# CIF generated by HEAS from Alexandria entry agm005494985 data_agm005494985 _cell_length_a 7.26649 _cell_length_b 7.26649 _cell_length_c 4.21056 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 97.04391 _cell_volume 220.64713 _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 Ca2 Ca 0.50000 0.00000 0.00000 1.00000 Ca3 Ca 0.00000 0.50000 0.00000 1.00000 Ca4 Ca 0.73958 0.26042 0.50000 1.00000 Ca5 Ca 0.26042 0.73958 0.50000 1.00000 Mo1 Mo 0.50000 0.50000 0.00000 1.00000 Mo2 Mo 0.65133 0.65133 0.50000 1.00000 Mo3 Mo 0.34867 0.34867 0.50000 1.00000