File name: Pandora25s1_HoustonTX_20240521_L2Fit_fout2c6d20220503p1-8.txt File generation date: 20240928T011948.3Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 Local principal investigator: Jimmy Flynn Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 25 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora25_OF_v7d20190903.txt Instrument calibration file used: Pandora25s1_CF_v6d20220503.txt Level 1 file used: Pandora25s1_HoustonTX_20240521_L1_smca1c6d20220503p1-8.txt Full location name: University Of Houston Short location name: HoustonTX Country of location: United States Location latitude [deg]: 29.7200 Location longitude [deg]: -95.3400 Location altitude [m]: 19 Local noon date: 20240521 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: Update session 4 for SO2 First and last pixel inside fitting window: 281 423 Nominal wavelengths inside fitting window [nm]: 305.1116 305.2524 305.3931 305.5338 305.6745 305.8152 305.9558 306.0965 306.2371 306.3777 306.5183 306.6589 306.7995 306.9401 307.0806 307.2212 307.3617 307.5022 307.6427 307.7832 307.9236 308.0641 308.2045 308.3449 308.4853 308.6257 308.7661 308.9065 309.0468 309.1872 309.3275 309.4678 309.6081 309.7484 309.8886 310.0289 310.1691 310.3093 310.4495 310.5897 310.7299 310.8701 311.0102 311.1504 311.2905 311.4306 311.5707 311.7108 311.8509 311.9909 312.1310 312.2710 312.4110 312.5510 312.6910 312.8310 312.9709 313.1109 313.2508 313.3907 313.5306 313.6705 313.8104 313.9503 314.0901 314.2300 314.3698 314.5096 314.6494 314.7892 314.9290 315.0687 315.2085 315.3482 315.4879 315.6276 315.7673 315.9070 316.0466 316.1863 316.3259 316.4656 316.6052 316.7448 316.8843 317.0239 317.1635 317.3030 317.4425 317.5821 317.7216 317.8611 318.0005 318.1400 318.2794 318.4189 318.5583 318.6977 318.8371 318.9765 319.1159 319.2552 319.3946 319.5339 319.6732 319.8125 319.9518 320.0911 320.2304 320.3696 320.5089 320.6481 320.7873 320.9265 321.0657 321.2049 321.3441 321.4832 321.6223 321.7615 321.9006 322.0397 322.1788 322.3178 322.4569 322.5960 322.7350 322.8740 323.0130 323.1520 323.2910 323.4300 323.5689 323.7079 323.8468 323.9857 324.1246 324.2635 324.4024 324.5413 324.6801 324.8190 324.9578 --------------------------------------------------------------------------------------- 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 20240521T130504.0Z 8907.545185 207 1 11.38 2 70.23 77.27 129.67 273.31 0.00 1 0.00 1 0 17 4.696e-02 6.699e-03 2.502e-02 3.451e-03 3.787767e-01 1.771597e-03 4.122365e-03 -6.000000e+00 2.730798e-02 231.00 -2.00 3.24 -2.00 318.61 0.00e+00 1.725406e-04 3.765450e-04 1.196391e-04 -6.000000e+00 1.227794e-03 290.67 -2.00 20.00 -2.00 317.74 0.00e+00 2.923 0.000 302.00 328.00 3 3.8113e+00 4.8676e-03 3.4517e-02 -6.0000e+00 6.8200e-02 1.1593e-02 5.5872e-03 1.8443e-02 -6.0000e+00 7.3653e-02 3.4610e-03 3.7782e-03 8.9215e-03 -6.0000e+00 4.3973e-02 -6.6486e-03 1.9762e-03 2.4802e-03 -6.0000e+00 1.8804e-02 3.9785e-04 7.3917e-05 9.9433e-05 2.6671e-05 -6.0000e+00 1.2767e-03 -3.8837e-02 2.6903e-04 12 9 1 12 1 1 100.00 24.44 0.16 -0.03884 -0.03828 15 15 1 5 0 711.080 26.94 20.00 24.44 34.24 32.1 1100.00 -14789 -8482 -14169 905 -16122 -8192 17038 -7151 3340 6891 -17597 9229 -15204 -2246 -9080 28188 -3506 4302 -2642 -1087 -1530 -1307 672 -2923 -190 -3161 -492 -3754 2877 -3448 3058 3192 26 4235 -4040 146 -1482 6662 -1675 -316 -2374 1209 -1178 803 738 454 -1891 -1402 229 -1043 1817 -1363 1727 1165 1379 443 2763 -958 1090 -1174 678 582 960 1465 -263 64 27 -274 632 1179 37 227 -568 113 1151 766 -1812 -905 48 -176 -743 -1498 -1566 -1288 -555 -1129 -113 78 155 815 981 474 108 709 232 274 250 898 466 -437 -88 -980 -714 -533 146 -804 -678 -983 -38 157 268 618 358 39 -164 170 -5 -378 -282 69 -514 296 211 179 -158 753 272 913 298 145 470 -44 -26 197 66 -144 -45 37 263 -498 113 -366 -422 -641 -387 -709 38 -718 -331 588 -346 165 350 -1132 491 -1161 -179 -895 2212 -394 477 -328 -139 -202 -172 90 -432 -29 -522 -80 -602 414 -530 482 557 5 840 -825 28 -316 1533 -492 -106 -888 461 -474 322 297 184 -781 -574 93 -436 786 -651 853 610 747 248 1549 -555 611 -665 387 354 628 1018 -188 44 18 -178 431 884 31 192 -483 93 891 550 -1235 -595 33 -133 -621 -1368 -1514 -1292 -580 -1246 -129 91 181 930 1065 487 105 678 233 297 295 1137 622 -587 -114 -1202 -834 -627 179 -1040 -905 -1360 -54 236 420 990 569 60 -242 240 -6 -544 -423 107 -815 464 326 270 -232 1066 374 1250 428 221 747 -72 -44 337 117 -264 -83 71 502 -945 208 -659 -745 SS 20240521T133847.4Z 8907.568605 224 1 48.89 2 63.04 80.85 136.71 277.86 0.00 1 0.00 1 0 17 3.177e-01 2.230e-02 9.862e-02 6.743e-03 3.047831e-01 3.469568e-03 3.320421e-03 -6.000000e+00 1.849567e-01 231.00 -2.00 3.24 -2.00 318.03 0.00e+00 -1.484486e-03 6.052337e-04 1.139210e-04 -6.000000e+00 8.343006e-03 290.67 -2.00 20.00 -2.00 317.14 0.00e+00 2.193 0.000 302.00 328.00 3 6.7113e+00 9.3637e-03 2.6438e-02 -6.0000e+00 4.6192e-01 9.9794e-02 1.0635e-02 1.4811e-02 -6.0000e+00 4.9887e-01 -1.7978e-02 6.6394e-03 7.1459e-03 -6.0000e+00 2.9776e-01 7.6540e-03 3.3716e-03 2.2946e-03 -6.0000e+00 1.2822e-01 4.7188e-05 3.3404e-04 1.9789e-04 2.3614e-05 -6.0000e+00 8.6971e-03 -4.0080e-02 4.9311e-04 12 9 8 11 8 0 99.95 24.43 0.88 -0.04008 -0.03757 20 4 1 5 0 2444.210 26.94 20.01 24.43 35.14 32.2 1100.00 900000 2173 -20226 27497 -18521 -18348 184347 -20049 298752 -5870 2651 18399 -32136 554 -10399 76438 -673 15701 3534 11135 -8359 5586 -16170 9192 -4725 1908 -8431 -377 -784 -12362 14427 6235 9094 -2649 -9270 1974 21180 26948 7447 -4033 -2557 3253 198 3143 6137 5286 -10135 -6808 4280 884 1641 -37 134 5333 4517 995 6895 -5205 250 -2807 1645 -4566 -494 -900 -1431 -1876 -317 -1894 2279 874 4508 1388 1983 -2340 2368 3918 -6270 -1550 -283 -150 -2445 -3443 -2813 2139 158 -3098 312 -215 -789 2452 338 735 90 -1930 -2855 1744 -5 1633 1376 -1381 2119 -2165 -1339 -2634 2144 1771 -2068 -818 1715 1296 181 1639 1666 -16 -1287 -300 -1387 -919 -1342 -1736 -1350 1643 1738 775 545 1926 -285 1027 -1385 -235 -680 -1004 -441 2632 -1108 -701 839 1576 33 -796 556 -2046 384 900000 177 -2079 1734 -1601 -1519 2593 -2014 1964 -615 257 1580 -4883 71 -1672 6059 -114 2380 624 1899 -1744 1020 -3703 1770 -1100 437 -2130 -84 -163 -2806 2693 1362 2097 -707 -2496 466 4508 6290 2480 -1737 -1192 1506 97 1508 2856 2471 -5377 -3436 1926 413 800 -20 75 3005 2656 618 4144 -3492 156 -1786 1025 -3192 -359 -700 -1131 -1403 -219 -1294 1576 683 3722 1231 1756 -2088 1911 2843 -4543 -1024 -190 -112 -2073 -3230 -2797 2127 169 -3615 370 -265 -980 2887 382 766 87 -1847 -2865 1830 -5 2055 1843 -1892 2692 -2657 -1541 -3091 2576 2250 -2817 -1145 2452 1962 290 2659 2654 -24 -1871 -409 -1876 -1274 -1964 -2692 -2137 2525 2612 1139 770 2584 -374 1316 -1897 -339 -1036 -1578 -701 4199 -1903 -1254 1516 2882 61 -1476 988 -3597 646 SS 20240521T134431.7Z 8907.572589 227 1 49.59 2 61.81 81.46 137.90 278.71 0.00 1 0.00 1 0 17 7.967e-03 4.911e-03 1.791e-03 6.506e-04 2.759424e-01 3.341074e-04 3.057050e-03 -6.000000e+00 4.630057e-03 231.00 -2.00 3.24 -2.00 316.97 0.00e+00 2.392726e-04 4.479667e-05 5.192719e-05 -6.000000e+00 2.083078e-04 290.67 -2.00 20.00 -2.00 316.10 0.00e+00 2.106 0.000 302.00 328.00 3 3.1194e+00 8.8232e-04 2.4929e-02 -6.0000e+00 1.1563e-02 5.7325e-03 9.8900e-04 1.3344e-02 -6.0000e+00 1.2490e-02 6.6526e-04 5.8277e-04 6.4583e-03 -6.0000e+00 7.4569e-03 -2.8167e-03 2.8284e-04 1.7791e-03 -6.0000e+00 3.1868e-03 2.0424e-03 -3.3925e-04 1.8656e-05 2.0529e-05 -6.0000e+00 2.1670e-04 -3.7652e-02 1.2894e-04 10 0 0 10 0 0 99.99 24.45 0.20 -0.03765 -0.04020 209 44 1 5 0 237.200 26.94 20.00 24.45 35.35 32.2 1100.00 -1891 -1369 -1068 -1226 -2387 -3089 -37 -981 1056 -285 -1788 -299 -2807 -499 -716 728 -459 784 515 952 509 585 169 277 -91 109 223 -487 -53 -36 1779 1019 1601 240 -1648 -1658 -1589 -352 -675 -555 -903 -300 -657 -400 -284 -130 -614 -516 -509 -210 506 604 623 905 700 637 924 317 724 457 757 754 1203 1384 800 -281 -463 -553 184 589 124 338 218 356 353 140 -446 -712 -519 -536 -1017 -921 -1471 -1628 -939 -605 -283 20 244 354 453 468 137 263 303 396 438 637 266 -176 -324 -736 -677 -242 -280 -683 -541 -534 -217 273 196 313 264 81 -124 88 133 112 84 94 -316 -72 92 275 247 498 176 783 607 451 299 23 -152 148 19 151 -103 162 -34 -248 -184 -429 -565 -247 -182 -145 -167 -293 -367 -4 -137 162 -43 -274 -47 -505 -101 -167 173 -116 203 140 267 146 167 50 86 -30 37 76 -158 -16 -11 552 347 554 87 -606 -596 -586 -150 -328 -299 -535 -185 -398 -245 -173 -79 -389 -319 -309 -128 324 395 432 628 504 470 692 238 532 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