File name: Pandora55s1_QueensNY_20240419_L2Fit_fout2c18d20230426p1-8.txt File generation date: 20240824T134810.0Z 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 v1.8.59 Instrument operation file used: Pandora55_OF_v5d20190723.txt Instrument calibration file used: Pandora55s1_CF_v18d20230426.txt Level 1 file used: Pandora55s1_QueensNY_20240419_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: 20240419 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 20240419T122022.4Z 8875.514149 225 1 51.68 2 66.31 95.27 125.08 330.74 0.00 1 0.00 1 0 17 3.796e-01 1.891e-02 8.774e-02 3.433e-03 3.594233e-01 1.784564e-03 4.243908e-03 -6.000000e+00 2.261009e-01 229.01 -2.00 3.51 -2.00 318.40 0.00e+00 -5.847947e-04 3.492101e-04 3.545796e-04 -6.000000e+00 9.890300e-03 280.91 -2.00 20.00 -2.00 317.71 0.00e+00 2.470 0.000 302.00 328.00 3 5.1783e+00 4.8268e-03 3.1022e-02 -6.0000e+00 5.6324e-01 4.7392e-02 5.4924e-03 1.8720e-02 -6.0000e+00 6.1002e-01 -3.4994e-02 3.5869e-03 9.1197e-03 -6.0000e+00 3.6298e-01 1.8851e-02 1.8213e-03 2.6074e-03 -6.0000e+00 1.5178e-01 1.5809e-04 -4.5297e-04 1.0632e-04 3.0793e-05 -6.0000e+00 1.1333e-02 7.3436e-03 0.0000e+00 12 9 9 12 32 32 99.91 22.68 0.44 0.00734 0.00394 18 3 1 5 0 2870.370 26.00 20.00 22.68 16.42 36.3 1061.26 -45706 -50856 414772 -58946 -6351 26613 -27257 73443 -9462 -7288 -37468 -27120 -30732 -27866 24685 -530 20627 18208 26962 12011 16418 -1952 1376 17198 18178 -5433 41741 -3626 -9584 -10408 -4484 2320 -6508 -2852 -4850 21273 -10129 -5533 3434 6221 -3383 3343 -4910 -2123 5699 5544 -4458 2935 3210 3315 -1904 -1377 7514 6331 4081 1296 4607 1744 3083 381 -325 5087 154 -3439 1842 4373 255 -2901 899 760 -420 158 1146 -3284 2426 -1257 -778 4275 -1306 -2760 -4188 2248 -2633 -388 -3354 -932 -2395 -970 -1869 -371 -578 -1133 565 -185 54 339 -955 -700 -139 -391 -558 -1055 -1035 1900 873 405 -521 -582 629 2294 964 -777 559 312 -1107 1294 198 1022 111 -138 -1329 649 1000 1871 186 454 -626 453 148 -437 885 928 603 305 738 -426 760 34 -271 -1290 -111 -1047 -335 -598 -3412 -4470 1389 -5749 -355 1037 -1800 2111 -656 -532 -3747 -2547 -3279 -3338 2091 -64 2202 2099 3005 1602 2160 -309 214 2425 2710 -1057 5366 -689 -1840 -1966 -828 439 -1461 -654 -1135 3819 -2491 -1459 978 2017 -1333 1334 -2186 -943 2378 2326 -2024 1240 1347 1405 -871 -666 3597 3236 2220 744 2647 1033 1797 224 -193 2996 101 -2478 1324 3066 177 -1991 605 551 -336 133 984 -2891 1967 -987 -564 2800 -888 -2010 -3412 1905 -2496 -381 -3520 -1006 -2741 -1140 -2249 -439 -666 -1245 576 -181 52 349 -1073 -852 -180 -528 -748 -1358 -1261 2198 1038 505 -682 -787 875 3294 1468 -1242 899 493 -1699 1867 277 1422 159 -207 -2080 1015 1549 2829 276 654 -879 615 203 -629 1333 1455 971 502 1247 -749 1375 63 -509 -2443 -205 -1908 -590 -1042 SS 20240419T122607.2Z 8875.518139 229 1 49.39 2 65.22 96.26 125.60 332.28 0.00 1 0.00 1 0 25 1.182e-01 1.085e-02 1.469e-02 2.279e-03 3.549668e-01 1.187817e-03 4.212428e-03 -6.000000e+00 7.042659e-02 229.01 -2.00 3.51 -2.00 318.04 0.00e+00 4.460875e-04 2.114143e-04 2.494941e-04 -6.000000e+00 3.079725e-03 280.91 -2.00 20.00 -2.00 317.35 0.00e+00 2.370 0.000 302.00 328.00 3 4.6066e+00 3.1825e-03 3.0107e-02 -6.0000e+00 1.7544e-01 3.6217e-02 3.5981e-03 1.8449e-02 -6.0000e+00 1.8999e-01 -6.0310e-03 2.3081e-03 9.0215e-03 -6.0000e+00 1.1305e-01 4.5062e-04 1.1723e-03 2.5742e-03 -6.0000e+00 4.7294e-02 3.0830e-04 -4.6749e-04 6.9855e-05 3.0844e-05 -6.0000e+00 3.5284e-03 4.8136e-03 0.0000e+00 12 9 8 11 32 0 99.92 22.68 0.64 0.00481 0.00130 19 4 1 5 0 2599.020 26.00 20.00 22.68 16.87 36.3 1063.96 -15039 -20359 112083 -30306 2065 19762 -238 51417 8550 -8778 -17652 -11729 -14398 -12677 2932 456 -10853 331 12651 13334 -2324 6583 4377 -8224 -203 -1624 4975 -4821 -2799 -3216 -613 3506 2472 -3422 -1317 10136 -3341 -4354 2655 2344 -2159 1463 -3533 -2103 -1324 4367 -2897 2565 1228 2044 248 -156 -921 518 3412 964 3691 1300 2626 720 1500 2557 1196 -1969 803 -1521 171 -867 585 1435 -696 304 -167 -1479 1372 -997 470 2306 713 -830 -1671 340 -1190 -1191 -1828 -1103 -1972 -1073 -1411 -119 77 85 535 1393 788 951 -149 500 82 -138 -847 -547 -92 1188 997 -367 148 -776 201 774 174 -955 52 5 -257 22 627 1277 464 84 -1229 -248 547 -484 63 280 98 910 614 -102 863 407 783 85 436 -522 408 281 -317 -803 -397 -465 -247 -22 -928 -1491 2500 -2537 120 918 -14 2009 557 -723 -1631 -1065 -1477 -1475 343 62 -1751 51 1832 2003 -414 1098 754 -1656 -40 -343 1008 -1047 -573 -648 -125 749 584 -898 -340 2316 -880 -1286 858 875 -930 655 -1704 -1025 -646 2050 -1434 1208 582 971 123 -82 -517 303 2031 600 2310 833 1660 457 952 1664 833 -1493 620 -1189 127 -629 424 1101 -586 269 -151 -1341 1181 -827 360 1648 510 -633 -1402 305 -1157 -1213 -1945 -1219 -2288 -1279 -1712 -143 90 94 561 1394 791 1000 -168 608 107 -186 -1136 -704 -112 1396 1194 -463 193 -1049 279 1112 262 -1498 82 8 -386 32 869 1759 658 123 -1888 -384 834 -731 93 400 136 1226 833 -144 1279 626 1233 138 719 -894 715 501 -574 -1464 -713 -818 -423 -37 SS 20240419T123245.4Z 8875.522748 233 1 50.45 2 63.97 97.41 126.17 334.10 0.00 1 0.00 1 0 25 1.122e-02 5.917e-03 1.854e-03 4.887e-04 3.441709e-01 2.551057e-04 4.109979e-03 -6.000000e+00 6.683081e-03 229.01 -2.00 3.51 -2.00 317.50 0.00e+00 1.486661e-04 3.874024e-05 1.134833e-04 -6.000000e+00 2.921862e-04 280.91 -2.00 20.00 -2.00 316.80 0.00e+00 2.265 0.000 302.00 328.00 3 1.8464e+00 6.7567e-04 2.8918e-02 -6.0000e+00 1.6649e-02 2.4501e-02 7.5880e-04 1.7779e-02 -6.0000e+00 1.8027e-02 -9.0844e-03 4.6294e-04 8.7136e-03 -6.0000e+00 1.0727e-02 -4.9387e-04 2.2889e-04 2.4352e-03 -6.0000e+00 4.4889e-03 5.5325e-03 -3.2215e-04 1.4856e-05 2.9775e-05 -6.0000e+00 3.3472e-04 3.1878e-03 0.0000e+00 10 0 0 10 0 0 99.98 22.68 0.18 0.00319 0.00077 328 62 1 5 0 153.790 26.00 20.00 22.68 17.46 36.3 1067.00 -3479 -4110 -2253 -5710 -3883 -1405 -2701 1468 -1008 -1706 -3132 -667 -959 -381 1503 -243 -798 -332 1022 539 -427 451 1259 42 323 -434 4 -1161 -389 821 944 1808 881 -1141 -1145 368 -448 66 468 -678 -1156 -795 -1146 -917 -607 -295 -878 -565 -169 500 766 690 767 917 771 587 879 282 627 891 1316 1442 1242 562 -389 -82 44 370 1232 762 196 -134 -559 -600 -605 -206 210 582 1052 75 -131 -738 -1509 -1251 -1173 -1047 -758 -485 -421 -608 -59 327 487 1321 1391 1113 856 729 -326 -451 -400 -549 -108 689 -146 -809 -393 -674 -50 -33 -82 -323 -239 -101 -1 568 791 867 591 -108 -586 -442 -236 -334 165 142 418 1391 866 377 506 -38 267 144 262 -304 -116 168 -438 -439 -214 -224 -215 58 -275 -372 -211 -543 -336 -112 -222 128 -102 -187 -360 -77 -123 -52 237 -44 -159 -70 222 123 -95 101 282 10 81 -116 1 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