File name: Pandora206s1_BuffaloNY_20240505_L2Fit_fout2c1d20220512p1-8.txt File generation date: 20240506T074847.8Z 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 v1.8.59 Instrument operation file used: Pandora206_OF_v3d20211008.txt Instrument calibration file used: Pandora206s1_CF_v1d20220512.txt Level 1 file used: Pandora206s1_BuffaloNY_20240505_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: 20240505 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 20240505T132236.9Z 8891.557372 151 1 24.01 2 55.08 100.23 45.42 145.07 0.00 1 0.00 1 0 17 1.989e-01 2.664e-02 1.479e-01 2.064e-02 2.835300e-01 1.025690e-02 3.489857e-03 -6.000000e+00 1.124567e-01 230.11 -2.00 3.55 -2.00 318.17 0.00e+00 1.529007e-03 1.846318e-03 5.710583e-04 -6.000000e+00 4.870799e-03 280.29 -2.00 20.00 -2.00 317.48 0.00e+00 1.742 0.000 302.00 328.00 3 7.9480e+00 2.7852e-02 2.3092e-02 -6.0000e+00 2.8136e-01 6.6620e-02 3.1577e-02 1.5803e-02 -6.0000e+00 3.0538e-01 6.2414e-03 2.0376e-02 7.3754e-03 -6.0000e+00 1.8129e-01 -3.4237e-03 1.0492e-02 2.6331e-03 -6.0000e+00 7.6696e-02 2.2502e-05 1.7655e-04 5.7966e-04 2.4834e-05 -6.0000e+00 5.0706e-03 4.4814e-03 -4.7383e-06 12 8 8 10 0 0 67.99 18.51 2.67 0.00448 0.00581 6 6 2 8 0 4000.000 15.00 18.51 21.25 21.88 21.88 22.1 1036.25 -50971 -34047 46035 64965 37435 91842 78623 77065 53580 87456 69276 17419 -11698 30888 11092 -5591 26826 12027 -1694 16339 23867 -14421 15424 7464 4512 -7285 13344 5456 -3923 3357 10519 11279 17453 13247 -8468 2467 -13712 8645 15757 -9440 -6004 317 -1386 -2053 230 -4302 -8792 -14644 2302 1454 10725 -824 386 3617 6666 -718 1695 -1169 1460 -2866 -5271 3174 -4725 1355 592 -595 -1267 -2221 -171 -6355 5855 1393 1863 -1099 5094 329 1088 -1213 -3395 -669 783 1094 -3142 971 360 -405 4224 22 -1715 -854 1516 -1482 5334 973 1879 -4089 2459 -828 1972 1127 3279 -894 -1234 -3030 2651 -2091 -462 1063 -428 -495 6023 635 -2727 157 -4062 1678 -2402 -1390 -2361 -345 926 -2105 -612 111 3709 -1647 -544 -116 1430 498 -104 -1545 145 220 512 -375 -1089 1275 990 892 407 -792 -385 -5772 -3737 2440 2703 1784 2486 2565 2835 2697 3461 3222 1333 -1366 2736 1384 -897 3366 1765 -298 2577 3572 -3006 2505 1392 905 -1711 2579 1073 -782 615 1934 2225 3549 2951 -2159 541 -3883 2257 4610 -4071 -2745 147 -653 -1018 111 -2182 -4590 -7911 1032 657 4685 -435 212 2041 3771 -443 1043 -736 874 -1773 -3438 2049 -3602 1048 462 -431 -858 -1474 -117 -5309 4762 1236 1642 -959 3880 235 718 -775 -2316 -505 635 980 -3140 967 387 -471 4934 28 -2209 -1048 1668 -1534 4869 892 1813 -4492 2817 -1096 2701 1522 4056 -1059 -1409 -3512 3185 -2768 -628 1493 -640 -791 9571 1045 -4463 239 -5918 2231 -3208 -1917 -3530 -541 1458 -3351 -938 161 5067 -2266 -699 -149 1948 733 -158 -2437 229 358 886 -687 -2054 2405 1884 1643 723 -1371 -667 SS 20240505T144918.8Z 8891.617579 196 1 25.43 2 40.21 120.09 39.69 175.48 0.00 1 0.00 1 0 17 1.467e-01 3.157e-02 1.375e-01 2.927e-02 2.617055e-01 1.460514e-02 3.101472e-03 -6.000000e+00 8.290586e-02 230.11 -2.00 3.55 -2.00 317.76 0.00e+00 -3.943317e-03 2.295363e-03 6.923120e-05 -6.000000e+00 3.591207e-03 280.29 -2.00 20.00 -2.00 317.03 0.00e+00 1.308 0.000 302.00 328.00 3 8.4075e+00 3.9360e-02 1.9038e-02 -6.0000e+00 2.0742e-01 6.6351e-02 4.4410e-02 1.4255e-02 -6.0000e+00 2.2514e-01 1.8905e-02 2.7425e-02 6.9705e-03 -6.0000e+00 1.3366e-01 -2.2836e-02 1.3818e-02 3.6475e-03 -6.0000e+00 5.6537e-02 2.2725e-05 -4.5680e-04 8.2816e-04 3.1000e-05 -6.0000e+00 3.7384e-03 5.2791e-03 -1.4006e-06 12 8 8 10 0 0 -58.41 18.47 2.14 0.00528 0.00185 16 16 1 8 0 1589.250 14.99 18.47 23.28 21.88 21.88 21.9 1047.03 -5937 7452 -3315 61228 16983 56160 24112 61658 7109 62818 37090 67459 -17033 10933 1378 -16818 -1951 -1482 12913 -11813 23340 -1656 32473 6106 3544 -7372 18873 -2345 -3618 -11730 18673 42286 -889 6161 -9959 8797 -7463 18887 5663 6431 -3912 4338 745 2857 1483 -16862 -10011 -19748 203 4631 3447 1427 7229 3180 7811 304 -5039 -5304 404 -10083 838 -848 -3575 3908 -5822 1338 -2381 3236 482 -1646 4325 5577 1308 2073 6674 513 3060 -584 -3479 -1115 -126 2618 2407 -1747 2571 233 1640 -689 474 2336 -1185 -1583 1881 -4019 -560 320 1705 998 661 5420 2601 808 -1954 -4053 -145 -3797 835 750 333 -617 1201 280 -764 -2087 -1935 -1640 -1085 -3314 -2039 775 -19 3196 -525 -1845 4126 1423 -3154 1555 1646 271 888 255 -1737 -3372 70 -1066 -2337 1776 2322 2505 964 -756 -593 -578 697 -356 3370 1264 2690 1720 3457 763 4354 3289 4401 -2749 1496 233 -3648 -390 -303 2376 -2787 4112 -370 5305 1412 900 -2198 4383 -625 -880 -2967 3788 7198 -244 1655 -2901 2107 -2233 5037 2095 2823 -2102 2233 408 1535 794 -10770 -5813 -12205 100 2174 1730 787 3963 1924 4689 201 -3606 -3800 266 -7234 549 -602 -2822 3065 -5036 982 -1736 2157 347 -1337 3648 4857 1191 1868 5347 390 2034 -377 -2383 -841 -105 2364 2331 -1833 2770 276 2014 -864 611 2840 -1370 -1677 1752 -3793 -538 336 1951 1280 905 6917 3197 930 -2153 -4697 -178 -5070 1109 1045 487 -968 1958 467 -1237 -3181 -2686 -2191 -1433 -4655 -2926 1158 -29 4858 -809 -2754 5469 1849 -4044 1897 2153 383 1315 390 -2751 -5610 120 -1945 -4414 3298 4324 4509 1697 -1305 -993 SS 20240505T155253.1Z 8891.661726 232 1 24.00 2 31.36 141.53 40.88 199.54 0.00 1 0.00 1 0 17 8.734e-02 2.346e-02 5.872e-02 1.463e-02 2.476913e-01 7.278397e-03 2.931608e-03 -6.000000e+00 4.940640e-02 230.12 -2.00 3.55 -2.00 317.60 0.00e+00 -1.943140e-03 1.104868e-03 3.484706e-04 -6.000000e+00 2.138878e-03 280.30 -2.00 20.00 -2.00 316.88 0.00e+00 1.170 0.000 302.00 328.00 3 8.1743e+00 1.9464e-02 1.7554e-02 -6.0000e+00 1.2361e-01 3.0092e-03 2.1939e-02 1.3301e-02 -6.0000e+00 1.3414e-01 2.1095e-02 1.3474e-02 6.2909e-03 -6.0000e+00 7.9640e-02 -1.2983e-02 6.7435e-03 2.4306e-03 -6.0000e+00 3.3707e-02 3.4127e-05 5.4939e-04 4.0945e-04 2.2427e-05 -6.0000e+00 2.2259e-03 5.2942e-03 1.7897e-04 12 9 8 11 8 0 29.27 18.45 0.98 0.00529 0.00942 6 6 2 8 0 4000.000 15.00 18.45 22.57 21.88 21.88 21.6 1040.91 -19743 22289 27030 6109 41321 -2927 59667 21106 21308 15722 18761 2352 -12249 8370 3612 -4282 10578 7528 -4816 2142 11224 1750 7438 7019 -3054 6332 1127 2339 -12329 3673 964 -2934 2496 2570 -2163 -9803 -2047 -6625 8980 -2457 1661 -4426 -6406 -988 6471 -2874 -6543 -11153 529 -2500 -2520 1879 -17 1465 329 1616 2356 564 -74 -3652 -4308 5764 -171 -197 1598 -1744 888 -2960 1964 -1504 5156 776 2152 3751 3044 -2399 -612 -3695 -6783 -1660 -3351 3358 452 612 6827 1470 -646 847 57 2411 772 -1259 1093 -5207 -772 -794 1953 -1617 2386 1287 1894 -963 -2122 -3170 757 -3430 600 2084 -896 1926 1305 1641 -1620 -446 -2424 -240 -3602 -1208 -2672 424 709 -434 2260 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