5rec 8.07 0.1826 0.2371 0.1938 0.2485 0.0069 0.2292 -2.80 0.1959 0.2455 0.0068 0.2317 -2.03 0.1999 0.2415 0.0067 0.2364 -0.76 1.1826 0.80 0.03 0.03 84 0 0 6 9 NA 0 0.461 0.400 0.413 -1.608 -1.627 -1.365 -1.684 -1.380 -1.273 -1.472 -0.872 -0.674 -0.479 -0.271 -0.262 1.324 0.313 0.322 0.982 0.541 0.533 19 17 17 16 15 17 NA NA NA REFMAC_5.8.0238 2020 1.73 1.73 54.78 26435 1314 5.0 1314 9.2 112.398 52.72 52.72 90 102.888 90 29.53 29.41 ISOT SIMP 1.3 0.8 0.8 0 1 REDO 0 0 'C 1 2 1' 0 0 3 0 0.006 0.006 0.006 0.894 0.888 0.888 1.73 0.963 0.960 -4.45 0.941 0.944 0.69 0.91260 0 34.05 X-ray 99.3 0 0 1 0 2024-03-30 3 0 38 48 62 79 27 37 68 68 42 36 NA NA NA 69 67 0 0 0.514 0.512 0.525 0.552 0.562 0.575 0.0532 -1.87 -1.33 -0.48 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 0.9522 0.9405 0.9528 0.9401 0.9520 0.9403 F 1.1 22
