# CIF generated by HEAS from Alexandria entry agm044207678 data_agm044207678 _cell_length_a 5.31583 _cell_length_b 5.31583 _cell_length_c 5.06463 _cell_angle_alpha 79.96202 _cell_angle_beta 79.96202 _cell_angle_gamma 120.00022 _cell_volume 116.16762 _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 0.00000 0.00000 0.00000 1.00000 Ti1 Ti 0.66589 0.33411 0.00000 1.00000 Ti2 Ti 0.33411 0.66589 0.00000 1.00000 Cr1 Cr 0.83197 0.16803 0.50000 1.00000 Cr2 Cr 0.16803 0.83197 0.50000 1.00000 Cr3 Cr 0.50000 0.50000 0.50000 1.00000 N1 N 0.56865 0.91181 0.26395 1.00000 N2 N 0.74332 0.74332 0.73807 1.00000 N3 N 0.43135 0.08819 0.73605 1.00000 N4 N 0.91181 0.56865 0.26395 1.00000 N5 N 0.25668 0.25668 0.26193 1.00000 N6 N 0.08819 0.43135 0.73605 1.00000