# CIF generated by HEAS from Alexandria entry agm005014389 data_agm005014389 _cell_length_a 4.61675 _cell_length_b 5.26387 _cell_length_c 5.45493 _cell_angle_alpha 128.33665 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 103.98161 _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 Ni1 Ni 0.75000 0.27862 0.79287 1.00000 Ni2 Ni 0.25000 0.72138 0.20713 1.00000 B1 B 0.25000 0.99817 0.86257 1.00000 B2 B 0.75000 0.00183 0.13743 1.00000 O1 O 0.75000 0.99020 0.88633 1.00000 O2 O 0.25000 0.00980 0.11367 1.00000 O3 O 0.25000 0.24879 0.83914 1.00000 O4 O 0.75000 0.75121 0.16086 1.00000 F1 F 0.75000 0.31127 0.44215 1.00000 F2 F 0.25000 0.68873 0.55785 1.00000