# CIF generated by HEAS from Alexandria entry agm011719081 data_agm011719081 _cell_length_a 4.47727 _cell_length_b 4.47727 _cell_length_c 4.47727 _cell_angle_alpha 118.57205 _cell_angle_beta 118.57205 _cell_angle_gamma 92.49160 _cell_volume 64.76701 _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 Ti1 Ti 0.73158 0.23158 0.50000 1.00000 Ti2 Ti 0.23158 0.73158 0.50000 1.00000 Mo1 Mo 0.48307 0.48307 0.00000 1.00000 H1 H 0.78232 0.22051 0.00000 1.00000 H2 H 0.22051 0.22051 0.43819 1.00000 H3 H 0.78232 0.78232 0.56181 1.00000 H4 H 0.22051 0.78232 0.00000 1.00000 H5 H 0.77107 0.77107 0.00000 1.00000