5r7y 8.07 0.1794 0.2367 0.2350 0.2614 0.0067 0.2766 2.27 0.1968 0.2480 0.0064 0.2316 -2.56 0.1985 0.2450 0.0063 0.2336 -1.81 1.1769 0.10 0.05 0.05 92 0 0 6 7 NA 0 0.425 0.476 0.477 -1.554 -1.672 -1.465 -1.690 -0.973 -0.881 -1.675 -0.861 -0.309 -0.430 -0.347 -0.350 1.374 0.409 0.389 1.014 0.612 0.588 19 26 28 15 16 14 NA NA NA REFMAC_5.8.0238 2020 1.65 1.65 54.83 30223 1501 5.0 1501 10.3 112.463 52.731 52.731 90 102.812 90 24.15 28.69 ISOT SIMP 1.1 0.7 0.7 0 1 REDO 0 0 'C 1 2 1' 70 0 77 1 0.009 0.012 0.017 0.887 0.885 0.896 1.65 0.941 0.961 25.42 0.931 0.941 2.21 0.91260 0 33.98 X-ray 98.7 0 0 1 0 2024-03-30 4 0 37 59 57 85 29 33 59 42 35 45 NA NA NA 67 69 0 0 0.515 0.534 0.536 0.529 0.530 0.549 0.0503 1.28 -1.66 -1.14 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 0.9424 0.9361 0.9516 0.9410 0.9507 0.9402 F 1.1 15
