File name: Pandora64s1_NewHavenCT_20240703_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240704T050743.0Z 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_20240703_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: 20240703 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 20240703T120021.5Z 8950.500249 191 1 38.19 2 63.35 82.04 36.65 101.46 0.00 1 0.00 1 0 25 1.564e-02 7.719e-03 7.029e-03 1.923e-03 3.162326e-01 1.045603e-03 3.772720e-03 -6.000000e+00 9.644293e-03 232.95 -2.00 3.52 -2.00 317.50 0.00e+00 4.236230e-04 1.600380e-04 1.766533e-04 -6.000000e+00 4.269862e-04 288.26 -2.00 20.00 -2.00 316.68 0.00e+00 2.217 0.000 302.00 328.00 3 4.5778e+00 2.7856e-03 2.7962e-02 -6.0000e+00 2.4213e-02 4.5369e-02 3.1175e-03 1.6737e-02 -6.0000e+00 2.6046e-02 -1.0342e-02 1.8893e-03 8.0835e-03 -6.0000e+00 1.5499e-02 -1.4889e-03 9.3136e-04 2.2044e-03 -6.0000e+00 6.5608e-03 3.8900e-04 -5.3635e-04 5.9415e-05 2.6715e-05 -6.0000e+00 4.6572e-04 -8.5481e-03 -4.8572e-06 12 9 1 12 1 1 99.64 21.88 0.18 -0.00855 -0.01258 18 6 1 5 0 2009.810 26.32 20.01 21.88 29.10 39.8 1051.04 -725 -2860 2862 -3647 530 -3209 -945 -5704 3850 -2005 -6254 -2230 -1289 -2389 1005 547 -768 1087 473 905 2528 514 4065 2090 1275 351 1146 -1733 458 -4451 2592 -22 1747 -601 -4819 -3016 -2131 -2652 615 -798 -688 -1278 7 -1827 -194 -441 -576 -638 -859 -1685 1369 1670 1625 951 677 483 1185 844 841 477 998 1442 741 2091 1088 -1070 -184 -346 939 1492 584 406 -240 368 -62 -547 202 -1776 -969 -31 -1673 -1497 -1738 -1721 -318 -628 193 276 1101 627 58 660 -1090 188 576 548 -210 1105 370 -559 -455 -1184 -1751 63 43 -1319 -635 -132 -137 154 697 212 126 188 -211 -233 637 -57 444 423 -90 -308 756 58 867 682 -806 419 1142 433 494 -646 -472 -436 573 -47 -316 118 284 -428 30 -830 -65 -276 265 -331 43 -271 -84 -598 402 -231 -754 -282 -186 -374 174 104 -154 226 103 204 567 117 941 523 336 96 306 -447 111 -1171 692 -6 516 -181 -1525 -921 -724 -1065 268 -401 -370 -681 4 -1011 -106 -241 -310 -360 -485 -934 792 1028 1057 623 455 334 824 583 573 329 718 1117 590 1728 882 -868 -143 -271 763 1345 537 384 -224 325 -54 -448 154 -1365 -806 -27 -1589 -1489 -1831 -1916 -359 -754 230 334 1305 738 67 695 -1149 199 628 632 -258 1468 488 -747 -572 -1449 -2099 79 55 -1713 -865 -188 -198 229 1071 325 192 268 -292 -312 863 -81 647 641 -137 -461 1090 84 1183 930 -1077 577 1613 629 754 -983 -739 -716 956 -81 -541 205 489 -741 49 -1352 SS 20240703T120439.7Z 8950.503238 194 1 30.47 2 62.55 82.70 35.87 102.35 0.00 1 0.00 1 0 17 1.355e-02 7.159e-03 1.867e-03 6.231e-04 3.044755e-01 3.392764e-04 3.630123e-03 -6.000000e+00 8.354762e-03 232.95 -2.00 3.52 -2.00 317.12 0.00e+00 4.650029e-04 4.713879e-05 1.055133e-04 -6.000000e+00 3.698754e-04 288.26 -2.00 20.00 -2.00 316.30 0.00e+00 2.158 0.000 302.00 328.00 3 2.3581e+00 8.9931e-04 2.7079e-02 -6.0000e+00 2.0975e-02 1.6532e-02 1.0026e-03 1.6060e-02 -6.0000e+00 2.2562e-02 -5.7586e-03 5.9317e-04 7.7580e-03 -6.0000e+00 1.3426e-02 -2.0531e-03 2.8613e-04 2.1355e-03 -6.0000e+00 5.6843e-03 3.9172e-03 -2.2189e-04 1.9217e-05 2.5781e-05 -6.0000e+00 4.0331e-04 -8.7356e-03 3.3427e-05 12 9 1 12 1 1 99.88 21.88 0.17 -0.00874 -0.01040 143 55 1 5 0 211.550 26.32 20.01 21.88 29.39 39.8 1052.66 1090 -2622 446 -4898 -8798 -3414 -415 -1308 823 -1230 -3093 -3021 -16 -1311 1096 7 -696 667 694 1230 1287 -481 1300 1280 233 368 459 -1480 -498 -461 2017 -251 1938 -10 -3808 -2353 -1299 -1121 166 201 -911 -1124 -420 -789 -533 79 -640 84 -469 -66 1194 1212 637 1558 198 842 1143 797 157 515 521 1395 955 1986 639 -1283 -151 -1083 610 1593 150 352 -411 390 76 -621 -398 -1557 -511 -118 -1262 -726 -2006 -1951 -647 -538 -36 125 541 458 321 634 -443 285 1054 457 -101 887 448 -564 -331 -1228 -1517 135 431 -1396 -293 -704 -255 94 582 181 124 147 60 91 695 -171 545 298 -104 -396 622 76 978 1108 -634 570 941 305 477 -467 -509 -325 422 -131 -513 258 121 -519 53 -653 123 -298 54 -578 -996 -371 -47 -168 114 -165 -423 -450 -3 -253 235 2 -173 159 172 316 334 -127 353 368 71 115 140 -433 -139 -132 613 -84 687 -4 -1344 -858 -489 -495 80 111 -509 -656 -251 -473 -320 47 -377 48 -272 -39 754 816 429 1096 144 626 859 595 117 385 408 1105 817 1672 529 -1061 -120 -871 532 1453 140 337 -388 367 66 -519 -311 -1214 -430 -105 -1206 -758 -2133 -2192 -738 -650 -44 152 649 544 352 674 -469 304 1151 530 -124 1132 590 -723 -415 -1510 -1826 162 555 -1822 -400 -969 -371 139 894 277 182 209 84 121 941 -235 793 436 -154 -571 902 105 1340 1452 -852 757 1336 443 699 -708 -796 -513 677 -219 -879 448 208 -868 85 -1065 SS 20240703T120859.7Z 8950.506247 197 1 48.05 2 61.75 83.36 35.09 103.28 0.00 1 0.00 1 0 17 1.123e-02 7.066e-03 8.915e-04 2.958e-04 2.973359e-01 1.610446e-04 3.555973e-03 -6.000000e+00 6.924568e-03 232.95 -2.00 3.52 -2.00 317.13 0.00e+00 2.921898e-04 2.247248e-05 1.319896e-04 -6.000000e+00 3.065577e-04 288.26 -2.00 20.00 -2.00 316.33 0.00e+00 2.102 0.000 302.00 328.00 3 1.3695e+00 4.2662e-04 2.6421e-02 -6.0000e+00 1.7385e-02 1.0890e-02 4.7511e-04 1.5719e-02 -6.0000e+00 1.8700e-02 -4.3618e-03 2.8205e-04 7.5871e-03 -6.0000e+00 1.1128e-02 -3.0199e-03 1.3652e-04 2.0659e-03 -6.0000e+00 4.7113e-03 1.1280e-02 -1.7281e-04 9.1387e-06 2.5455e-05 -6.0000e+00 3.3426e-04 -8.7809e-03 3.5885e-05 11 8 0 10 0 0 99.95 21.88 0.17 -0.00878 -0.01008 856 206 1 5 0 56.120 26.21 19.97 21.88 29.81 39.8 1055.41 1260 -1560 134 -3494 -5303 -2582 -445 -228 552 -575 -3332 -2307 -11 -618 837 322 -770 562 245 1296 1103 -609 842 676 365 548 168 -1359 -1012 -246 1664 -221 1953 -211 -4343 -2259 -1542 -946 162 11 -858 -1028 -136 -928 -443 80 -675 11 -506 -207 1164 735 725 1459 293 852 1149 720 285 636 691 1451 1145 2029 679 -1143 -113 -1103 699 1610 199 387 -311 386 89 -769 -545 -1622 -503 -269 -1215 -753 -1901 -1945 -493 -547 -18 14 732 468 336 637 -420 234 983 432 -124 892 471 -545 -391 -1304 -1512 120 396 -1373 -256 -675 -308 232 590 240 162 167 34 108 708 -124 563 309 -161 -363 524 32 864 1036 -666 567 961 279 483 -461 -568 -356 410 -73 -538 237 131 -439 33 -594 143 -176 17 -408 -581 -279 -51 -29 77 -77 -457 -341 -2 -118 179 75 -189 144 60 328 282 -158 226 193 109 168 51 -390 -279 -69 496 -72 674 -74 -1500 -800 -609 -405 82 6 -496 -621 -79 -541 -275 50 -410 7 -302 -127 709 479 499 1051 206 609 831 517 203 456 519 1169 938 1728 567 -956 -90 -897 581 1480 187 372 -295 367 78 -650 -430 -1278 -427 -242 -1161 -787 -2015 -2180 -560 -658 -21 17 870 553 386 674 -444 249 1069 496 -151 1175 612 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