# CIF generated by HEAS from Alexandria entry agm004787635 data_agm004787635 _cell_length_a 6.91770 _cell_length_b 6.21094 _cell_length_c 6.21094 _cell_angle_alpha 67.68047 _cell_angle_beta 56.15859 _cell_angle_gamma 56.15859 _cell_volume 183.15472 _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 Ca1 Ca 0.00000 0.00000 0.00000 1.00000 Pu1 Pu 0.50000 0.50000 0.50000 1.00000 Cu1 Cu 0.24932 0.25068 0.25068 1.00000 Cu2 Cu 0.75068 0.74932 0.74932 1.00000 Se1 Se 0.48669 0.99352 0.51333 1.00000 Se2 Se 0.99354 0.00648 0.48667 1.00000 Se3 Se 0.00645 0.51333 0.99352 1.00000 Se4 Se 0.51331 0.48667 0.00648 1.00000