5re4 8.07 0.1991 0.2664 0.2071 0.2695 0.0084 0.2472 -2.65 0.2080 0.2687 0.0084 0.2483 -2.43 0.2122 0.2735 0.0085 0.2533 -2.38 1.1937 0.50 0.01 0.01 58 0 0 4 10 NA 0 0.692 0.610 0.543 -1.644 -1.447 -1.382 -2.653 -2.054 -2.104 -2.052 -0.959 -0.775 -0.432 -0.313 -0.305 1.300 0.233 0.233 0.986 0.489 0.471 43 30 33 16 18 16 NA NA NA REFMAC_5.8.0238 2020 1.88 1.88 54.37 20087 1030 5.1 1030 7.0 111.643 52.352 52.352 90 103.083 90 28.16 30.76 ISOT SIMP 1.2 0.8 0.8 0 1 REDO 0 0 'C 1 2 1' 0 0 6 0 0.014 0.010 0.008 0.888 0.877 0.882 1.88 0.952 0.949 -3.03 0.911 0.909 -0.26 0.91260 0 33.37 X-ray 97.9 0 0 1 0 2024-03-30 3 0 21 29 50 77 26 37 47 62 36 30 NA NA NA 77 72 0 0 0.496 0.514 0.505 0.561 0.562 0.565 0.0597 -1.80 -1.64 -1.59 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 0.9485 0.9328 0.9451 0.9313 0.9441 0.9302 F 1.0 18
