File name: Pandora64s1_NewHavenCT_20240103_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240113T052342.5Z Data description: Level 2 spectral fitting results file Data file version: fout2c4p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 64 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora64_OF_v3d20190516.txt Instrument calibration file used: Pandora64s1_CF_v4d20190911.txt Level 1 file used: Pandora64s1_NewHavenCT_20240103_L1_smca1c4d20190911p1-8.txt Full location name: New Haven - Criscuolo Park CTDEEP (USEPA AQS ID 34-017-0006) Short location name: NewHavenCT Country of location: USA Location latitude [deg]: 41.3014 Location longitude [deg]: -72.9029 Location altitude [m]: 4 Local noon date: 20240103 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: Mod WL cal slit func 9 First and last pixel inside fitting window: 249 390 Nominal wavelengths inside fitting window [nm]: 305.1279 305.2688 305.4097 305.5506 305.6915 305.8324 305.9732 306.1141 306.2549 306.3958 306.5366 306.6774 306.8182 306.9590 307.0997 307.2405 307.3812 307.5220 307.6627 307.8034 307.9441 308.0848 308.2255 308.3662 308.5068 308.6475 308.7881 308.9287 309.0693 309.2099 309.3505 309.4911 309.6316 309.7722 309.9127 310.0533 310.1938 310.3343 310.4748 310.6153 310.7557 310.8962 311.0366 311.1771 311.3175 311.4579 311.5983 311.7387 311.8791 312.0195 312.1598 312.3002 312.4405 312.5808 312.7211 312.8614 313.0017 313.1420 313.2822 313.4225 313.5627 313.7030 313.8432 313.9834 314.1236 314.2638 314.4039 314.5441 314.6842 314.8244 314.9645 315.1046 315.2447 315.3848 315.5249 315.6649 315.8050 315.9450 316.0851 316.2251 316.3651 316.5051 316.6451 316.7850 316.9250 317.0649 317.2049 317.3448 317.4847 317.6246 317.7645 317.9044 318.0442 318.1841 318.3239 318.4638 318.6036 318.7434 318.8832 319.0230 319.1628 319.3025 319.4423 319.5820 319.7217 319.8614 320.0011 320.1408 320.2805 320.4202 320.5598 320.6995 320.8391 320.9787 321.1183 321.2579 321.3975 321.5371 321.6766 321.8162 321.9557 322.0953 322.2348 322.3743 322.5138 322.6532 322.7927 322.9322 323.0716 323.2110 323.3504 323.4899 323.6292 323.7686 323.9080 324.0474 324.1867 324.3260 324.4654 324.6047 324.7440 324.8833 --------------------------------------------------------------------------------------- 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 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: 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 20240103T134344.8Z 8768.572047 312 1 48.85 2 78.07 135.53 62.51 239.41 0.00 1 0.00 1 0 17 3.869e-01 1.674e-02 9.533e-02 4.459e-03 6.772638e-01 2.442927e-03 8.062651e-03 -6.000000e+00 2.298531e-01 223.32 -2.00 3.52 -2.00 320.72 0.00e+00 8.959395e-03 9.700138e-04 2.395425e-03 -6.000000e+00 1.002016e-02 275.73 -2.00 20.00 -2.00 320.24 0.00e+00 4.691 0.002 302.00 328.00 3 3.3419e+00 7.4280e-03 5.8517e-02 -6.0000e+00 5.6647e-01 3.0212e-01 9.3750e-03 3.5545e-02 -6.0000e+00 6.1524e-01 -3.1534e-01 8.7665e-03 2.2591e-02 -6.0000e+00 3.6620e-01 1.2286e-01 4.3722e-03 1.1613e-02 -6.0000e+00 1.5599e-01 7.6505e-05 -1.4369e-03 1.2803e-04 1.5576e-04 -6.0000e+00 1.1489e-02 -1.0770e-03 -1.0282e-04 12 9 8 11 8 0 98.88 21.48 -0.11 -0.00108 -0.01187 23 6 1 5 0 2123.440 26.00 20.01 21.48 7.08 37.0 941.98 -137922 -134218 -127242 -155178 -98274 -155784 -128872 -127408 11448 -71347 -129293 -73517 -72288 -58058 -55854 -46497 -49732 -20583 -22125 -15242 -15030 7747 60473 -3007 -21388 -20988 -9679 -20063 -13309 -68541 -4299 -7256 23536 5899 7994 -8997 10738 -3568 6289 3238 9965 3626 8688 -5294 6794 8482 11893 5182 10053 -7443 12483 13178 17679 5653 8808 5665 4111 2771 5616 743 3723 2487 4887 9468 8335 1463 2663 4091 4770 3000 2045 1860 1441 1204 -2257 -3107 3004 -3779 -3327 -504 -2380 -6222 -2405 -2646 -484 -1087 726 -464 2364 510 -1063 201 -4145 -2380 -1056 510 -770 1032 841 -492 -1031 -1438 -3360 -429 -329 -2417 -1407 355 -671 993 1117 78 -260 73 -408 -885 874 -122 1004 1128 104 637 1192 1654 1842 732 -1802 1184 1343 76 269 -619 -680 -298 452 -138 63 392 407 -662 -296 -1392 -2999 -2952 -2905 -4088 -1538 -3825 -2697 -2839 84 -1096 -3549 -1418 -1807 -1625 -1800 -1606 -1972 -674 -775 -519 -507 219 1122 -103 -853 -859 -354 -806 -524 -5116 -218 -438 1192 362 458 -640 703 -299 568 346 1081 445 1066 -762 891 1129 1580 775 1510 -1369 2105 2422 3358 1299 2020 1376 1021 682 1315 185 960 728 1576 3061 2771 510 940 1491 1944 1396 1016 939 700 546 -960 -1219 1148 -1558 -1587 -275 -1446 -4424 -1761 -2054 -393 -890 606 -396 1928 421 -832 149 -3175 -1933 -924 506 -847 1253 1066 -612 -1196 -1579 -3561 -461 -359 -2808 -1736 465 -943 1467 1789 129 -428 116 -616 -1372 1368 -192 1649 1868 169 988 1861 2461 2652 1035 -2593 1808 2222 136 520 -1225 -1421 -635 1015 -322 148 927 942 -1461 -639 -2885 SS 20240103T134915.0Z 8768.575868 315 1 22.52 2 77.35 136.60 63.40 240.54 0.00 1 0.00 1 0 33 3.204e-01 9.079e-03 7.644e-02 2.628e-03 6.593313e-01 1.429232e-03 7.572941e-03 -6.000000e+00 1.903949e-01 223.33 -2.00 3.52 -2.00 320.47 0.00e+00 2.034646e-03 5.480849e-04 1.064329e-03 -6.000000e+00 8.298883e-03 275.73 -2.00 20.00 -2.00 319.99 0.00e+00 4.444 0.002 302.00 328.00 3 2.0699e+00 4.2682e-03 5.5838e-02 -6.0000e+00 4.6923e-01 8.1753e-02 5.4567e-03 3.4540e-02 -6.0000e+00 5.0957e-01 -7.9614e-02 5.4055e-03 1.8710e-02 -6.0000e+00 3.0330e-01 2.5541e-02 2.7156e-03 6.4527e-03 -6.0000e+00 1.2925e-01 3.7983e-04 -6.6961e-04 7.6037e-05 8.0531e-05 -6.0000e+00 9.5149e-03 -1.9065e-03 -5.5119e-05 12 9 1 12 9 1 92.97 21.47 0.13 -0.00191 -0.00694 43 23 1 5 0 511.600 26.00 19.98 21.47 7.35 37.0 943.14 -126022 -110142 -87226 -98302 -119352 -95496 -143043 -92865 -83071 -74521 -102549 -52416 -67291 -44837 -44260 -29317 -30229 3211 -33990 -15575 -13138 1715 -12663 -4543 -17573 -6610 -26774 -14606 -14903 -33540 1988 -6545 -7229 -5248 -9255 -4526 -984 607 -761 3685 2412 1245 3118 -764 972 1462 2343 1335 1430 -680 4886 -215 5488 1790 2804 1989 2370 821 1474 -370 2133 1568 3361 3454 3334 -940 551 -381 1587 2078 781 1272 -449 289 -287 -1669 -129 -2620 -1389 -109 -892 -1986 -1920 -2011 -674 -498 717 564 1544 845 -6 446 -1245 -446 238 358 -443 1083 589 -274 -423 -1629 -2143 -70 360 -1490 -790 -618 -358 493 841 286 114 -40 -479 -385 271 311 747 700 -122 -101 815 207 989 527 -1570 338 1010 347 334 -721 -960 -405 666 -119 -405 559 456 -222 -85 -666 -1350 -1129 -827 -982 -1407 -930 -2266 -1118 -1022 -916 -1648 -685 -1191 -804 -979 -656 -760 64 -1053 -424 -355 41 -378 -136 -643 -228 -1135 -538 -569 -1758 88 -364 -465 -339 -601 -299 -72 48 -75 403 294 163 421 -109 139 214 351 212 241 -128 977 -46 1216 446 723 539 652 226 394 -102 608 502 1190 1347 1321 -381 226 -166 715 1049 425 701 -243 145 -131 -765 -57 -1259 -709 -64 -610 -1445 -1496 -1665 -591 -458 634 504 1436 749 -5 356 -1002 -385 218 375 -502 1351 767 -348 -500 -1872 -2358 -79 406 -1784 -1006 -847 -512 734 1352 474 187 -63 -720 -598 430 486 1222 1158 -198 -157 1292 316 1452 753 -2276 525 1663 602 629 -1376 -1937 -863 1429 -265 -915 1264 1011 -468 -179 -1338 SS 20240103T140501.7Z 8768.586825 325 1 48.39 2 75.38 139.74 66.01 243.69 0.00 1 0.00 1 0 25 1.561e-01 7.428e-03 1.298e-02 5.651e-04 5.811970e-01 3.022866e-04 6.759674e-03 -6.000000e+00 9.275231e-02 223.33 -2.00 3.52 -2.00 319.91 0.00e+00 1.902474e-03 9.741153e-05 6.345832e-04 -6.000000e+00 4.042826e-03 275.73 -2.00 20.00 -2.00 319.39 0.00e+00 3.881 0.001 302.00 328.00 3 5.3302e-01 8.6683e-04 4.8785e-02 -6.0000e+00 2.2859e-01 4.1834e-02 1.0513e-03 2.9966e-02 -6.0000e+00 2.4824e-01 -2.3187e-02 9.5353e-04 1.5811e-02 -6.0000e+00 1.4776e-01 -1.4829e-03 4.9428e-04 5.3897e-03 -6.0000e+00 6.2964e-02 3.2902e-03 -5.9814e-04 1.6619e-05 6.2902e-05 -6.0000e+00 4.6352e-03 -2.0217e-03 -5.7022e-05 11 8 0 10 0 0 99.40 21.49 0.20 -0.00202 -0.00652 641 154 1 5 0 75.480 26.00 20.00 21.49 9.25 37.1 952.73 -52009 -61313 -33869 -61239 -83573 -58828 -46772 -47614 -34642 -40640 -37048 -34084 -19394 -18369 -7396 -8038 -6246 -3730 -3520 -2662 -1316 -3617 -3679 -1878 -4673 -3646 -4937 -6524 -6714 -4493 -591 198 1603 -437 -5502 -3202 -2944 -145 76 685 -1024 -430 117 -366 -50 494 -261 701 -379 229 1533 -620 1201 2044 287 1133 883 515 -227 376 644 1792 1804 3182 1088 -905 74 -937 1052 1945 805 778 16 240 -354 -1362 -1228 -2164 -676 -443 -1086 -769 -1837 -1987 -457 -324 576 548 1302 682 453 223 -700 -250 633 251 -47 1146 745 -343 -445 -1796 -1926 140 479 -1403 -367 -788 -212 304 864 280 137 5 -287 -333 495 -23 792 502 -181 -331 696 198 925 487 -1363 193 828 198 295 -697 -743 -434 465 -104 -437 501 443 -185 205 -639 -585 -841 -371 -830 -1349 -775 -606 -708 -508 -683 -643 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