# CIF generated by HEAS from Alexandria entry agm073025713 data_agm073025713 _cell_length_a 10.18854 _cell_length_b 10.18854 _cell_length_c 10.18854 _cell_angle_alpha 109.47122 _cell_angle_beta 109.47122 _cell_angle_gamma 109.47122 _cell_volume 814.16785 _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 Zr1 Zr 0.87332 0.92223 0.72074 1.00000 Zr2 Zr 0.25000 0.12500 0.87500 1.00000 Zr3 Zr 0.57777 0.45109 0.79851 1.00000 Zr4 Zr 0.45109 0.79851 0.57777 1.00000 Zr5 Zr 0.15258 0.77926 0.70149 1.00000 Zr6 Zr 0.54891 0.84742 0.12668 1.00000 Zr7 Zr 0.62668 0.34742 0.04891 1.00000 Zr8 Zr 0.29851 0.95109 0.07777 1.00000 Zr9 Zr 0.84742 0.12668 0.54891 1.00000 Zr10 Zr 0.34742 0.04891 0.62668 1.00000 Zr11 Zr 0.72074 0.87332 0.92223 1.00000 Zr12 Zr 0.37332 0.22074 0.42223 1.00000 Zr13 Zr 0.12500 0.87500 0.25000 1.00000 Zr14 Zr 0.92223 0.72074 0.87332 1.00000 Zr15 Zr 0.37500 0.62500 0.75000 1.00000 Zr16 Zr 0.20149 0.27926 0.65258 1.00000 Zr17 Zr 0.27926 0.65258 0.20149 1.00000 Zr18 Zr 0.65258 0.20149 0.27926 1.00000 Zr19 Zr 0.42223 0.37332 0.22074 1.00000 Zr20 Zr 0.87500 0.25000 0.12500 1.00000 Zr21 Zr 0.77926 0.70149 0.15258 1.00000 Zr22 Zr 0.70149 0.15258 0.77926 1.00000 Zr23 Zr 0.07777 0.29851 0.95109 1.00000 Zr24 Zr 0.04891 0.62668 0.34742 1.00000 Zr25 Zr 0.22074 0.42223 0.37332 1.00000 Zr26 Zr 0.79851 0.57777 0.45109 1.00000 Zr27 Zr 0.12668 0.54891 0.84742 1.00000 Zr28 Zr 0.75000 0.37500 0.62500 1.00000 Zr29 Zr 0.95109 0.07777 0.29851 1.00000 Zr30 Zr 0.62500 0.75000 0.37500 1.00000 Mo1 Mo 0.59745 0.59745 0.59745 1.00000 Mo2 Mo 0.90255 0.50000 0.00000 1.00000 Mo3 Mo 0.09745 0.09745 0.09745 1.00000 Mo4 Mo 0.00000 0.40255 0.50000 1.00000 Mo5 Mo 0.00000 0.90255 0.50000 1.00000 Mo6 Mo 0.40255 0.50000 0.00000 1.00000 Mo7 Mo 0.50000 0.00000 0.40255 1.00000 Mo8 Mo 0.50000 0.00000 0.90255 1.00000