# CIF generated by HEAS from Alexandria entry agm005100696 data_agm005100696 _cell_length_a 4.68964 _cell_length_b 4.80780 _cell_length_c 4.80780 _cell_angle_alpha 120.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 93.87763 _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 Pa1 Pa 0.00000 0.33333 0.66667 1.00000 Be1 Be 0.50000 0.00000 0.00000 1.00000 Ni1 Ni 0.50000 0.66667 0.33333 1.00000 O1 O 0.71896 0.69856 0.67163 1.00000 O2 O 0.71896 0.32837 0.02693 1.00000 O3 O 0.71896 0.97307 0.30144 1.00000 O4 O 0.28104 0.32837 0.30144 1.00000 O5 O 0.28104 0.69856 0.02693 1.00000 O6 O 0.28104 0.97307 0.67163 1.00000