5red 8.07 0.1814 0.2112 0.2031 0.2266 0.0050 0.2358 1.84 0.1991 0.2236 0.0050 0.2312 1.52 0.2021 0.2277 0.0051 0.2347 1.37 1.1611 1.20 0.10 0.10 80 0 0 5 4 NA 0 0.391 0.324 0.314 -1.548 -1.600 -1.484 -0.287 -0.272 -0.276 -0.403 -0.071 0.162 -0.376 -0.332 -0.324 1.329 0.552 0.572 1.019 0.719 0.713 14 13 14 9 19 14 NA NA NA REFMAC_5.8.0238 2020 1.47 1.47 55.20 41453 2028 4.9 2028 13.5 113.307 52.912 52.912 90 103.01 90 23.42 25.56 ISOT SIMP 1.2 0.9 0.9 0 1 REDO 0 0 'C 1 2 1' 0 0 20 0 0.002 0.004 0.008 0.876 0.854 0.859 1.47 0.959 0.959 0.00 0.950 0.948 -0.64 0.91260 0 35.02 X-ray 94.7 0 0 1 0 2024-03-30 4 0 76 76 84 92 30 32 85 62 26 17 NA NA NA 66 63 0 0 0.551 0.537 0.540 0.563 0.568 0.568 0.0439 1.03 0.87 0.78 T F 0 NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA 0.9524 0.9467 0.9493 0.9416 0.9478 0.9393 F 0.9 3
