# CIF generated by HEAS from Alexandria entry agm007613694 data_agm007613694 _cell_length_a 4.52783 _cell_length_b 4.52783 _cell_length_c 6.55622 _cell_angle_alpha 77.42194 _cell_angle_beta 77.42194 _cell_angle_gamma 77.55576 _cell_volume 126.02765 _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 0.50000 1.00000 Ni1 Ni 0.00000 0.00000 0.00000 1.00000 H1 H 0.33074 0.33074 0.44331 1.00000 H2 H 0.83627 0.21013 0.17691 1.00000 H3 H 0.66926 0.66926 0.55669 1.00000 H4 H 0.75986 0.75986 0.04579 1.00000 H5 H 0.24014 0.24014 0.95421 1.00000 H6 H 0.21013 0.83627 0.17691 1.00000 H7 H 0.78987 0.16373 0.82309 1.00000 H8 H 0.16373 0.78987 0.82309 1.00000 Au1 Au 0.52932 0.52932 0.22680 1.00000 Au2 Au 0.47068 0.47068 0.77320 1.00000