File name: Pandora64s1_NewHavenCT_20240709_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240710T050531.9Z 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_20240709_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: 20240709 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 20240709T154843.1Z 8956.658833 5 1 48.46 2 23.86 137.81 60.55 97.95 0.00 1 0.00 1 0 17 9.582e-03 7.675e-03 1.745e-04 1.329e-04 1.462703e-01 7.354396e-05 1.790408e-03 -6.000000e+00 5.895587e-03 232.95 -2.00 3.52 -2.00 314.39 0.00e+00 2.739758e-04 5.689514e-06 1.383695e-05 -6.000000e+00 2.620815e-04 288.84 -2.00 20.00 -2.00 313.77 0.00e+00 1.093 0.000 302.00 328.00 3 1.1429e+00 1.8923e-04 1.3465e-02 -6.0000e+00 1.4797e-02 -8.7343e-03 2.0795e-04 7.7294e-03 -6.0000e+00 1.5930e-02 3.1270e-03 1.1907e-04 3.7327e-03 -6.0000e+00 9.4831e-03 -4.6698e-03 5.1125e-05 1.0274e-03 -6.0000e+00 4.0035e-03 5.0712e-02 1.1320e-04 4.0695e-06 1.5338e-05 -6.0000e+00 2.8543e-04 1.0369e-02 2.5314e-05 11 8 0 10 0 0 95.61 25.06 0.22 0.01037 0.01122 1729 416 1 5 0 27.960 28.84 19.93 25.06 32.27 48.0 1075.79 736 -970 231 -3136 -2924 -638 450 1267 1467 186 -2615 -728 368 -1 992 267 -770 814 313 1643 824 -143 946 798 340 1038 300 -728 -255 854 1751 119 2363 -712 -3754 -1339 -1283 -786 182 -250 -1326 -1185 -501 -1209 -454 -249 -832 -148 -657 -12 1287 745 763 1154 30 825 916 567 315 583 740 1249 952 1763 22 -1060 -68 -1151 1167 1326 58 219 -305 598 111 -406 -410 -1473 -83 -295 -1129 -745 -2132 -1667 -443 -512 -84 -98 635 213 484 458 -414 521 1089 293 -113 903 215 -574 -353 -1156 -1215 469 74 -1325 -226 -839 -241 153 538 87 174 127 36 279 718 -186 522 227 -188 -229 592 -72 1217 928 -353 905 873 354 510 -447 -530 -221 425 -294 -493 187 -101 -489 70 -752 296 -406 94 -1256 -1072 -230 172 530 609 78 -1101 -317 174 0 523 147 -433 465 183 977 491 -86 543 476 210 643 180 -433 -142 470 993 71 1456 -434 -2223 -816 -820 -549 139 -202 -1135 -1042 -446 -1073 -399 -214 -692 -118 -540 -10 1050 637 680 1008 27 741 827 508 281 527 700 1195 960 1797 21 -995 -63 -1077 1116 1328 60 228 -313 610 110 -382 -356 -1262 -75 -282 -1134 -770 -2329 -1839 -520 -610 -104 -123 779 257 535 482 -426 534 1186 334 -134 1098 265 -682 -412 -1339 -1407 550 90 -1683 -286 -1107 -317 210 746 118 229 160 44 330 867 -228 658 302 -252 -303 756 -91 1519 1103 -410 1073 1089 443 658 -588 -686 -298 580 -418 -692 266 -143 -703 99 -1035 SS 20240709T155311.2Z 8956.661935 8 1 48.40 2 23.31 139.99 59.74 98.75 0.00 1 0.00 1 0 17 9.567e-03 7.665e-03 1.782e-04 1.353e-04 1.458673e-01 7.500140e-05 1.774022e-03 -6.000000e+00 5.882662e-03 232.95 -2.00 3.52 -2.00 314.41 0.00e+00 2.687873e-04 5.829191e-06 1.429685e-05 -6.000000e+00 2.616795e-04 288.84 -2.00 20.00 -2.00 313.79 0.00e+00 1.089 0.000 302.00 328.00 3 1.1820e+00 1.9304e-04 1.3399e-02 -6.0000e+00 1.4764e-02 -8.7213e-03 2.1202e-04 7.6780e-03 -6.0000e+00 1.5898e-02 2.7563e-03 1.2147e-04 3.7054e-03 -6.0000e+00 9.4638e-03 -4.6137e-03 5.2132e-05 1.0197e-03 -6.0000e+00 3.9925e-03 4.9055e-02 1.8395e-04 4.1610e-06 1.5273e-05 -6.0000e+00 2.8496e-04 1.3855e-02 1.3020e-06 11 8 0 10 0 0 96.42 24.40 0.21 0.01385 0.01524 1727 416 1 5 0 27.990 28.29 19.96 24.40 33.49 45.8 1077.98 613 -899 177 -3138 -2818 -626 461 1223 1531 42 -2607 -596 354 59 1081 193 -733 840 332 1707 696 -185 961 710 324 1024 213 -782 -225 898 1703 99 2361 -931 -3745 -1378 -1282 -739 251 -338 -1340 -1164 -521 -1263 -383 -315 -790 -208 -679 24 1278 709 834 1133 61 853 930 536 351 570 754 1209 979 1752 -48 -1022 -86 -1204 1224 1252 68 220 -290 613 105 -366 -456 -1481 -46 -387 -1121 -750 -2178 -1640 -410 -512 -68 -76 651 192 516 423 -427 546 1072 280 -100 987 203 -533 -371 -1210 -1209 507 -12 -1289 -238 -776 -234 174 517 83 183 135 37 321 677 -181 521 219 -193 -202 601 -71 1239 849 -362 956 870 386 502 -472 -546 -229 421 -323 -457 210 -75 -438 82 -783 245 -373 71 -1240 -1023 -224 176 509 631 18 -1088 -258 167 31 565 105 -409 475 193 1005 411 -110 584 420 198 628 126 -459 -124 490 956 59 1440 -561 -2193 -833 -814 -513 191 -271 -1135 -1013 -459 -1109 -332 -268 -649 -174 -551 19 1090 601 735 1030 57 758 830 500 325 509 707 1203 976 1763 -48 -946 -79 -1115 1160 1243 72 237 -307 616 102 -339 -390 -1323 -41 -367 -1115 -803 -2353 -1871 -476 -603 -84 -94 787 228 586 459 -434 554 1155 315 -118 1185 246 -651 -427 -1383 -1383 589 -14 -1618 -310 -1011 -317 234 708 110 238 168 44 374 807 -229 678 287 -256 -263 787 -89 1524 994 -434 1119 1072 477 639 -612 -727 -306 591 -453 -658 307 -108 -621 113 -1105 SS 20240709T155815.8Z 8956.665461 11 1 48.43 2 22.72 142.58 58.83 99.67 0.00 1 0.00 1 0 17 9.641e-03 7.696e-03 1.715e-04 1.306e-04 1.448573e-01 7.206031e-05 1.761344e-03 -6.000000e+00 5.927319e-03 232.95 -2.00 3.52 -2.00 314.41 0.00e+00 2.700076e-04 5.582520e-06 1.397334e-05 -6.000000e+00 2.637600e-04 288.84 -2.00 20.00 -2.00 313.78 0.00e+00 1.084 0.000 302.00 328.00 3 1.1174e+00 1.8536e-04 1.3328e-02 -6.0000e+00 1.4876e-02 -1.0322e-02 2.0398e-04 7.6243e-03 -6.0000e+00 1.6020e-02 3.3605e-03 1.1687e-04 3.6807e-03 -6.0000e+00 9.5361e-03 -4.4977e-03 4.9952e-05 1.0141e-03 -6.0000e+00 4.0221e-03 5.2714e-02 2.1691e-04 4.0014e-06 1.5077e-05 -6.0000e+00 2.8717e-04 1.4878e-02 -1.5594e-05 11 8 0 10 0 0 96.76 23.61 0.23 0.01488 0.01651 1900 457 1 5 0 25.440 27.67 19.97 23.61 34.23 44.3 1079.39 604 -864 156 -3227 -2783 -621 476 1358 1497 -50 -2641 -525 351 75 1117 178 -712 873 307 1747 685 -153 917 702 331 1078 154 -775 -238 938 1669 99 2380 -1005 -3797 -1361 -1247 -716 201 -324 -1402 -1127 -512 -1212 -387 -298 -839 -199 -695 63 1264 696 855 1165 83 887 917 513 335 574 763 1229 988 1783 -71 -1013 -145 -1174 1268 1237 74 211 -269 618 79 -405 -492 -1514 1 -398 -1123 -777 -2200 -1634 -430 -487 -62 -48 688 182 520 390 -466 547 1067 261 -74 965 166 -565 -362 -1285 -1188 502 -28 -1292 -214 -819 -199 195 562 89 181 97 3 279 666 -201 547 230 -200 -193 612 -92 1274 808 -335 928 862 376 479 -499 -521 -207 397 -344 -433 215 -96 -460 73 -797 241 -357 67 -1268 -1004 -221 180 562 661 -23 -1180 -226 164 38 580 97 -394 490 176 1021 401 -90 553 413 200 655 90 -451 -130 507 930 58 1439 -600 -2205 -817 -786 -493 152 -271 -1179 -972 -446 -1054 -333 -251 -721 -164 -559 51 1068 584 747 1048 76 821 853 473 307 535 708 1211 976 1775 -71 -927 -132 -1075 1191 1216 77 225 -282 614 76 -371 -440 -1339 1 -374 -1162 -824 -2353 -1846 -495 -592 -75 -59 822 213 584 418 -492 576 1139 291 -86 1196 208 -683 -429 -1452 -1345 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