File name: Pandora55s1_QueensNY_20210602_L2Fit_fout2c11d20210101p1-8.txt File generation date: 20260625T185733.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c11p1-8 Local principal investigator: Lukas Valin Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 55 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora55_OF_v4d20190723.txt Instrument calibration file used: Pandora55s1_CF_v11d20210101.txt Level 1 file used: Pandora55s1_QueensNY_20210602_L1_smca1c11d20210101p1-8.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: 20210602 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: 261 404 Nominal wavelengths inside fitting window [nm]: 305.0145 305.1546 305.2946 305.4346 305.5746 305.7145 305.8545 305.9945 306.1344 306.2744 306.4143 306.5542 306.6941 306.8340 306.9739 307.1138 307.2536 307.3935 307.5333 307.6732 307.8130 307.9528 308.0926 308.2324 308.3722 308.5120 308.6517 308.7915 308.9312 309.0710 309.2107 309.3504 309.4901 309.6298 309.7695 309.9091 310.0488 310.1884 310.3281 310.4677 310.6073 310.7469 310.8865 311.0261 311.1657 311.3053 311.4448 311.5844 311.7239 311.8634 312.0029 312.1424 312.2819 312.4214 312.5609 312.7003 312.8398 312.9792 313.1187 313.2581 313.3975 313.5369 313.6763 313.8156 313.9550 314.0944 314.2337 314.3730 314.5124 314.6517 314.7910 314.9303 315.0695 315.2088 315.3481 315.4873 315.6265 315.7658 315.9050 316.0442 316.1834 316.3226 316.4617 316.6009 316.7401 316.8792 317.0183 317.1574 317.2966 317.4357 317.5747 317.7138 317.8529 317.9919 318.1310 318.2700 318.4090 318.5481 318.6871 318.8260 318.9650 319.1040 319.2429 319.3819 319.5208 319.6598 319.7987 319.9376 320.0765 320.2153 320.3542 320.4931 320.6319 320.7708 320.9096 321.0484 321.1872 321.3260 321.4648 321.6036 321.7423 321.8811 322.0198 322.1586 322.2973 322.4360 322.5747 322.7134 322.8520 322.9907 323.1294 323.2680 323.4066 323.5453 323.6839 323.8225 323.9611 324.0996 324.2382 324.3768 324.5153 324.6538 324.7924 324.9309 --------------------------------------------------------------------------------------- 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 20210602T105106.7Z 7823.452160 187 1 49.12 2 76.10 72.45 53.15 171.23 0.00 1 0.00 1 0 25 4.302e-01 2.288e-02 1.752e-01 4.549e-03 5.665587e-01 2.494649e-03 6.479518e-03 -6.000000e+00 2.631936e-01 232.16 -2.00 3.51 -2.00 320.28 0.00e+00 5.546070e-03 8.914460e-04 6.247325e-04 -6.000000e+00 1.175828e-02 285.43 -2.00 20.00 -2.00 319.60 0.00e+00 4.068 0.001 302.00 328.00 3 3.7797e+00 7.5166e-03 5.1125e-02 -6.0000e+00 6.6073e-01 1.6296e-01 9.2640e-03 3.2019e-02 -6.0000e+00 7.1496e-01 -2.0734e-01 7.7501e-03 1.5590e-02 -6.0000e+00 4.2298e-01 8.5405e-02 3.8778e-03 8.1575e-03 -6.0000e+00 1.7559e-01 1.0424e-04 -1.5221e-03 1.3777e-04 7.7051e-05 -6.0000e+00 1.3131e-02 3.5018e-03 5.5989e-05 12 9 8 11 32 0 89.89 22.75 0.15 0.00350 -0.00794 15 3 1 5 0 3273.840 25.68 19.98 22.75 22.78 28.7 1081.83 11174 900000 -73503 -162089 139215 900000 -77247 900000 107572 -27043 -108792 -113218 10891 -84480 900000 -1670 -67294 64694 900000 186670 251264 16767 76082 -28244 -5092 -31365 14315 -9526 -27805 -11066 -5651 -28823 -4552 -12701 14862 127703 -5377 -3861 52485 -1093 -6439 28462 -11745 2778 12111 44789 -1180 31499 23493 14097 -9870 1517 -8864 21855 19244 9173 2389 8312 5961 5598 -1155 7748 -127 6351 6562 -8594 6453 -3110 11567 5445 -4598 -711 3910 -4282 158 1029 4007 -1401 -1556 -2588 -3398 5533 -1599 576 -900 -1962 -4211 -1744 -2988 174 -1721 -773 304 39 424 586 -2351 -561 -630 -2977 517 27 782 2103 1648 -1255 -272 919 -7 2117 -103 -1947 -214 -285 -1032 171 478 2258 -16 614 -2870 -650 1701 2795 109 -546 486 1579 846 -1177 1002 965 872 659 983 -480 749 -23 -371 -47 -1078 -493 -352 -1034 91 900000 -1671 -8366 617 900000 -1652 900000 492 -461 -4091 -4760 170 -3912 900000 -52 -4391 1371 900000 1463 1114 652 1728 -1745 -268 -2200 671 -552 -1881 -655 -349 -2558 -371 -1216 1122 3340 -492 -388 3694 -148 -1044 3647 -2301 494 2015 5613 -230 4625 3806 2592 -2403 363 -2541 5094 4878 2646 757 2519 1829 1699 -374 2427 -47 2435 2708 -4138 2666 -1374 4641 2527 -2575 -413 2244 -2593 88 528 1842 -644 -730 -1342 -2026 3442 -1164 440 -732 -1692 -3890 -1645 -2906 164 -1602 -678 250 31 345 517 -2355 -616 -756 -3829 650 33 873 2219 1757 -1432 -322 1124 -10 2863 -152 -3095 -346 -463 -1631 258 701 3269 -24 963 -4758 -1064 2693 4287 167 -814 699 2204 1211 -1821 1644 1681 1580 1235 1905 -977 1567 -49 -806 -103 -2314 -1021 -701 -2031 SS 20210602T110205.7Z 7823.459789 190 1 49.89 2 74.11 74.08 52.86 174.51 0.00 1 0.00 1 0 25 9.148e-02 6.357e-03 1.684e-02 9.358e-04 5.282875e-01 4.985429e-04 6.125529e-03 -6.000000e+00 5.510651e-02 232.16 -2.00 3.51 -2.00 319.52 0.00e+00 1.783875e-03 1.426946e-04 4.779444e-04 -6.000000e+00 2.428173e-03 285.43 -2.00 20.00 -2.00 318.79 0.00e+00 3.589 0.001 302.00 328.00 3 1.4611e+00 1.4239e-03 4.5777e-02 -6.0000e+00 1.3812e-01 3.5495e-02 1.6825e-03 2.8445e-02 -6.0000e+00 1.4913e-01 -3.1818e-02 1.3362e-03 1.3707e-02 -6.0000e+00 8.8752e-02 3.9912e-03 6.9397e-04 4.4095e-03 -6.0000e+00 3.7028e-02 1.8010e-03 -8.8726e-04 2.7636e-05 4.7810e-05 -6.0000e+00 2.7336e-03 3.4880e-03 9.1480e-06 12 1 1 12 1 1 97.21 22.73 0.25 0.00349 -0.00318 187 36 1 5 0 265.330 25.68 20.00 22.73 23.22 28.6 1084.39 -39139 -11795 442 -51178 -29623 -32563 -30043 -17368 -17113 -30539 -24874 -26268 -24113 -17529 4853 -2821 -13265 -3024 2852 3035 -3283 2927 -1457 -5489 -5190 -5681 2884 -6348 -4691 -8214 -282 -980 177 -6148 -1080 1314 -982 -1445 935 1197 -1553 -224 -2905 -1093 -1137 1685 -1397 1216 768 1519 354 623 922 2034 1783 766 1325 -417 832 661 1089 1665 1355 624 147 34 1193 1112 1887 1149 -5 -349 -523 -663 -297 -231 513 810 1176 -86 119 -480 -1467 -1313 -1231 -1121 -926 -640 -601 -377 54 649 628 1237 1408 1337 591 692 -352 -844 -336 -471 160 834 29 -1040 -646 -647 -132 -59 -22 -503 -151 -64 -28 632 899 964 378 -95 -866 -414 -189 -186 21 -15 456 1357 892 142 413 -17 330 189 274 -326 -135 253 -384 -635 -158 -153 -13 176 -582 -171 6 -1121 -496 -539 -503 -288 -321 -719 -587 -682 -717 -602 164 -123 -679 -154 148 167 -201 172 -92 -382 -391 -460 221 -527 -375 -690 -24 -97 20 -805 -137 160 -127 -200 153 235 -340 -53 -752 -288 -306 447 -388 333 216 441 111 202 329 778 729 332 591 -182 376 295 486 737 662 341 83 19 654 598 1046 712 -3 -255 -377 -493 -208 -156 312 462 680 -56 85 -377 -1242 -1203 -1148 -1114 -938 -679 -652 -405 56 645 606 1137 1323 1323 642 821 -453 -1123 -442 -604 193 945 34 -1296 -819 -833 -180 -84 -34 -796 -247 -103 -43 947 1330 1427 566 -151 -1402 -671 -298 -293 32 -22 654 1938 1266 214 665 -29 587 342 506 -624 -271 506 -787 -1304 -314 -299 -26 325 SS 20210602T111243.2Z 7823.467166 193 1 49.74 2 72.17 75.65 52.69 177.71 0.00 1 0.00 1 0 25 4.201e-02 6.129e-03 8.028e-03 6.772e-04 4.775763e-01 3.587060e-04 5.574425e-03 -6.000000e+00 2.531218e-02 232.16 -2.00 3.51 -2.00 319.07 0.00e+00 9.551508e-04 8.822648e-05 3.730012e-04 -6.000000e+00 1.115253e-03 285.43 -2.00 20.00 -2.00 318.31 0.00e+00 3.221 0.001 302.00 328.00 3 1.2596e+00 1.0017e-03 4.1134e-02 -6.0000e+00 6.3445e-02 2.5225e-02 1.1588e-03 2.5462e-02 -6.0000e+00 6.8500e-02 -2.4219e-02 8.4925e-04 1.2262e-02 -6.0000e+00 4.0766e-02 2.4878e-03 4.4260e-04 3.5656e-03 -6.0000e+00 1.7010e-02 3.3393e-03 -7.2973e-04 2.0286e-05 4.0991e-05 -6.0000e+00 1.2555e-03 3.0602e-03 1.7307e-05 10 0 0 10 0 0 79.28 22.73 0.19 0.00306 -0.00242 306 58 1 5 0 162.320 25.68 19.98 22.73 23.92 28.8 1089.27 -20467 -6115 -7013 -20821 -11902 -13114 -15080 -8365 -8325 -11216 -10795 -13298 -12622 -6436 1659 -1862 -4100 -6066 1597 2195 -1482 1988 -286 -1357 -1935 -2168 -254 -3174 -2283 -2174 62 850 922 -2860 231 964 -31 -244 1072 -122 -1544 -770 -2384 -1052 -1020 328 -1112 54 -70 916 584 1000 842 1272 1119 506 1119 -22 620 541 1315 1555 1462 484 -253 -2 473 962 1713 1244 -94 -272 -658 -484 -672 -115 541 790 1312 217 -26 -509 -1380 -1297 -1174 -1109 -817 -497 -459 -360 -38 399 547 1550 1509 1269 758 726 -438 -598 -486 -505 185 801 -96 -1064 -551 -806 -165 -73 -167 -448 -317 -60 3 646 842 952 561 -179 -846 -475 -172 -195 104 104 493 1345 980 318 363 -22 249 189 287 -279 -129 141 -353 -549 -209 -135 -123 140 -479 -145 -167 -568 -306 -326 -396 -230 -238 -361 -365 -493 -535 -311 89 -122 -308 -467 122 177 -129 171 -26 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