File name: Pandora177s1_WestportCT_20231002_L2Fit_fout2c3d20221101p1-8.txt File generation date: 20240313T194923.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 177 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora177_OF_v3d20201002.txt Instrument calibration file used: Pandora177s1_CF_v3d20221101.txt Level 1 file used: Pandora177s1_WestportCT_20231002_L1_smca1c3d20221101p1-8.txt Full location name: Westport - Sherwood Island State Park CTDEEP (USEPA AQS ID 09-001-9003) Short location name: WestportCT Country of location: USA Location latitude [deg]: 41.1183 Location longitude [deg]: -73.3367 Location altitude [m]: 4 Local noon date: 20231002 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: None First and last pixel inside fitting window: 218 360 Nominal wavelengths inside fitting window [nm]: 305.0382 305.1790 305.3198 305.4607 305.6015 305.7423 305.8831 306.0238 306.1646 306.3054 306.4461 306.5868 306.7276 306.8683 307.0090 307.1497 307.2904 307.4310 307.5717 307.7124 307.8530 307.9936 308.1343 308.2749 308.4155 308.5561 308.6967 308.8372 308.9778 309.1184 309.2589 309.3994 309.5400 309.6805 309.8210 309.9615 310.1019 310.2424 310.3829 310.5233 310.6638 310.8042 310.9446 311.0850 311.2254 311.3658 311.5062 311.6466 311.7869 311.9273 312.0676 312.2079 312.3482 312.4885 312.6288 312.7691 312.9094 313.0497 313.1899 313.3302 313.4704 313.6106 313.7508 313.8910 314.0312 314.1714 314.3116 314.4517 314.5919 314.7320 314.8721 315.0123 315.1524 315.2925 315.4325 315.5726 315.7127 315.8527 315.9928 316.1328 316.2728 316.4129 316.5529 316.6928 316.8328 316.9728 317.1128 317.2527 317.3926 317.5326 317.6725 317.8124 317.9523 318.0922 318.2320 318.3719 318.5118 318.6516 318.7914 318.9313 319.0711 319.2109 319.3507 319.4904 319.6302 319.7700 319.9097 320.0494 320.1892 320.3289 320.4686 320.6083 320.7480 320.8876 321.0273 321.1669 321.3066 321.4462 321.5858 321.7254 321.8650 322.0046 322.1442 322.2837 322.4233 322.5628 322.7024 322.8419 322.9814 323.1209 323.2604 323.3998 323.5393 323.6788 323.8182 323.9576 324.0971 324.2365 324.3759 324.5153 324.6546 324.7940 324.9334 --------------------------------------------------------------------------------------- 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 20231002T123534.3Z 8675.524702 275 1 47.73 2 71.70 112.11 69.70 278.66 0.00 1 0.00 1 0 17 1.634e-01 2.032e-02 1.806e-01 1.418e-02 3.477406e-01 7.426603e-03 4.405214e-03 -6.000000e+00 9.703167e-02 227.37 -2.00 3.51 -2.00 319.71 0.00e+00 8.567940e-03 2.189667e-03 1.483774e-03 -6.000000e+00 4.372356e-03 285.75 -2.00 20.00 -2.00 318.93 0.00e+00 3.143 0.001 302.00 328.00 3 5.3855e+00 2.1390e-02 3.6084e-02 -6.0000e+00 2.4030e-01 6.0954e-02 2.5259e-02 1.8075e-02 -6.0000e+00 2.6113e-01 -3.9106e-02 1.8272e-02 1.1798e-02 -6.0000e+00 1.5598e-01 6.0219e-03 9.2959e-03 7.6499e-03 -6.0000e+00 6.4940e-02 6.8610e-05 -9.6082e-04 4.7120e-04 8.8462e-05 -6.0000e+00 4.9632e-03 6.0378e-02 -1.3202e-04 12 8 8 10 0 0 99.98 23.17 0.71 0.06038 0.05316 16 4 1 5 0 2982.480 26.51 20.00 23.17 22.26 22.2 995.77 -27311 69955 -34291 -37644 52782 -26034 75860 -38173 -26122 10317 -8348 -39131 -72318 -18819 -19272 52061 30212 33454 5121 21058 12078 -22863 -1309 -14110 8760 2502 20155 -9483 8490 3556 622 -5509 -5313 1572 -17037 -7353 -12193 3287 17638 1467 -2996 -115 12058 -14499 13748 930 10885 -1527 6441 6640 6785 7502 -4229 6577 -3296 8367 5851 3864 -2189 -3378 3692 940 3971 2063 5295 -1167 1457 25 5950 -1522 -1143 -387 -5423 -1276 -2570 1075 -4847 -2122 2276 -3875 -1177 -4513 -2214 -2724 1547 1467 3848 228 1493 311 254 3430 -4092 150 -779 1629 2055 3062 -2634 -1264 -2411 -2910 352 -3014 -1308 -2099 1011 -2432 499 1653 27 1804 -708 517 264 -293 -1004 1397 -165 -1393 1887 -457 1907 388 3242 900 341 104 -790 -403 -21 -1424 -824 380 -134 1816 -59 600 96 454 371 -2604 -485 -955 1088 -1450 -1561 867 -900 1049 -1682 -1084 303 -303 -2130 -6562 -1220 -1482 2204 1723 1966 420 1529 971 -2588 -120 -1512 772 238 1585 -983 734 338 68 -719 -748 209 -2650 -1042 -1992 540 2942 325 -754 -30 2865 -4611 3362 262 2784 -442 1737 1848 2011 2379 -1604 2336 -1328 3255 2346 1567 -936 -1485 1600 458 2050 1149 2850 -636 735 13 3170 -971 -781 -270 -3919 -842 -1587 582 -2591 -1103 1232 -2533 -844 -3673 -1883 -2468 1430 1447 3895 244 1562 316 240 2890 -3508 124 -709 1619 2275 3678 -3508 -1631 -2930 -3286 373 -3432 -1560 -2676 1313 -3451 735 2585 45 2982 -1159 784 375 -404 -1409 2013 -257 -2290 3034 -737 2906 578 4495 1220 453 144 -1185 -650 -35 -2522 -1504 721 -270 3742 -127 1300 209 958 754 -5248 -955 SS 20231002T125019.7Z 8675.534951 281 1 48.86 2 69.15 114.94 72.32 280.87 0.00 1 0.00 1 0 17 3.944e-02 1.009e-02 1.928e-02 2.583e-03 3.117965e-01 1.337561e-03 3.726845e-03 -6.000000e+00 2.343093e-02 227.37 -2.00 3.51 -2.00 319.07 0.00e+00 2.472993e-03 3.238386e-04 1.260837e-03 -6.000000e+00 1.054664e-03 285.75 -2.00 20.00 -2.00 318.27 0.00e+00 2.782 0.000 302.00 328.00 3 3.7179e+00 3.7300e-03 3.2135e-02 -6.0000e+00 5.8029e-02 -1.9476e-02 4.3166e-03 1.6517e-02 -6.0000e+00 6.3043e-02 1.3045e-02 2.9383e-03 8.5891e-03 -6.0000e+00 3.7661e-02 -1.3049e-02 1.5038e-03 2.8608e-03 -6.0000e+00 1.5692e-02 5.6755e-04 8.6782e-04 8.4718e-05 3.4645e-05 -6.0000e+00 1.1973e-03 5.8322e-02 1.4654e-05 12 8 8 10 0 0 99.78 23.20 0.45 0.05832 0.06484 45 10 1 5 0 1085.720 26.51 20.00 23.20 22.63 22.2 998.01 -6268 -1447 -14861 7812 -11811 -2572 -13043 -8574 -12925 -13118 -16213 -18343 5749 -3340 2297 419 2450 -986 -186 1959 -2252 1079 684 2539 -3306 1767 -4514 -4111 -6954 -1758 3240 2007 1353 -4841 -5254 -5863 -4042 -3149 -758 -337 -896 638 -310 1327 351 1865 -911 103 -843 1201 1703 1067 2175 772 1691 789 167 -203 -891 860 1709 3503 3184 2996 -616 -1082 -974 274 2288 1345 954 934 1383 1 229 -2004 -1972 -2430 -2680 -2167 -2600 -2060 -2763 -933 -124 328 1478 1132 1392 811 342 -1339 -1081 -347 -244 -167 791 881 -40 -503 -1509 -1742 -779 -166 -2185 -1404 -1196 -918 1127 1121 1410 272 734 -406 3 -371 281 555 241 414 277 548 1070 793 784 -255 -226 642 153 -322 -1132 -1492 -294 -110 253 -88 735 739 463 22 -425 -1005 -340 -238 -57 -674 293 -500 -97 -588 -415 -710 -747 -976 -1220 348 -261 195 40 244 -107 -21 225 -274 128 83 321 -468 243 -649 -568 -962 -236 449 312 227 -870 -921 -1047 -788 -723 -201 -101 -294 217 -110 469 126 662 -330 37 -303 436 656 446 956 360 807 389 84 -102 -445 427 883 1929 1906 1884 -397 -661 -563 159 1422 939 719 725 1055 1 156 -1266 -1156 -1422 -1698 -1543 -2086 -1799 -2598 -914 -128 361 1691 1325 1605 901 355 -1296 -984 -317 -240 -182 952 1049 -50 -619 -1922 -2067 -897 -198 -2840 -1918 -1555 -1253 1607 1706 2234 437 1129 -591 4 -534 406 842 355 637 432 836 1572 1237 1170 -367 -317 920 236 -489 -1816 -2474 -499 -196 473 -173 1469 1496 938 44 -816 -1876 -632 SS 20231002T132133.4Z 8675.556637 293 1 48.59 2 63.97 121.28 77.80 285.54 0.00 1 0.00 1 0 17 1.887e-02 1.013e-02 1.051e-03 2.770e-04 2.576432e-01 1.429011e-04 3.055131e-03 -6.000000e+00 1.119479e-02 227.37 -2.00 3.51 -2.00 317.96 0.00e+00 1.562683e-03 2.477388e-05 6.091554e-04 -6.000000e+00 5.046873e-04 285.75 -2.00 20.00 -2.00 317.14 0.00e+00 2.265 0.000 302.00 328.00 3 4.8169e-01 3.8197e-04 2.6085e-02 -6.0000e+00 2.7723e-02 -9.3472e-03 4.3355e-04 1.3112e-02 -6.0000e+00 3.0131e-02 3.4850e-03 2.6360e-04 6.4584e-03 -6.0000e+00 1.7998e-02 -9.0002e-03 1.2953e-04 1.9084e-03 -6.0000e+00 7.4905e-03 2.5808e-02 -1.0812e-04 8.9195e-06 2.1750e-05 -6.0000e+00 5.7285e-04 6.1788e-02 -1.7502e-04 12 8 8 10 0 0 14.82 23.13 0.31 0.06179 0.06098 1298 299 1 5 0 37.430 26.51 20.01 23.13 25.21 22.5 1017.55 775 -440 -2119 -5320 -5925 -5041 -3084 -1740 -3757 -6510 -7224 -4508 -2119 -252 381 -389 50 1523 1364 2081 697 726 1413 1833 911 -528 -1953 -2226 -1561 -773 1482 1370 437 -4143 -5785 -4313 -3171 -556 -81 -791 -695 -140 176 381 950 581 16 -287 -483 500 1508 1289 1357 1028 602 1222 186 -412 -371 396 1760 2746 2866 2009 -216 -1204 -1057 -136 2285 1447 841 1194 804 882 -462 -1562 -2403 -2680 -1529 -2043 -2349 -2519 -2776 -1432 -282 365 1203 1070 1389 1116 432 -649 -1189 -165 -257 -158 548 952 5 -849 -1600 -1741 -478 -304 -1754 -1961 -1038 -720 813 1290 1097 637 382 -47 -142 64 365 341 836 235 469 690 1153 734 868 -470 -267 837 23 -442 -1064 -1186 -354 34 169 3 596 653 476 -51 -319 -1142 -483 67 -41 -201 -487 -503 -414 -267 -166 -396 -724 -819 -529 -275 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