# CIF generated by HEAS from Alexandria entry agm047677755 data_agm047677755 _cell_length_a 5.49376 _cell_length_b 5.49376 _cell_length_c 5.37653 _cell_angle_alpha 80.18179 _cell_angle_beta 80.18179 _cell_angle_gamma 120.00782 _cell_volume 132.09326 _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 Ca1 Ca 0.66712 0.33288 0.00000 1.00000 Ca2 Ca 0.33288 0.66712 0.00000 1.00000 Zr1 Zr 0.00000 0.00000 0.00000 1.00000 Cr1 Cr 0.83632 0.16368 0.50000 1.00000 Cr2 Cr 0.16368 0.83632 0.50000 1.00000 Cr3 Cr 0.50000 0.50000 0.50000 1.00000 N1 N 0.58879 0.90432 0.28604 1.00000 N2 N 0.77772 0.77772 0.71410 1.00000 N3 N 0.41121 0.09568 0.71396 1.00000 N4 N 0.90432 0.58879 0.28604 1.00000 N5 N 0.22228 0.22228 0.28590 1.00000 N6 N 0.09568 0.41121 0.71396 1.00000