# CIF generated by HEAS from Alexandria entry agm008181971 data_agm008181971 _cell_length_a 5.06443 _cell_length_b 5.06443 _cell_length_c 9.82881 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 120.00000 _cell_volume 218.31993 _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 0.66111 1.00000 Ca2 Ca 0.00000 0.00000 0.33889 1.00000 Ca3 Ca 0.00000 0.00000 0.00000 1.00000 Ni1 Ni 0.50000 0.00000 0.50000 1.00000 Ni2 Ni 0.50000 0.50000 0.50000 1.00000 Ni3 Ni 0.00000 0.50000 0.20654 1.00000 Ni4 Ni 0.50000 0.00000 0.20654 1.00000 Ni5 Ni 0.50000 0.50000 0.20654 1.00000 Ni6 Ni 0.00000 0.50000 0.79346 1.00000 Ni7 Ni 0.50000 0.00000 0.79346 1.00000 Ni8 Ni 0.50000 0.50000 0.79346 1.00000 Ni9 Ni 0.66667 0.33333 0.00000 1.00000 Ni10 Ni 0.33333 0.66667 0.00000 1.00000 Ni11 Ni 0.00000 0.50000 0.50000 1.00000 B1 B 0.66667 0.33333 0.65250 1.00000 B2 B 0.33333 0.66667 0.65250 1.00000 B3 B 0.33333 0.66667 0.34750 1.00000 B4 B 0.66667 0.33333 0.34750 1.00000