# CIF generated by HEAS from Alexandria entry agm005995488 data_agm005995488 _cell_length_a 3.30992 _cell_length_b 7.63062 _cell_length_c 9.04415 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 102.52611 _cell_volume 222.98882 _symmetry_space_group_name_H-M 'P 1' _symmetry_Int_Tables_number 1 loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Zr1 Zr 0.10643 0.21285 0.44545 1.00000 Zr2 Zr 0.89357 0.78715 0.55455 1.00000 Zr3 Zr 0.24479 0.48958 0.75000 1.00000 Zr4 Zr 0.75521 0.51042 0.25000 1.00000 Zr5 Zr 0.10643 0.21285 0.05455 1.00000 Zr6 Zr 0.89357 0.78715 0.94545 1.00000 Ni1 Ni 0.95034 0.90069 0.25000 1.00000 Ni2 Ni 0.04966 0.09931 0.75000 1.00000 B1 B 0.44323 0.88647 0.75000 1.00000 B2 B 0.55677 0.11353 0.25000 1.00000 B3 B 0.48366 0.96732 0.40823 1.00000 B4 B 0.51634 0.03268 0.59177 1.00000 B5 B 0.51634 0.03268 0.90823 1.00000 B6 B 0.48366 0.96732 0.09177 1.00000 B7 B 0.36832 0.73665 0.34937 1.00000 B8 B 0.63168 0.26335 0.65063 1.00000 B9 B 0.27390 0.54780 0.46637 1.00000 B10 B 0.72610 0.45220 0.53363 1.00000 B11 B 0.72610 0.45220 0.96637 1.00000 B12 B 0.27390 0.54780 0.03363 1.00000 B13 B 0.36832 0.73665 0.15063 1.00000 B14 B 0.63168 0.26335 0.84937 1.00000