# CIF generated by HEAS from Alexandria entry agm002913604 data_agm002913604 _cell_length_a 4.13727 _cell_length_b 4.13727 _cell_length_c 4.58301 _cell_angle_alpha 63.16833 _cell_angle_beta 63.16833 _cell_angle_gamma 90.00000 _cell_volume 60.38553 _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 Mo1 Mo 0.75000 0.25000 0.50000 1.00000 Mo2 Mo 0.25000 0.75000 0.50000 1.00000 C1 C 0.39594 0.39594 0.20811 1.00000 C2 C 0.60406 0.60406 0.79189 1.00000 Br1 Br 0.00000 0.00000 0.00000 1.00000