File name: Pandora25s1_HoustonTX_20241117_L2Fit_fout2c9d20230101p1-8.txt File generation date: 20241218T130512.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c9p1-8 Local principal investigator: Jimmy Flynn Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 25 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora25_OF_v7d20190903.txt Instrument calibration file used: Pandora25s1_CF_v9d20230101.txt Level 1 file used: Pandora25s1_HoustonTX_20241117_L1_smca1c9d20230101p1-8.txt Full location name: University Of Houston Short location name: HoustonTX Country of location: United States Location latitude [deg]: 29.7200 Location longitude [deg]: -95.3400 Location altitude [m]: 19 Local noon date: 20241117 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: Modification of session 8, but repeated E-MLE of HCHO. First and last pixel inside fitting window: 281 423 Nominal wavelengths inside fitting window [nm]: 305.0808 305.2213 305.3618 305.5022 305.6427 305.7831 305.9235 306.0640 306.2044 306.3447 306.4851 306.6255 306.7658 306.9062 307.0465 307.1868 307.3272 307.4675 307.6077 307.7480 307.8883 308.0285 308.1688 308.3090 308.4492 308.5894 308.7296 308.8698 309.0100 309.1501 309.2903 309.4304 309.5705 309.7106 309.8507 309.9908 310.1309 310.2710 310.4110 310.5511 310.6911 310.8311 310.9711 311.1111 311.2511 311.3911 311.5310 311.6710 311.8109 311.9508 312.0907 312.2306 312.3705 312.5104 312.6503 312.7901 312.9300 313.0698 313.2096 313.3494 313.4892 313.6290 313.7688 313.9085 314.0483 314.1880 314.3277 314.4675 314.6072 314.7468 314.8865 315.0262 315.1658 315.3055 315.4451 315.5847 315.7243 315.8639 316.0035 316.1431 316.2826 316.4222 316.5617 316.7013 316.8408 316.9803 317.1198 317.2592 317.3987 317.5382 317.6776 317.8170 317.9564 318.0958 318.2352 318.3746 318.5140 318.6534 318.7927 318.9320 319.0714 319.2107 319.3500 319.4893 319.6285 319.7678 319.9070 320.0463 320.1855 320.3247 320.4639 320.6031 320.7423 320.8815 321.0206 321.1598 321.2989 321.4380 321.5771 321.7162 321.8553 321.9944 322.1334 322.2725 322.4115 322.5506 322.6896 322.8286 322.9676 323.1065 323.2455 323.3845 323.5234 323.6623 323.8012 323.9402 324.0790 324.2179 324.3568 324.4957 324.6345 324.7733 324.9122 --------------------------------------------------------------------------------------- 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 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: 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 20241117T145221.9Z 9087.619698 313 1 10.43 2 67.66 130.09 90.51 302.28 0.00 1 0.00 1 0 17 1.836e-02 5.953e-03 7.248e-03 2.517e-03 2.732453e-01 1.279936e-03 3.065121e-03 -6.000000e+00 1.055659e-02 224.98 -2.00 3.24 -2.00 317.05 0.00e+00 -4.644948e-04 1.778225e-04 7.544060e-05 -6.000000e+00 4.802080e-04 288.36 -2.00 20.00 -2.00 316.23 0.00e+00 2.608 0.000 302.00 328.00 3 3.6106e+00 3.3449e-03 2.8908e-02 -6.0000e+00 2.6000e-02 1.9049e-02 3.7630e-03 1.2993e-02 -6.0000e+00 2.8193e-02 7.6822e-03 2.2424e-03 6.3575e-03 -6.0000e+00 1.6890e-02 -5.6154e-03 1.1060e-03 1.8382e-03 -6.0000e+00 7.2966e-03 7.8250e-04 -1.6280e-04 7.4012e-05 2.2085e-05 -6.0000e+00 5.1300e-04 -1.3944e-02 0.0000e+00 12 1 1 12 1 1 99.83 24.00 0.27 -0.01394 -0.01517 11 12 1 5 0 868.780 26.62 19.99 24.00 29.54 32.9 1081.84 -3124 -2066 -3123 -3067 625 -10703 7187 -3390 5187 -3219 -356 652 -2178 -509 -1616 11219 -1066 946 -171 1120 -38 -36 785 1307 -663 379 -1139 -1538 -498 -1603 2173 2764 1095 -1517 -1961 -1997 92 1640 -79 -1226 -1250 -931 -824 -107 -647 195 -1431 -988 3 221 327 192 4 1178 445 1131 1157 168 1004 431 1479 163 1571 967 127 -244 -401 51 590 91 204 726 -546 248 285 500 -436 -83 -269 277 -879 -1098 -1038 -1165 -920 -843 -393 -187 295 172 332 377 501 302 805 27 367 171 127 -553 -198 -437 -499 199 -348 -455 -786 -1090 -124 128 196 477 -46 97 176 158 440 164 314 -230 -489 16 -63 353 268 865 99 894 738 262 146 49 -415 360 -53 54 -94 454 -141 -587 -159 -457 -213 -378 -269 -418 -388 70 -1278 776 -450 705 -495 -53 100 -379 -99 -356 2399 -265 240 -45 303 -10 -10 222 386 -209 123 -374 -484 -147 -473 650 882 378 -549 -684 -685 33 661 -37 -655 -718 -554 -502 -65 -396 119 -873 -592 2 130 200 124 3 821 320 824 854 125 735 315 1093 127 1287 832 111 -204 -320 40 476 80 190 697 -531 236 259 426 -349 -64 -212 234 -810 -1084 -1074 -1247 -1023 -980 -472 -230 362 208 386 414 523 307 837 30 433 215 167 -732 -253 -535 -588 234 -430 -586 -1044 -1493 -174 187 295 729 -70 142 246 212 581 222 439 -337 -731 24 -93 508 375 1172 130 1168 994 370 214 74 -631 555 -84 89 -158 770 -242 -1002 -267 -749 -344 SS 20241117T145651.4Z 9087.622817 316 1 46.11 2 66.92 130.91 91.29 302.81 0.00 1 0.00 1 0 17 6.560e-02 6.897e-03 6.469e-03 1.875e-03 2.667619e-01 9.515783e-04 2.991413e-03 -6.000000e+00 3.772855e-02 224.98 -2.00 3.24 -2.00 317.31 0.00e+00 -3.013958e-04 1.411133e-04 5.382291e-05 -6.000000e+00 1.715723e-03 288.36 -2.00 20.00 -2.00 316.49 0.00e+00 2.530 0.000 302.00 328.00 3 4.4497e+00 2.4984e-03 2.8091e-02 -6.0000e+00 9.2925e-02 3.7804e-02 2.8177e-03 1.2692e-02 -6.0000e+00 1.0075e-01 1.0410e-02 1.7012e-03 6.2220e-03 -6.0000e+00 6.0357e-02 -7.8725e-03 8.5024e-04 1.7723e-03 -6.0000e+00 2.6086e-02 3.6405e-04 1.0075e-04 5.5596e-05 2.1234e-05 -6.0000e+00 1.8327e-03 -1.6453e-02 0.0000e+00 12 9 1 12 9 1 100.00 23.99 0.12 -0.01645 -0.01570 48 11 1 5 0 940.800 26.51 20.00 23.99 29.94 33.1 1085.52 72861 -697 -4306 -2887 -4259 -5123 12994 -6045 9088 -4771 -4012 2280 -3821 630 -2220 3125 -2468 1293 -1074 1385 -875 554 -484 847 -1254 902 -1341 -1573 -330 -137 4231 1891 1848 -1643 -2694 -862 -218 3272 -243 -1044 -1423 -311 -908 -652 -301 90 -2293 -1408 -251 -236 788 232 271 1081 753 1022 929 -203 1099 129 1549 594 1210 883 79 -513 -110 -310 788 540 620 721 -94 -240 449 969 -1105 143 152 322 -991 -1150 -1569 -777 -875 -1145 -72 -430 101 282 439 262 541 471 612 373 577 410 71 -264 -225 -708 25 239 -382 -762 -692 -659 -303 240 113 14 409 -87 174 440 155 -137 -86 -471 -506 -185 75 331 624 592 96 1145 455 364 191 -7 -216 535 -193 -121 76 406 -188 -335 -169 -636 -59 3968 -81 -525 -328 -445 -522 1189 -736 1066 -668 -557 308 -605 109 -443 647 -563 296 -260 339 -223 139 -125 229 -363 266 -403 -451 -88 -36 1124 551 578 -544 -861 -266 -72 1194 -107 -525 -776 -175 -527 -381 -175 52 -1341 -803 -140 -132 456 142 174 723 519 717 662 -146 774 91 1102 448 967 743 67 -419 -85 -234 613 458 565 682 -90 -225 399 798 -858 105 114 262 -892 -1117 -1610 -822 -970 -1335 -87 -533 125 343 509 287 556 469 626 408 678 518 95 -352 -290 -868 29 281 -473 -989 -927 -910 -432 355 174 23 629 -130 245 591 206 -185 -121 -698 -767 -280 111 481 877 806 127 1489 614 515 281 -10 -332 834 -313 -203 131 704 -329 -584 -289 -1064 -96 SS 20241117T152023.0Z 9087.639155 330 1 4.55 2 63.19 135.46 95.32 305.74 0.00 1 0.00 1 0 17 7.376e-02 8.815e-03 8.647e-03 3.871e-03 2.363051e-01 1.977411e-03 2.681926e-03 -6.000000e+00 4.238770e-02 224.98 -2.00 3.24 -2.00 316.24 0.00e+00 -2.946791e-04 2.257495e-04 3.784101e-05 -6.000000e+00 1.929104e-03 288.36 -2.00 20.00 -2.00 315.46 0.00e+00 2.205 0.000 302.00 328.00 3 3.9287e+00 5.1004e-03 2.4562e-02 -6.0000e+00 1.0439e-01 3.2814e-02 5.7062e-03 1.1229e-02 -6.0000e+00 1.1322e-01 3.0011e-03 3.3155e-03 5.5080e-03 -6.0000e+00 6.7831e-02 -4.6751e-03 1.5720e-03 1.5798e-03 -6.0000e+00 2.9281e-02 8.8758e-04 -7.5016e-04 1.1313e-04 2.0125e-05 -6.0000e+00 2.0616e-03 -9.2625e-03 0.0000e+00 12 9 1 12 1 1 98.34 23.99 0.46 -0.00926 -0.01490 3 9 1 5 0 1136.320 26.51 19.99 23.99 31.32 32.9 1091.29 84769 -365 -6616 -686 -6033 -1572 1164 992 2135 -1203 -5058 -373 233 -672 -586 5304 675 783 216 -1100 169 -1416 1486 -1311 -764 -156 -733 449 -515 938 161 2040 -521 -596 -2698 -1204 -1746 1921 -64 -649 -399 -813 -383 -1020 -157 -606 -556 -988 -213 -805 1182 592 32 780 1249 778 710 435 383 452 947 1159 238 211 201 -100 266 -535 452 634 605 236 332 -340 996 262 -494 -640 312 260 -1129 -1181 -1659 -644 -934 -485 -361 -425 287 335 25 618 22 910 917 225 395 607 -69 -163 -137 -653 415 88 15 -1125 -951 -955 277 291 -51 -24 91 179 -228 414 319 340 -15 -189 -850 9 61 135 399 481 462 1486 465 44 -90 -265 -581 303 190 28 -16 223 -244 -39 -447 116 -337 7407 -73 -1409 -131 -1098 -266 202 191 446 -270 -1164 -84 57 -184 -178 1644 225 268 77 -403 62 -526 550 -516 -312 -65 -308 179 -196 346 62 817 -225 -262 -1159 -502 -776 930 -36 -405 -265 -559 -268 -720 -110 -425 -386 -675 -142 -541 808 425 24 600 980 621 573 352 307 360 766 975 212 195 186 -89 225 -445 385 580 587 237 335 -339 946 235 -417 -520 256 228 -1073 -1194 -1757 -699 -1054 -570 -438 -528 356 410 29 688 23 931 957 248 464 755 -89 -212 -173 -792 482 103 18 -1440 -1250 -1289 382 415 -75 -35 134 253 -309 537 408 444 -21 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