5r82 8.07 0.1803 0.2116 0.2420 0.2552 0.0050 0.2748 3.92 0.1994 0.2202 0.0043 0.2264 1.44 0.1990 0.2204 0.0043 0.2260 1.30 1.1356 0.10 0.05 0.05 27 0 0 3 6 NA 0 0.463 0.496 0.518 -1.547 -1.562 -1.440 -1.212 -0.552 -0.457 -0.800 0.148 0.371 -0.354 -0.304 -0.262 1.281 0.276 0.274 1.002 0.544 0.534 13 15 10 19 11 15 NA NA NA REFMAC_5.8.0238 2020 1.31 1.31 54.90 53593 2605 4.9 2605 18.6 112.665 52.848 52.848 90 102.966 90 18.82 22.35 ISOT SIMP 1.1 0.8 0.8 0 1 REDO 0 0 'C 1 2 1' 90 0 172 0 0.005 0.003 0.003 0.879 0.899 0.877 1.31 0.945 0.962 30.21 0.941 0.958 6.29 0.91260 0 34.62 X-ray 87.2 0 0 1 0 2024-03-30 4 0 49 71 76 94 30 34 72 81 28 26 NA NA NA 69 71 0 0 0.518 0.521 0.519 0.552 0.557 0.558 0.0362 2.24 0.86 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 0.9449 0.9394 0.9553 0.9474 0.9556 0.9478 F 1.3 7
