File name: Pandora64s1_NewHavenCT_20240819_L2Fit_fout2c4d20190911p1-8.txt File generation date: 20240820T061837.0Z 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_20240819_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: 20240819 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 20240819T162326.0Z 8997.682940 420 1 48.97 2 29.67 164.23 154.31 342.52 0.00 1 0.00 1 0 17 1.838e-02 1.143e-02 2.858e-03 1.861e-03 1.755183e-01 1.022871e-03 2.117159e-03 -6.000000e+00 1.126819e-02 231.44 -2.00 3.52 -2.00 315.16 0.00e+00 9.869006e-04 9.179615e-05 4.804944e-05 -6.000000e+00 5.046950e-04 289.67 -2.00 20.00 -2.00 314.46 0.00e+00 1.150 0.000 302.00 328.00 3 6.0562e+00 2.6406e-03 1.4803e-02 -6.0000e+00 2.8169e-02 6.6687e-02 2.9147e-03 9.1824e-03 -6.0000e+00 3.0331e-02 -5.7541e-03 1.6669e-03 4.4144e-03 -6.0000e+00 1.8090e-02 -9.7023e-04 7.3518e-04 1.3136e-03 -6.0000e+00 7.6883e-03 3.2087e-04 1.0532e-04 5.7527e-05 1.6933e-05 -6.0000e+00 5.4717e-04 -3.4079e-03 8.5261e-05 12 8 8 10 0 0 99.27 21.38 0.19 -0.00341 -0.00262 18 4 1 5 0 2720.080 25.90 20.03 21.38 35.03 40.6 1071.41 1950 -36 1573 -1780 -15189 -1619 -365 653 2407 -639 -3358 -1295 -378 -549 2435 1090 -551 1652 1169 2304 2751 903 1511 1558 545 1133 407 -1295 -777 -2602 989 -63 2082 -109 -4302 -2215 -2073 -1602 452 209 -361 -784 119 -1370 -464 -125 -428 -492 -864 -1582 1516 902 1082 1629 628 554 1274 -69 -18 661 294 1635 1442 2767 923 -1478 -1054 -1511 572 1484 730 1066 136 612 -278 -1829 -1030 -3138 -1824 -775 -1971 -1213 -2124 -1678 -33 -35 755 846 1591 978 214 -141 -2103 -1534 60 281 -208 1670 1367 -411 -755 -2007 -2373 -410 103 -1182 -475 258 451 987 1525 810 515 212 -753 -1184 -98 -693 506 711 447 275 843 176 1365 504 -1317 136 635 7 384 -463 -756 -437 800 41 6 479 309 -384 -385 -1333 597 -12 494 -518 -4596 -426 -101 196 763 -212 -1110 -441 -142 -216 1023 489 -255 773 561 1125 1336 441 756 809 278 583 216 -645 -364 -1238 475 -32 1093 -57 -2191 -1151 -1133 -1012 312 161 -282 -634 98 -1132 -379 -100 -332 -389 -667 -1240 1215 726 904 1407 553 496 1140 -62 -16 589 262 1536 1434 2792 900 -1344 -950 -1350 522 1485 743 1109 140 628 -265 -1667 -858 -2721 -1593 -743 -1997 -1266 -2339 -1941 -38 -43 931 1058 1951 1184 250 -152 -2220 -1607 63 321 -249 2124 1700 -521 -903 -2373 -2777 -482 129 -1493 -626 350 613 1396 2198 1148 690 273 -943 -1433 -120 -892 663 976 620 376 1115 231 1691 625 -1596 167 786 10 515 -608 -1018 -612 1128 61 10 728 468 -568 -556 -1889 SS 20240819T170246.3Z 8997.710258 445 1 3.12 2 28.91 183.87 155.01 3.50 0.00 1 0.00 1 0 25 1.051e-02 8.355e-03 1.857e-03 1.396e-03 1.602365e-01 7.709696e-04 1.963975e-03 -6.000000e+00 6.441813e-03 231.44 -2.00 3.52 -2.00 314.46 0.00e+00 2.383510e-04 6.065225e-05 2.738497e-05 -6.000000e+00 2.886064e-04 289.67 -2.00 20.00 -2.00 313.83 0.00e+00 1.142 0.000 302.00 328.00 3 2.9554e+00 1.9782e-03 1.4241e-02 -6.0000e+00 1.6103e-02 2.0271e-02 2.1782e-03 8.3838e-03 -6.0000e+00 1.7344e-02 2.3539e-03 1.2477e-03 4.0712e-03 -6.0000e+00 1.0344e-02 -4.1344e-03 5.3775e-04 1.1193e-03 -6.0000e+00 4.3931e-03 7.5774e-03 -4.6526e-04 4.2824e-05 1.7025e-05 -6.0000e+00 3.1305e-04 -2.6511e-03 -6.5211e-05 12 9 1 12 1 1 47.82 21.38 0.22 -0.00265 -0.00615 13 52 1 5 0 222.700 25.90 19.96 21.38 33.56 40.9 1062.99 1079 -95 262 -2381 -4093 -1083 -73 1259 1052 331 -2741 -1103 141 114 561 519 -640 1059 -92 1740 1001 -290 744 1251 407 1294 446 -1093 -389 802 1992 -58 2018 -146 -4372 -1947 -1625 -772 191 226 -1128 -1347 -283 -1063 -589 -268 -602 -460 -757 -207 1414 1239 845 1564 73 634 1153 401 191 408 558 1407 1264 1792 711 -1544 -257 -1532 706 1403 286 384 -122 563 530 -352 -741 -1909 -401 -411 -1364 -608 -2044 -1942 -588 -561 -169 45 849 212 156 408 -840 202 814 647 -79 1134 523 -469 -390 -1207 -1432 214 292 -1375 -271 -778 -290 239 943 395 49 280 -45 -98 576 -327 480 464 -123 -154 734 50 966 1105 -762 696 990 453 527 -459 -471 -509 402 -226 -369 263 -141 -653 -85 -524 426 -39 106 -884 -1516 -389 -28 483 435 140 -1158 -481 63 56 299 272 -343 576 -52 988 572 -166 437 760 241 773 276 -633 -211 454 1090 -33 1212 -87 -2546 -1155 -1009 -522 142 178 -953 -1174 -249 -937 -514 -230 -499 -388 -621 -171 1146 1053 750 1365 66 574 1046 363 171 369 527 1343 1274 1844 700 -1481 -231 -1377 678 1415 295 406 -127 585 530 -320 -654 -1652 -366 -396 -1384 -635 -2265 -2175 -673 -680 -204 56 1021 251 177 441 -886 211 857 711 -92 1401 660 -574 -468 -1371 -1611 254 355 -1700 -349 -1003 -389 322 1286 548 64 350 -54 -118 708 -408 615 625 -162 -208 955 64 1179 1336 -901 834 1196 574 664 -590 -619 -674 559 -315 -527 381 -205 -924 -121 -730 SS 20240819T170643.1Z 8997.712999 448 1 48.36 2 28.98 185.86 154.93 5.62 0.00 1 0.00 1 0 25 1.029e-02 8.102e-03 1.907e-04 1.409e-04 1.604208e-01 7.775292e-05 1.958507e-03 -6.000000e+00 6.308832e-03 231.44 -2.00 3.52 -2.00 314.55 0.00e+00 2.736598e-04 6.238261e-06 2.136568e-05 -6.000000e+00 2.825885e-04 289.67 -2.00 20.00 -2.00 313.91 0.00e+00 1.143 0.000 302.00 328.00 3 1.1828e+00 1.9954e-04 1.4250e-02 -6.0000e+00 1.5771e-02 8.2291e-03 2.1963e-04 8.3861e-03 -6.0000e+00 1.6983e-02 1.8402e-03 1.2584e-04 4.0697e-03 -6.0000e+00 1.0129e-02 -4.2827e-03 5.4488e-05 1.1247e-03 -6.0000e+00 4.3041e-03 4.4749e-02 5.0201e-05 4.3315e-06 1.6712e-05 -6.0000e+00 3.0643e-04 -3.4548e-03 3.8826e-05 11 8 0 10 0 0 99.87 21.37 0.22 -0.00345 -0.00308 1608 387 1 5 0 30.070 25.90 20.02 21.37 33.81 40.8 1066.02 942 -884 366 -2931 -3511 -1148 7 1105 1498 305 -2796 -1308 278 -16 1011 537 -754 887 409 1605 1057 -317 879 859 441 1138 571 -796 -356 563 1849 176 2292 -171 -4159 -2017 -1529 -1024 135 -32 -1169 -1168 -474 -1062 -537 -56 -792 -160 -661 -157 1192 920 684 1335 175 842 1066 625 205 506 572 1281 1063 1951 442 -1274 -261 -1434 734 1524 202 340 -203 627 235 -533 -634 -1819 -429 -253 -1175 -774 -2064 -1958 -500 -493 -46 8 730 357 382 458 -626 181 969 374 -35 1070 559 -436 -356 -1316 -1495 241 330 -1389 -295 -787 -297 239 691 277 205 130 -90 18 620 -217 534 381 -47 -228 615 14 995 1024 -562 718 993 400 545 -481 -615 -333 413 -142 -534 218 27 -498 12 -763 375 -342 138 -1103 -1210 -386 2 428 622 121 -1106 -535 123 -8 503 282 -405 483 228 914 605 -182 484 491 261 679 331 -461 -193 301 1017 102 1379 -103 -2429 -1204 -949 -692 100 -25 -981 -1009 -416 -930 -466 -47 -654 -127 -541 -129 964 781 606 1161 155 756 963 560 183 455 538 1216 1067 1992 434 -1216 -234 -1284 703 1528 208 356 -210 648 225 -485 -560 -1575 -392 -243 -1187 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