File name: Pandora64s1_NewHavenCT_20240713_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240714T050609.8Z 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_20240713_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: 20240713 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 20240713T152059.2Z 8960.639574 233 1 13.25 2 28.24 126.60 109.00 84.46 0.00 1 0.00 1 0 17 9.788e-03 7.794e-03 3.801e-04 2.900e-04 1.535833e-01 1.606331e-04 1.864873e-03 -6.000000e+00 6.020752e-03 232.95 -2.00 3.52 -2.00 314.40 0.00e+00 2.918911e-04 1.244264e-05 1.374481e-05 -6.000000e+00 2.681394e-04 289.21 -2.00 20.00 -2.00 313.77 0.00e+00 1.135 0.000 302.00 328.00 3 1.3535e+00 4.1325e-04 1.4015e-02 -6.0000e+00 1.5109e-02 1.5208e-02 4.5451e-04 8.0783e-03 -6.0000e+00 1.6266e-02 4.9209e-05 2.6035e-04 3.8972e-03 -6.0000e+00 9.6854e-03 -3.4687e-03 1.1141e-04 1.0740e-03 -6.0000e+00 4.0893e-03 3.8520e-02 2.6108e-04 8.8896e-06 1.5913e-05 -6.0000e+00 2.9156e-04 1.1053e-02 -1.6408e-05 12 9 1 12 1 1 99.87 21.41 0.21 0.01105 0.01302 322 284 1 5 0 41.010 25.90 19.97 21.41 33.34 40.0 1071.04 776 -853 211 -3216 -2995 -836 357 1307 1543 -4 -2759 -738 231 -36 1023 168 -720 922 350 1831 827 -31 1005 706 250 1002 158 -818 -299 808 1625 80 2264 -908 -3920 -1492 -1296 -716 266 -176 -1241 -1047 -463 -1119 -315 -299 -773 -119 -637 27 1343 753 779 1196 114 938 1007 652 364 586 755 1246 948 1774 -42 -1187 -219 -1266 1147 1197 14 206 -288 608 67 -535 -587 -1647 -157 -404 -1118 -799 -2187 -1723 -519 -566 -81 -43 704 245 495 425 -504 484 1052 303 -33 993 313 -497 -283 -1245 -1233 454 90 -1236 -182 -803 -216 223 567 123 211 96 33 222 678 -181 575 290 -134 -150 600 -73 1185 867 -403 877 847 368 470 -512 -589 -279 388 -343 -511 249 -84 -459 82 -750 320 -366 88 -1224 -1127 -310 141 522 658 -2 -1195 -332 106 -18 558 90 -393 511 199 1057 479 -18 598 438 151 606 98 -472 -173 463 901 47 1365 -541 -2274 -892 -816 -494 202 -141 -1053 -913 -408 -984 -274 -255 -637 -99 -519 22 1147 641 691 1093 101 841 906 581 323 528 712 1191 956 1805 -40 -1112 -203 -1182 1099 1204 15 215 -296 618 66 -500 -507 -1480 -142 -387 -1127 -829 -2400 -1913 -613 -679 -101 -52 865 284 547 447 -518 497 1148 347 -40 1215 387 -593 -331 -1444 -1429 534 109 -1573 -231 -1063 -287 307 791 167 279 121 41 263 820 -224 729 386 -180 -198 766 -93 1474 1027 -467 1038 1056 461 607 -648 -765 -378 533 -489 -720 355 -119 -659 115 -1030 SS 20240713T153012.5Z 8960.645978 236 1 49.03 2 26.89 130.19 107.35 86.01 0.00 1 0.00 1 0 17 9.780e-03 7.740e-03 1.544e-04 1.145e-04 1.524304e-01 6.341593e-05 1.847179e-03 -6.000000e+00 6.016299e-03 232.95 -2.00 3.52 -2.00 314.55 0.00e+00 2.871722e-04 5.050067e-06 1.858682e-05 -6.000000e+00 2.679331e-04 289.21 -2.00 20.00 -2.00 313.91 0.00e+00 1.121 0.000 302.00 328.00 3 7.5902e-01 1.6342e-04 1.3865e-02 -6.0000e+00 1.5098e-02 1.2808e-02 1.7979e-04 8.0089e-03 -6.0000e+00 1.6254e-02 -4.3209e-05 1.0280e-04 3.8635e-03 -6.0000e+00 9.6781e-03 -3.7162e-03 4.4172e-05 1.0632e-03 -6.0000e+00 4.0863e-03 7.1007e-02 3.1923e-04 3.5124e-06 1.5697e-05 -6.0000e+00 2.9134e-04 1.0942e-02 -1.2560e-05 11 8 0 10 0 0 99.98 21.42 0.24 0.01094 0.01334 3391 816 1 5 0 14.250 25.90 19.97 21.42 34.01 40.0 1074.10 688 -925 231 -3166 -2931 -785 283 1209 1445 -65 -2776 -764 265 36 1083 232 -666 923 392 1758 856 -145 966 748 324 992 158 -859 -366 732 1585 5 2313 -1073 -3921 -1543 -1359 -746 290 -175 -1240 -1062 -429 -1130 -336 -229 -774 -126 -687 -15 1309 772 848 1208 152 906 1007 561 368 582 762 1241 995 1786 -52 -1170 -236 -1351 1083 1252 80 245 -257 636 52 -528 -694 -1696 -193 -458 -1176 -786 -2184 -1681 -443 -478 -21 11 727 251 498 376 -531 436 990 242 -80 1032 234 -509 -380 -1268 -1280 486 59 -1265 -177 -757 -179 260 643 170 216 120 -21 236 635 -172 565 291 -109 -190 616 -115 1151 784 -453 829 811 308 442 -535 -570 -241 446 -280 -423 261 -37 -439 85 -799 266 -372 90 -1128 -1039 -274 105 453 577 -26 -1126 -322 121 17 549 123 -361 508 221 1007 492 -84 570 429 191 590 90 -492 -197 390 871 3 1380 -634 -2251 -914 -841 -501 225 -143 -1072 -890 -364 -956 -281 -199 -650 -102 -541 -12 1081 669 722 1061 137 820 914 505 330 529 725 1188 1004 1819 -50 -1105 -210 -1212 1047 1259 81 254 -262 646 51 -473 -610 -1473 -179 -443 -1185 -853 -2380 -1933 -517 -589 -25 13 877 298 570 414 -547 448 1080 275 -95 1297 285 -625 -439 -1460 -1473 564 73 -1580 -230 -978 -241 363 908 234 292 149 -25 275 758 -218 732 395 -143 -257 802 -142 1413 917 -544 969 998 397 560 -692 -755 -318 620 -404 -601 374 -53 -639 121 -1113 SS 20240713T153648.5Z 8960.650561 240 1 14.52 2 25.96 132.93 106.17 87.11 0.00 1 0.00 1 0 17 1.169e-02 9.266e-03 4.087e-03 2.963e-03 1.571623e-01 1.635233e-03 1.889764e-03 -6.000000e+00 7.193547e-03 232.95 -2.00 3.52 -2.00 314.66 0.00e+00 5.356941e-04 1.330146e-04 1.733406e-05 -6.000000e+00 3.203048e-04 289.21 -2.00 20.00 -2.00 314.01 0.00e+00 1.112 0.000 302.00 328.00 3 5.7251e+00 4.2168e-03 1.3939e-02 -6.0000e+00 1.8053e-02 5.6126e-02 4.6447e-03 8.2511e-03 -6.0000e+00 1.9434e-02 -2.9920e-03 2.6534e-03 3.9667e-03 -6.0000e+00 1.1571e-02 -2.7139e-03 1.1446e-03 1.1206e-03 -6.0000e+00 4.8867e-03 4.8622e-04 5.1654e-04 9.0755e-05 1.5884e-05 -6.0000e+00 3.4829e-04 1.0512e-02 1.4615e-05 12 9 1 12 1 1 99.78 21.42 0.19 0.01051 0.01439 4 4 1 5 0 2901.630 25.90 20.02 21.42 34.41 40.2 1075.75 41 -1592 194 -3102 -2740 -469 -423 2103 2106 590 -3956 135 562 -714 1406 159 346 527 806 1119 1518 54 2209 770 1111 597 -309 -2399 -167 -1768 2074 -393 3177 -1829 -3156 -1996 -859 -1393 392 -151 -374 -1348 431 -1778 126 6 -165 -1284 -764 -730 758 1459 1218 1290 -130 225 1517 -65 209 124 890 1492 1064 1632 362 -893 -980 -630 1128 1307 769 842 3 1133 -254 -484 -708 -2753 -626 -536 -1844 -581 -2676 -1644 -264 -396 -38 642 1056 677 200 302 -1213 288 81 655 -149 1666 767 -488 -482 -1750 -1681 152 -284 -1017 -616 -221 -291 756 934 192 643 -346 -934 -101 241 -33 312 369 -123 6 635 -30 1384 884 -402 971 905 96 587 -669 -618 -487 744 67 5 147 95 -791 -39 -1033 16 -623 73 -1067 -914 -154 -149 750 802 228 -1557 54 247 -331 699 83 182 286 422 602 807 29 1198 439 647 354 -176 -1359 -88 -943 1108 -223 1839 -1065 -1757 -1160 -525 -950 293 -120 -312 -1169 374 -1561 109 5 -134 -1066 -612 -594 613 1221 1064 1165 -115 202 1347 -60 191 111 829 1474 1065 1653 362 -823 -898 -573 1066 1302 811 903 3 1132 -245 -440 -623 -2420 -557 -504 -1920 -620 -2917 -1881 -309 -490 -47 797 1284 803 227 325 -1279 301 87 732 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