.0000e+00 3.0887e-04 -6.7223e-04 -7.8450e-05 12 9 1 12 1 1 999.00 22.70 0.20 -0.00067 -0.01141 2 51 1 5 0 178.020 25.58 20.00 22.70 14.86 30.8 1071.53 -679 -1613 -3904 -5212 -192 -140 182 2772 566 -375 -1787 -456 1893 -1022 1253 -412 -335 562 610 550 -124 406 1551 1180 226 -98 639 -774 498 2179 1510 1321 1312 -1603 -704 1531 261 -103 1555 -48 -1023 -765 -2511 -236 -478 -800 -1382 -271 -507 518 922 639 701 784 662 943 9 59 129 1126 775 1123 915 -158 -1146 -862 260 921 -26 1535 664 -804 -1118 -93 -1112 -303 829 1000 1475 450 301 -141 -1188 -671 -626 -1256 -1089 -672 -625 -475 -372 2 779 1526 1637 696 1049 693 -526 -483 -465 -592 517 437 -82 -470 -593 -840 -92 -173 -16 -577 -559 -58 16 558 408 1048 314 -325 -423 142 -174 -138 483 642 650 1598 1127 647 -131 37 10 -16 195 -506 -70 521 -574 -187 -182 52 -467 -582 -183 -468 -1169 -1531 -51 -35 46 744 167 -116 -562 -143 615 -368 483 -171 -144 244 271 250 -57 188 717 560 112 -50 322 -386 236 992 697 634 658 -837 -361 756 133 -57 942 -32 -738 -572 -1934 -181 -367 -616 -1059 -203 -376 379 680 487 552 636 549 793 8 51 111 950 661 980 831 -150 -1111 -820 235 801 -22 1396 643 -817 -1156 -95 -1117 -290 746 855 1242 394 281 -140 -1237 -721 -693 -1446 -1297 -822 -773 -584 -447 2 849 1590 1688 745 1178 823 -658 -618 -589 -725 606 504 -97 -578 -752 -1094 -122 -236 -22 -829 -804 -82 21 720 512 1309 403 -433 -583 198 -242 -190 646 838 827 1976 1398 828 -174 51 13 -23 276 -740 -104 791 -886 -289 -279 78 -693 -859 SS 20220222T160349.3Z 8088.669320 388 1 1.36 2 52.94 159.82 104.76 260.14 0.00 1 0.00 1 0 17 1.359e-02 8.576e-03 8.978e-03 5.527e-03 2.167420e-01 2.875414e-03 2.679570e-03 -6.000000e+00 7.962207e-03 225.23 -2.00 3.51 -2.00 315.42 0.00e+00 -1.638626e-04 2.655924e-04 3.186958e-05 -6.000000e+00 3.464998e-04 275.77 -2.00 20.00 -2.00 314.89 0.00e+00 1.655 0.000 302.00 328.00 3 2.9886e+00 7.3629e-03 1.9804e-02 -6.0000e+00 1.9693e-02 3.1635e-02 8.2105e-03 1.1042e-02 -6.0000e+00 2.1423e-02 -7.6821e-03 4.6992e-03 5.4758e-03 -6.0000e+00 1.2745e-02 -1.0411e-03 2.0770e-03 1.5513e-03 -6.0000e+00 5.3320e-03 4.0235e-03 -1.0162e-03 1.6893e-04 2.2437e-05 -6.0000e+00 4.0550e-04 -1.2765e-03 -4.2322e-05 12 9 1 12 1 1 999.00 22.70 0.24 -0.00128 -0.00891 1 16 1 5 0 594.500 25.58 20.00 22.70 15.15 30.9 1073.72 -2149 -103 -3924 -4186 -5247 124 -3039 4923 544 -871 3537 -1805 2819 -108 2217 -345 -2250 1240 -1217 2927 -73 1723 354 1053 -652 448 -2719 871 -57 1679 2100 1533 1233 -1005 -1942 947 1324 209 -649 -458 -1844 -529 -1322 -980 -285 582 -584 -1086 -1228 497 522 1414 854 2226 509 403 1627 379 1426 -207 2113 1660 576 -345 242 -465 -50 259 1661 20 -1015 -160 -794 -412 -1280 -1018 -354 1662 484 749 586 -1331 -538 -2107 -758 -1365 -298 -605 -618 -264 -715 514 594 925 272 302 976 729 -17 -965 242 0 362 881 -1261 -638 -258 156 353 -591 -296 -691 -234 -224 88 256 131 1821 -8 326 -454 -181 -132 302 -21 -84 1146 2039 1237 953 346 -240 525 -66 354 -475 576 -333 -813 -581 47 -282 -361 -591 -581 -29 -1167 -1205 -1426 31 -787 1288 159 -269 1064 -569 906 -39 844 -142 -974 536 -545 1305 -34 789 164 498 -323 226 -1406 430 -27 765 961 732 618 -523 -1003 469 667 115 -399 -309 -1342 -398 -1017 -760 -220 446 -447 -819 -913 364 386 1073 674 1794 424 340 1386 326 1214 -176 1791 1447 526 -329 234 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