File name: Pandora64s1_NewHavenCT_20240329_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240330T050210.1Z 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_20240329_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: 20240329 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 20240329T142227.4Z 8854.598928 341 1 47.01 2 50.95 126.98 110.27 256.07 0.00 1 0.00 1 0 25 1.353e-02 8.376e-03 3.330e-03 1.341e-03 2.772841e-01 7.158348e-04 3.352639e-03 -6.000000e+00 8.166052e-03 227.30 -2.00 3.52 -2.00 316.66 0.00e+00 4.198348e-04 8.754152e-05 1.024809e-04 -6.000000e+00 3.544377e-04 278.39 -2.00 20.00 -2.00 316.04 0.00e+00 1.584 0.000 302.00 328.00 3 4.8703e+00 1.8638e-03 2.1420e-02 -6.0000e+00 2.0290e-02 2.0151e-02 2.0780e-03 1.4176e-02 -6.0000e+00 2.1959e-02 -1.9774e-03 1.2207e-03 7.0105e-03 -6.0000e+00 1.3051e-02 -3.1417e-03 5.8000e-04 1.9932e-03 -6.0000e+00 5.5324e-03 5.7619e-04 -1.2659e-04 4.1350e-05 2.5272e-05 -6.0000e+00 4.0226e-04 -3.6099e-03 3.1534e-05 12 9 1 12 1 1 99.26 21.55 0.09 -0.00361 -0.00456 24 6 1 5 0 1880.040 26.00 20.00 21.55 13.18 38.0 979.81 -356 -949 -28 -4942 -4656 -3464 -364 -2026 2951 -1666 -4140 -2439 279 -1707 1973 -9 -341 1438 559 1604 1548 -114 2008 969 906 886 526 -1700 -768 -2366 1357 -74 3169 -1080 -4449 -2445 -1357 -1196 -54 237 -723 -1353 179 -1384 155 418 -308 -302 -653 -904 1483 1210 1141 1391 449 546 1348 702 250 244 438 1480 861 2474 793 -1568 -570 -1692 507 1660 435 718 -141 507 57 -1020 -454 -1793 -968 60 -1401 -1131 -2023 -1743 -587 -439 -147 202 1025 619 16 519 -1007 -223 811 558 -4 1092 754 -447 -544 -1537 -1823 236 308 -1300 -393 -509 -205 580 1015 313 322 61 -189 -474 518 -204 734 405 -111 -282 752 79 1220 839 -1089 417 951 378 408 -643 -671 -408 504 -44 -481 498 244 -476 62 -912 -52 -146 -4 -723 -625 -465 -51 -322 487 -297 -752 -472 56 -397 501 -3 -99 431 174 481 467 -35 629 323 315 315 183 -566 -260 -779 464 -27 1224 -430 -1725 -974 -600 -583 -29 144 -448 -876 117 -919 101 271 -197 -190 -408 -583 999 867 818 1045 346 431 1066 552 195 192 344 1240 776 2187 719 -1347 -468 -1408 455 1563 419 707 -137 488 50 -865 -375 -1483 -823 55 -1418 -1196 -2176 -1975 -679 -536 -179 250 1238 736 18 571 -1055 -235 877 639 -5 1434 976 -584 -669 -1845 -2149 291 389 -1735 -528 -715 -292 841 1519 465 472 87 -250 -630 696 -279 1023 589 -163 -405 1078 109 1644 1085 -1386 545 1274 538 586 -952 -987 -627 787 -71 -799 807 405 -771 96 -1441 SS 20240329T142749.0Z 8854.602650 344 1 48.32 2 50.15 128.37 111.22 256.83 0.00 1 0.00 1 0 25 1.352e-02 8.038e-03 1.296e-03 5.782e-04 2.694229e-01 3.091357e-04 3.273268e-03 -6.000000e+00 8.156218e-03 227.30 -2.00 3.52 -2.00 316.39 0.00e+00 4.198492e-04 3.557286e-05 6.091849e-05 -6.000000e+00 3.540361e-04 278.39 -2.00 20.00 -2.00 315.78 0.00e+00 1.557 0.000 302.00 328.00 3 3.3730e+00 8.0236e-04 2.0954e-02 -6.0000e+00 2.0265e-02 6.6329e-03 8.9336e-04 1.3788e-02 -6.0000e+00 2.1934e-02 2.2840e-03 5.2002e-04 6.8176e-03 -6.0000e+00 1.3036e-02 -3.9150e-03 2.4394e-04 1.9423e-03 -6.0000e+00 5.5252e-03 2.6925e-03 -1.8965e-04 1.7851e-05 2.5177e-05 -6.0000e+00 4.0185e-04 -3.2762e-03 6.1218e-06 11 9 0 11 8 0 97.83 21.52 0.20 -0.00328 -0.00470 121 29 1 5 0 399.240 26.00 20.02 21.52 13.43 38.0 981.32 -11 -778 -118 -3716 -9242 -1964 -1825 452 832 -146 -4326 -1918 -610 -19 902 822 -828 1099 294 1683 1088 -360 1144 1187 553 1338 453 -1079 -601 -322 1792 98 2329 3 -4098 -2339 -1364 -1152 181 102 -924 -1043 -153 -946 -324 57 -518 -12 -501 -461 1267 896 931 1429 207 844 1164 607 278 207 636 1221 1192 2255 656 -1340 -342 -1611 688 1468 288 411 -280 520 170 -758 -671 -1884 -569 -215 -1242 -799 -2071 -2110 -620 -529 74 115 860 396 388 425 -751 59 927 409 -143 1255 747 -384 -495 -1452 -1782 304 426 -1320 -300 -693 -287 273 806 310 220 97 -246 -116 515 -189 568 420 -104 -194 650 117 1062 944 -795 648 1095 484 555 -451 -693 -376 517 -188 -535 301 156 -491 -35 -785 -2 -133 -20 -598 -1449 -316 -290 78 156 -28 -875 -410 -147 -5 253 248 -263 360 100 586 383 -128 420 425 207 510 170 -413 -220 -120 704 39 969 1 -1690 -994 -644 -594 102 65 -598 -702 -105 -651 -222 39 -345 -8 -325 -307 887 668 689 1105 165 684 950 492 223 169 511 1052 1043 2035 578 -1173 -287 -1367 628 1406 281 411 -275 508 153 -655 -570 -1600 -492 -198 -1213 -850 -2238 -2411 -719 -647 90 141 1039 473 447 452 -792 62 1005 469 -174 1637 959 -499 -604 -1740 -2101 374 537 -1757 -401 -969 -407 392 1192 455 319 136 -322 -152 688 -256 784 604 -150 -276 892 159 1429 1215 -1006 841 1452 683 785 -658 -1041 -569 793 -300 -873 479 255 -781 -53 -1222 SS 20240329T143246.9Z 8854.606098 347 1 48.39 2 49.43 129.68 112.10 257.54 0.00 1 0.00 1 0 25 1.213e-02 7.915e-03 8.067e-04 3.722e-04 2.651885e-01 1.993689e-04 3.221582e-03 -6.000000e+00 7.321189e-03 227.30 -2.00 3.52 -2.00 316.31 0.00e+00 3.137914e-04 2.235085e-05 6.447500e-05 -6.000000e+00 3.177970e-04 278.40 -2.00 20.00 -2.00 315.71 0.00e+00 1.534 0.000 302.00 328.00 3 2.5402e+00 5.1660e-04 2.0631e-02 -6.0000e+00 1.8190e-02 4.0383e-03 5.7538e-04 1.3562e-02 -6.0000e+00 1.9688e-02 2.1491e-03 3.3416e-04 6.7089e-03 -6.0000e+00 1.1702e-02 -3.6875e-03 1.5554e-04 1.9031e-03 -6.0000e+00 4.9593e-03 6.3901e-03 -2.4580e-04 1.1459e-05 2.4467e-05 -6.0000e+00 3.6072e-04 -3.3475e-03 -1.0068e-05 11 9 0 11 8 0 95.50 21.52 0.20 -0.00335 -0.00519 301 72 1 5 0 160.740 26.00 20.01 21.52 13.66 38.0 982.18 336 -1520 -522 -3764 -6490 -2149 -884 282 743 -647 -3757 -1842 -398 -145 1154 880 -578 1000 377 1614 1229 -305 917 972 508 1244 618 -969 -780 4 1844 201 2545 -26 -4338 -2236 -1663 -938 298 109 -954 -995 -121 -925 -299 101 -641 -88 -784 -298 1199 985 755 1320 304 770 1154 511 122 316 498 1347 1149 2253 610 -1351 -342 -1490 598 1578 249 436 -188 584 146 -669 -622 -1817 -373 -200 -1107 -721 -2085 -2099 -621 -512 -31 62 847 386 396 484 -682 53 861 362 -84 1160 630 -421 -427 -1413 -1708 323 443 -1338 -286 -817 -311 293 771 317 213 98 -189 -99 548 -205 610 395 -117 -225 665 56 1038 958 -778 631 1076 418 565 -449 -669 -387 449 -142 -495 306 137 -471 -24 -832 58 -280 -96 -645 -1053 -337 -148 52 148 -135 -802 -418 -101 -38 341 280 -193 345 125 549 421 -106 329 367 200 499 243 -362 -279 2 703 83 1103 -11 -1871 -991 -767 -503 175 68 -643 -697 -82 -626 -201 71 -444 -60 -530 -206 823 718 580 1003 237 613 924 407 96 252 415 1139 1040 2103 556 -1160 -295 -1303 536 1483 251 449 -190 560 136 -595 -517 -1505 -331 -189 -1111 -753 -2317 -2359 -710 -618 -37 75 1053 455 449 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