File name: Pandora206s1_BuffaloNY_20230815_L2Fit_fout2c1d20220512p1-8.txt File generation date: 20230816T083711.1Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Kang Sun Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 206 Spectrometer number: 1 Processing software version used: BlickP v1.8.49 Instrument operation file used: Pandora206_OF_v3d20211008.txt Instrument calibration file used: Pandora206s1_CF_v1d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20230815_L1_smca1c1d20220512p1-8.txt Full location name: University at Buffalo Short location name: BuffaloNY Country of location: Canada Location latitude [deg]: 43.0015 Location longitude [deg]: -78.7869 Location altitude [m]: 190 Local noon date: 20230815 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: 223 365 Nominal wavelengths inside fitting window [nm]: 305.0398 305.1808 305.3218 305.4628 305.6038 305.7447 305.8857 306.0266 306.1675 306.3084 306.4493 306.5902 306.7311 306.8720 307.0128 307.1537 307.2945 307.4353 307.5761 307.7169 307.8577 307.9985 308.1393 308.2800 308.4207 308.5615 308.7022 308.8429 308.9836 309.1243 309.2649 309.4056 309.5462 309.6869 309.8275 309.9681 310.1087 310.2493 310.3899 310.5305 310.6710 310.8116 310.9521 311.0926 311.2331 311.3736 311.5141 311.6546 311.7950 311.9355 312.0759 312.2164 312.3568 312.4972 312.6376 312.7779 312.9183 313.0587 313.1990 313.3394 313.4797 313.6200 313.7603 313.9006 314.0408 314.1811 314.3214 314.4616 314.6018 314.7421 314.8823 315.0225 315.1626 315.3028 315.4430 315.5831 315.7232 315.8634 316.0035 316.1436 316.2837 316.4238 316.5638 316.7039 316.8439 316.9839 317.1240 317.2640 317.4040 317.5439 317.6839 317.8239 317.9638 318.1038 318.2437 318.3836 318.5235 318.6634 318.8033 318.9431 319.0830 319.2228 319.3627 319.5025 319.6423 319.7821 319.9219 320.0616 320.2014 320.3412 320.4809 320.6206 320.7603 320.9000 321.0397 321.1794 321.3191 321.4587 321.5984 321.7380 321.8776 322.0172 322.1568 322.2964 322.4360 322.5755 322.7151 322.8546 322.9941 323.1336 323.2731 323.4126 323.5521 323.6916 323.8310 323.9705 324.1099 324.2493 324.3887 324.5281 324.6675 324.8069 324.9462 --------------------------------------------------------------------------------------- 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: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Temperature at electronics board 1 [°C], 999=no temperature signal Column 98: Temperature at electronics board 2 [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: 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 20230815T121932.9Z 8627.513575 92 1 28.00 2 69.61 89.60 59.61 88.59 0.00 1 0.00 1 0 25 3.066e-01 2.441e-02 2.329e-01 1.642e-02 3.769741e-01 8.436108e-03 4.337819e-03 -6.000000e+00 1.769950e-01 231.84 -2.00 3.55 -2.00 319.33 0.00e+00 1.678135e-03 2.199798e-03 7.283700e-04 -6.000000e+00 8.388708e-03 287.94 -2.00 20.00 -2.00 318.52 0.00e+00 2.840 0.000 302.00 328.00 3 6.6532e+00 2.3927e-02 3.4572e-02 -6.0000e+00 4.4309e-01 9.5461e-02 2.8078e-02 2.1116e-02 -6.0000e+00 4.7991e-01 2.2036e-02 2.1222e-02 9.6991e-03 -6.0000e+00 2.8401e-01 -2.1877e-02 1.1162e-02 3.7486e-03 -6.0000e+00 1.2100e-01 2.4954e-05 5.2660e-04 4.7010e-04 3.1506e-05 -6.0000e+00 7.9605e-03 9.6248e-04 1.5981e-04 12 8 8 10 0 0 97.84 18.52 3.50 0.00096 0.00492 7 7 2 8 0 4000.000 15.00 18.52 26.49 21.88 21.88 18.5 993.85 -37395 900000 64113 22345 182132 900000 900000 195321 91442 72464 900000 -28943 -43004 11988 -40977 40252 120323 53721 3336 11155 42092 -13249 -9304 56210 27646 19481 2686 16914 -18647 11552 17601 -8800 4722 8143 4928 6382 4568 -1381 14784 -11271 -6341 -3106 12969 -5939 5607 -8051 -1755 -17769 642 2388 4352 8365 -4139 6395 1748 4631 -715 5345 -5605 -7577 -5354 4677 2437 5672 -5215 -2728 558 -6423 3281 -1104 4355 34 4905 2172 3793 333 3856 431 -3712 -3427 -3900 2069 -2527 948 -1391 39 -389 1522 -2374 379 6087 -927 -87 -2527 2642 -2429 1599 904 1576 -692 3212 -1387 760 -2581 1010 -1442 531 72 -538 485 406 1911 -6024 -160 -1702 4066 -2816 -1144 -1030 1549 -577 1206 1400 -9 2510 -1183 -842 -37 2637 -1576 1330 -1241 654 -1733 -187 406 145 1710 2413 863 -452 -1189 -2488 -1287 900000 1026 501 2915 900000 900000 3126 1463 1282 900000 -1390 -2787 537 -3705 1967 2838 2625 272 884 2659 -1368 -946 3362 2329 1871 297 1624 -2268 1100 1749 -1268 664 1187 693 849 681 -254 2802 -3157 -1883 -939 3487 -1968 1656 -2758 -562 -6612 199 776 1492 3009 -1709 2543 761 2001 -335 2352 -2682 -3650 -2592 2216 1302 3213 -3368 -1598 313 -3619 1874 -720 2976 26 3485 1519 2547 207 2095 232 -2204 -2336 -2887 1616 -2231 843 -1357 40 -424 1682 -2745 411 5738 -859 -78 -2252 2399 -2473 1757 1127 2098 -927 3878 -1604 792 -2838 1173 -1807 682 99 -779 752 677 3223 -10187 -252 -2503 5291 -3919 -1633 -1573 2451 -944 1893 2138 -13 3433 -1607 -1137 -50 3601 -2432 2127 -2116 1120 -3163 -359 816 285 3377 4762 1752 -889 -2256 -4636 SS 20230815T125204.3Z 8627.536161 104 1 23.48 2 63.67 95.27 53.85 94.14 0.00 1 0.00 1 0 17 1.428e-02 5.658e-03 8.372e-03 1.931e-03 3.020705e-01 9.690741e-04 3.614834e-03 -6.000000e+00 8.130474e-03 231.84 -2.00 3.55 -2.00 317.84 0.00e+00 4.518791e-04 1.622796e-04 9.955734e-05 -6.000000e+00 3.612205e-04 287.94 -2.00 20.00 -2.00 317.00 0.00e+00 2.241 0.000 302.00 328.00 3 3.9260e+00 2.6097e-03 2.7285e-02 -6.0000e+00 2.0375e-02 3.7610e-03 2.9520e-03 1.6044e-02 -6.0000e+00 2.2056e-02 -1.6274e-04 1.8396e-03 7.7667e-03 -6.0000e+00 1.3134e-02 -1.8769e-03 9.3535e-04 2.1486e-03 -6.0000e+00 5.5774e-03 8.0057e-04 4.4945e-05 5.3355e-05 2.1689e-05 -6.0000e+00 3.6432e-04 2.9976e-03 -2.3465e-05 12 1 1 12 1 1 98.39 18.50 0.47 0.00300 0.00334 25 33 4 8 0 896.780 15.00 18.50 28.05 21.88 21.88 18.7 1004.34 -4606 -2911 -670 -3224 -6799 -678 -5276 -1005 -2832 610 -3736 -764 -5158 -1704 -3046 -301 73 -1578 -223 -24 859 -712 1132 -530 403 -715 741 -562 -2258 -1228 805 313 4933 739 -1977 -1914 -2764 -1367 -398 -308 -731 -212 -184 -230 94 -591 -457 -1356 119 -284 1519 1015 793 1420 1007 858 990 417 499 120 764 1056 1719 1758 238 99 -348 -484 12 584 208 591 125 646 201 -246 -141 -867 -128 -1379 -1046 -531 -1833 -1696 -1009 -844 -202 -172 501 334 404 139 206 466 259 179 467 875 206 -250 -247 -733 -871 -179 -572 -774 -680 -590 -304 -51 303 351 13 154 -95 103 258 118 144 5 -89 116 258 248 565 607 438 1003 706 451 270 -26 -115 -99 -173 -88 -26 300 8 -364 -115 -502 -554 -338 -235 -55 -259 -495 -44 -384 -78 -254 57 -359 -73 -584 -217 -455 -49 13 -288 -42 -5 172 -143 227 -116 92 -173 179 -130 -489 -260 181 77 1271 210 -534 -497 -797 -450 -147 -136 -357 -108 -91 -116 50 -317 -241 -707 60 -145 813 556 461 874 646 562 664 280 328 78 509 757 1265 1399 194 74 -259 -352 9 482 181 534 114 562 173 -189 -104 -610 -93 -1103 -942 -502 -1884 -1814 -1095 -985 -234 -207 603 407 453 151 205 445 265 194 562 1118 284 -339 -314 -904 -1000 -210 -706 -1009 -926 -806 -437 -78 472 556 20 231 -130 139 347 166 208 8 -135 180 390 359 806 828 567 1362 991 651 413 -42 -187 -159 -296 -153 -46 542 15 -647 -195 -864 -927 SS 20230815T125837.0Z 8627.540706 107 1 7.12 2 62.48 96.45 52.70 95.31 0.00 1 0.00 1 0 17 1.163e-02 5.400e-03 3.584e-03 9.300e-04 2.899740e-01 4.669020e-04 3.472597e-03 -6.000000e+00 6.617743e-03 231.84 -2.00 3.55 -2.00 317.71 0.00e+00 5.286086e-04 7.490700e-05 9.922659e-05 -6.000000e+00 2.940201e-04 287.94 -2.00 20.00 -2.00 316.87 0.00e+00 2.153 0.000 302.00 328.00 3 1.3865e+00 1.2538e-03 2.6191e-02 -6.0000e+00 1.6584e-02 -1.5222e-02 1.4137e-03 1.5372e-02 -6.0000e+00 1.7952e-02 -3.5194e-03 8.6533e-04 7.4446e-03 -6.0000e+00 1.0691e-02 -5.9086e-04 4.3538e-04 2.0698e-03 -6.0000e+00 4.5396e-03 1.1377e-02 3.7331e-05 2.5664e-05 2.1155e-05 -6.0000e+00 2.9654e-04 3.0437e-03 -2.8162e-05 12 1 1 12 1 1 98.85 18.50 0.27 0.00304 0.00332 112 230 2 8 0 59.980 15.00 18.50 28.36 21.88 21.88 18.7 1006.00 -2071 -1409 -1382 -2842 -5108 -5039 -2407 -2257 -850 -2630 -3150 -3359 -860 -2134 -552 -766 -573 124 998 710 838 36 138 222 314 -149 -10 -355 -1647 -80 1002 728 1684 -271 -2416 -2665 -1984 -1981 -475 -168 -615 -689 -180 -688 159 4 -68 -263 -645 -180 797 712 937 1224 817 1173 855 610 577 565 1036 1283 1398 1858 505 -89 -328 -704 318 432 538 317 219 387 249 9 -405 -931 -443 -682 -1039 -821 -1984 -1560 -1194 -612 -349 -192 403 232 379 330 81 156 471 103 338 715 262 -242 -228 -649 -752 -118 -683 -861 -675 -465 -277 307 441 222 309 177 -153 74 57 187 47 168 -299 14 341 175 700 444 385 847 650 192 319 165 -244 96 -5 -77 -53 182 -27 -320 -182 -435 -526 -172 -129 -132 -262 -420 -393 -195 -204 -85 -289 -343 -371 -105 -307 -90 -141 -111 25 208 154 186 8 31 53 80 -36 -2 -90 -391 -18 246 194 489 -77 -712 -758 -617 -648 -185 -78 -315 -368 -91 -354 81 2 -38 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