5rey 8.13 0.1958 0.2735 0.2136 0.2707 0.0087 0.2556 -1.74 0.2138 0.2656 0.0085 0.2558 -1.15 0.2168 0.2670 0.0086 0.2594 -0.88 1.1964 0.50 .005 .005 67 0 0 5 7 NA 0 0.286 0.235 0.258 -0.536 -0.495 -0.592 -1.330 -0.946 -0.706 -2.248 -1.562 -1.712 -0.453 -0.325 -0.305 1.298 0.191 0.167 0.937 0.453 0.422 27 17 28 21 23 22 NA NA NA REFMAC_5.8.0238 2020 1.96 1.96 55.19 18577 965 5.2 965 6.4 113.335 53.297 44.517 90 103.121 90 34.27 38.17 ISOT SIMP 1.2 0.8 0.8 0 1 REDO 0 0 'C 1 2 1' 0 0 17 0 0.005 0.003 0.015 0.859 0.856 0.852 1.96 0.949 0.947 -1.85 0.907 0.912 0.63 0.91260 0 35.55 X-ray 99.2 0 0 1 0 2025-01-30 3 0 46 64 46 57 70 68 72 45 17 14 NA NA NA 62 61 0 0 0.531 0.537 0.540 0.550 0.535 0.529 0.0617 -1.15 -0.74 -0.57 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 0.9530 0.9365 0.9524 0.9369 0.9501 0.9347 F 0.9 13 0 5343.6
