File name: Pandora55s1_QueensNY_20240512_L2Fit_fout2c17d20220526p1-8.txt File generation date: 20240515T023928.8Z Data description: Level 2 spectral fitting results file Data file version: fout2c17p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora55_OF_v5d20190723.txt Instrument calibration file used: Pandora55s1_CF_v17d20220526.txt Level 1 file used: Pandora55s1_QueensNY_20240512_L1_smca1c17d20220526p1-8.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: 20240512 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: 262 404 Nominal wavelengths inside fitting window [nm]: 305.1320 305.2720 305.4120 305.5520 305.6920 305.8320 305.9719 306.1119 306.2518 306.3917 306.5317 306.6716 306.8115 306.9514 307.0912 307.2311 307.3709 307.5108 307.6506 307.7905 307.9303 308.0701 308.2099 308.3496 308.4894 308.6292 308.7689 308.9087 309.0484 309.1881 309.3278 309.4675 309.6072 309.7469 309.8866 310.0262 310.1659 310.3055 310.4451 310.5847 310.7243 310.8639 311.0035 311.1431 311.2827 311.4222 311.5618 311.7013 311.8408 311.9803 312.1198 312.2593 312.3988 312.5383 312.6777 312.8172 312.9566 313.0960 313.2355 313.3749 313.5143 313.6536 313.7930 313.9324 314.0717 314.2111 314.3504 314.4897 314.6291 314.7684 314.9077 315.0469 315.1862 315.3255 315.4647 315.6040 315.7432 315.8824 316.0216 316.1608 316.3000 316.4392 316.5783 316.7175 316.8566 316.9958 317.1349 317.2740 317.4131 317.5522 317.6913 317.8303 317.9694 318.1085 318.2475 318.3865 318.5255 318.6645 318.8035 318.9425 319.0815 319.2205 319.3594 319.4984 319.6373 319.7762 319.9151 320.0540 320.1929 320.3318 320.4707 320.6095 320.7484 320.8872 321.0260 321.1649 321.3037 321.4425 321.5812 321.7200 321.8588 321.9975 322.1363 322.2750 322.4137 322.5524 322.6911 322.8298 322.9685 323.1072 323.2458 323.3845 323.5231 323.6617 323.8003 323.9389 324.0775 324.2161 324.3547 324.4932 324.6318 324.7703 324.9089 --------------------------------------------------------------------------------------- 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 20240512T171931.0Z 8898.721886 304 1 10.76 2 23.14 197.02 48.71 88.36 0.00 1 0.00 1 0 17 1.322e-02 7.592e-03 4.940e-03 3.019e-03 2.198730e-01 1.613110e-03 2.688415e-03 -6.000000e+00 7.931409e-03 230.95 -2.00 3.51 -2.00 315.47 0.00e+00 -2.373639e-04 1.511907e-04 3.743606e-05 -6.000000e+00 3.490861e-04 283.45 -2.00 20.00 -2.00 314.81 0.00e+00 1.087 0.000 302.00 328.00 3 4.8679e+00 4.1758e-03 1.6000e-02 -6.0000e+00 1.9834e-02 2.4319e-02 4.6325e-03 1.1425e-02 -6.0000e+00 2.1452e-02 -1.8206e-03 2.6472e-03 5.5939e-03 -6.0000e+00 1.2753e-02 1.4298e-04 1.1731e-03 1.5417e-03 -6.0000e+00 5.3524e-03 1.0375e-03 -1.0769e-03 9.2550e-05 2.2197e-05 -6.0000e+00 3.9749e-04 2.3996e-02 0.0000e+00 12 9 1 12 45 1 67.20 22.82 0.30 0.02400 0.01590 3 4 1 5 0 2687.310 26.11 20.00 22.82 18.14 36.6 1063.19 -2762 -2647 -6270 -2314 3897 -69 5488 -1782 -432 -603 -1325 -1028 -2136 3235 -397 -1469 3739 212 2148 133 -13 989 -1475 698 446 -892 282 -752 2314 -295 2480 1638 -1041 -756 3080 -1304 -473 446 589 -1447 -230 -1471 -1284 -1489 -161 -1221 -108 -921 1286 -63 348 454 586 1045 1434 1588 620 1671 993 1418 1821 617 123 74 -885 437 -590 532 112 -65 -124 -513 -984 -359 -30 -69 948 576 -529 -888 -1059 -1536 -823 -1234 -862 -1122 -617 -507 -492 62 7 217 588 1303 1138 937 562 -189 -272 -460 -269 -15 943 -144 -518 -60 -590 359 605 117 -449 237 -54 -377 24 701 259 832 -181 -647 -574 -220 47 207 489 -36 1444 572 612 524 288 574 283 313 -440 188 93 -377 -720 -18 -696 -324 -148 -767 -753 -1790 -599 904 -17 1353 -508 -128 -181 -402 -326 -743 1180 -160 -620 1555 92 946 60 -6 451 -699 338 223 -453 139 -357 1036 -135 1152 803 -534 -384 1486 -657 -255 267 391 -1047 -173 -1139 -1006 -1167 -125 -945 -81 -687 940 -47 266 359 478 871 1212 1359 536 1430 847 1211 1587 565 117 72 -854 401 -523 465 103 -63 -126 -533 -1025 -363 -29 -63 815 486 -462 -828 -1051 -1607 -886 -1375 -995 -1344 -760 -632 -613 75 9 239 618 1345 1209 1046 665 -235 -349 -586 -331 -18 1084 -170 -633 -76 -764 474 820 163 -645 340 -77 -512 31 876 323 1054 -239 -886 -800 -305 65 276 635 -46 1768 702 769 681 385 777 388 437 -633 276 139 -573 -1100 -27 -1040 -474 -215 SS 20240512T172357.7Z 8898.724973 307 1 50.42 2 23.40 199.61 47.89 89.05 0.00 1 0.00 1 0 25 8.331e-03 6.481e-03 5.032e-04 3.253e-04 2.166305e-01 1.740160e-04 2.621684e-03 -6.000000e+00 5.006935e-03 230.95 -2.00 3.51 -2.00 315.26 0.00e+00 6.583624e-05 1.567582e-05 4.542431e-05 -6.000000e+00 2.200295e-04 283.45 -2.00 20.00 -2.00 314.62 0.00e+00 1.089 0.000 302.00 328.00 3 2.3150e+00 4.4935e-04 1.5834e-02 -6.0000e+00 1.2521e-02 1.2847e-02 4.9795e-04 1.1174e-02 -6.0000e+00 1.3535e-02 -1.5602e-03 2.8457e-04 5.4678e-03 -6.0000e+00 8.0466e-03 -1.9619e-03 1.2511e-04 1.5134e-03 -6.0000e+00 3.3840e-03 1.3449e-02 4.4324e-04 9.9636e-06 2.1845e-05 -6.0000e+00 2.5047e-04 1.2428e-02 0.0000e+00 11 9 0 11 4 0 99.97 22.82 0.21 0.01243 0.01576 318 60 1 5 0 158.520 26.11 20.00 22.82 18.45 36.6 1064.71 -1866 -2461 -3362 -1612 -209 727 1299 679 -700 -375 1097 767 518 508 -356 -448 96 469 589 -55 970 1231 797 610 250 -489 -659 391 1359 1408 1711 1540 -930 -528 242 194 416 298 -635 -1354 -1053 -1234 -1220 -937 -781 -1113 -756 -689 460 679 514 827 638 589 527 839 378 652 789 1417 1241 1120 442 -718 -205 -35 365 1165 764 106 -307 -668 -458 -759 -114 194 585 1307 316 84 -666 -1422 -1184 -1003 -1108 -800 -498 -481 -665 -179 230 322 1225 1411 1260 821 696 -306 -464 -344 -465 6 726 22 -700 -253 -724 -134 -50 -121 -340 -254 -154 -115 492 734 804 661 38 -516 -365 -226 -279 226 226 461 1337 1002 472 548 58 214 138 244 -243 -202 139 -475 -452 -289 -291 -292 -4 -568 -779 -1036 -447 -57 195 353 207 -230 -124 360 267 189 197 -153 -204 42 212 274 -26 464 588 393 317 129 -256 -334 194 634 654 835 805 -493 -274 127 103 233 188 -430 -991 -790 -961 -966 -741 -614 -866 -570 -526 341 508 405 660 536 493 452 731 333 568 677 1215 1109 1031 422 -717 -198 -32 326 1024 698 104 -314 -684 -482 -768 -110 175 498 1108 272 77 -661 -1493 -1273 -1097 -1292 -961 -608 -602 -828 -214 271 355 1277 1482 1337 923 807 -378 -584 -440 -577 7 823 26 -858 -317 -924 -177 -67 -167 -490 -367 -214 -153 637 920 997 826 49 -695 -505 -311 -374 298 293 584 1655 1236 593 708 76 289 190 337 -344 -292 207 -727 -676 -437 -427 -426 -6 SS 20240512T172855.0Z 8898.728415 310 1 50.45 2 23.74 202.43 46.98 89.83 0.00 1 0.00 1 0 17 2.029e-02 8.476e-03 4.607e-03 2.144e-03 2.211374e-01 1.134402e-03 2.630853e-03 -6.000000e+00 1.219531e-02 230.95 -2.00 3.51 -2.00 316.39 0.00e+00 -7.799788e-05 1.306581e-04 4.122738e-05 -6.000000e+00 5.359177e-04 283.45 -2.00 20.00 -2.00 315.68 0.00e+00 1.092 0.000 302.00 328.00 3 5.5959e+00 2.9694e-03 1.6011e-02 -6.0000e+00 3.0498e-02 2.7646e-02 3.3096e-03 1.1380e-02 -6.0000e+00 3.2968e-02 6.1550e-03 1.9119e-03 5.5585e-03 -6.0000e+00 1.9599e-02 -4.6318e-03 8.8153e-04 1.5300e-03 -6.0000e+00 8.2423e-03 4.9489e-04 4.0465e-04 6.6588e-05 2.0063e-05 -6.0000e+00 6.1006e-04 1.2356e-02 0.0000e+00 11 9 0 11 4 0 100.00 22.82 0.36 0.01236 0.01540 72 14 1 5 0 700.430 26.11 20.00 22.82 18.71 36.7 1066.87 -4403 8564 -9079 -1546 1237 -1136 7352 2603 -816 -3056 -1439 -1337 -7325 5981 -41 -3084 -2695 5218 2960 -1207 474 2090 -2387 307 360 5288 -1083 -1720 -1163 -233 2150 568 -2375 -794 4888 -932 -2008 882 326 -1785 -109 -2213 -1442 -1130 925 -2207 87 -445 1311 -149 399 -475 2270 1878 1028 2027 653 1637 143 1236 2507 1237 -502 300 -1413 51 -222 607 821 149 199 -51 -1015 463 -477 407 1155 869 -596 -1214 495 -1528 -1195 -1463 -537 -1127 -428 -803 -320 -377 -92 -185 605 994 622 60 768 35 -98 -391 -568 -37 991 308 -668 -225 -766 94 720 276 -546 -135 -80 -170 -96 565 758 455 -113 -911 151 369 886 423 253 -468 1045 593 -174 237 594 470 83 613 -488 -80 -5 -119 -595 -203 -360 -291 -123 -853 1524 -1841 -271 198 -186 1211 495 -169 -657 -307 -301 -1919 1552 -12 -994 -890 1655 986 -425 166 724 -883 116 141 2010 -423 -640 -412 -82 777 222 -981 -322 1823 -371 -885 436 185 -1136 -72 -1536 -1009 -790 637 -1537 59 -293 842 -98 271 -341 1660 1426 799 1593 521 1290 113 972 2010 1058 -458 279 -1308 44 -182 494 705 139 197 -51 -1030 451 -443 348 916 671 -483 -1070 466 -1560 -1272 -1622 -619 -1366 -537 -1026 -407 -467 -107 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