# CIF generated by HEAS from Alexandria entry agm003845729 data_agm003845729 _cell_length_a 2.78257 _cell_length_b 2.78257 _cell_length_c 8.88169 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 104.10519 _cell_volume 66.69502 _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 Be1 Be 0.00000 0.00000 0.46719 1.00000 Mo1 Mo 0.00000 0.00000 0.03004 1.00000 Mo2 Mo 0.50000 0.50000 0.27371 1.00000 Ca1 Ca 0.50000 0.50000 0.72906 1.00000