# generated using pymatgen data_Ca11(RhN5)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 14.85375700 _cell_length_b 14.85375700 _cell_length_c 3.69041200 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca11(RhN5)2 _chemical_formula_sum 'Ca22 Rh4 N20' _cell_volume 814.23071923 _cell_formula_units_Z 2 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Ca Ca0 1 0.50000000 0.50000000 0.50000000 1.0 Ca Ca1 1 0.00000000 0.00000000 0.00000000 1.0 Ca Ca2 1 0.97276400 0.78751600 0.50000000 1.0 Ca Ca3 1 0.02723600 0.21248400 0.50000000 1.0 Ca Ca4 1 0.52723600 0.28751600 0.00000000 1.0 Ca Ca5 1 0.47276400 0.71248400 0.00000000 1.0 Ca Ca6 1 0.78751600 0.97276400 0.50000000 1.0 Ca Ca7 1 0.21248400 0.02723600 0.50000000 1.0 Ca Ca8 1 0.28751600 0.52723600 0.00000000 1.0 Ca Ca9 1 0.71248400 0.47276400 0.00000000 1.0 Ca Ca10 1 0.69878100 0.69878100 0.50000000 1.0 Ca Ca11 1 0.30121900 0.30121900 0.50000000 1.0 Ca Ca12 1 0.80121900 0.19878100 0.00000000 1.0 Ca Ca13 1 0.19878100 0.80121900 0.00000000 1.0 Ca Ca14 1 0.38807700 0.89302400 0.50000000 1.0 Ca Ca15 1 0.61192300 0.10697600 0.50000000 1.0 Ca Ca16 1 0.11192300 0.39302400 0.00000000 1.0 Ca Ca17 1 0.88807700 0.60697600 0.00000000 1.0 Ca Ca18 1 0.89302400 0.38807700 0.50000000 1.0 Ca Ca19 1 0.10697600 0.61192300 0.50000000 1.0 Ca Ca20 1 0.39302400 0.11192300 0.00000000 1.0 Ca Ca21 1 0.60697600 0.88807700 0.00000000 1.0 Rh Rh22 1 0.30172400 0.69827600 0.50000000 1.0 Rh Rh23 1 0.69827600 0.30172400 0.50000000 1.0 Rh Rh24 1 0.19827600 0.19827600 0.00000000 1.0 Rh Rh25 1 0.80172400 0.80172400 0.00000000 1.0 N N26 1 0.13316400 0.86683600 0.50000000 1.0 N N27 1 0.86683600 0.13316400 0.50000000 1.0 N N28 1 0.36683600 0.36683600 0.00000000 1.0 N N29 1 0.63316400 0.63316400 0.00000000 1.0 N N30 1 0.46543100 0.18641100 0.50000000 1.0 N N31 1 0.53456900 0.81358900 0.50000000 1.0 N N32 1 0.03456900 0.68641100 0.00000000 1.0 N N33 1 0.96543100 0.31358900 0.00000000 1.0 N N34 1 0.18641100 0.46543100 0.50000000 1.0 N N35 1 0.81358900 0.53456900 0.50000000 1.0 N N36 1 0.68641100 0.03456900 0.00000000 1.0 N N37 1 0.31358900 0.96543100 0.00000000 1.0 N N38 1 0.07388200 0.92611800 0.50000000 1.0 N N39 1 0.92611800 0.07388200 0.50000000 1.0 N N40 1 0.42611800 0.42611800 0.00000000 1.0 N N41 1 0.57388200 0.57388200 0.00000000 1.0 N N42 1 0.61009200 0.38990800 0.50000000 1.0 N N43 1 0.38990800 0.61009200 0.50000000 1.0 N N44 1 0.88990800 0.88990800 0.00000000 1.0 N N45 1 0.11009200 0.11009200 0.00000000 1.0