# generated using pymatgen data_Ca7RhN6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.34640500 _cell_length_b 9.08579480 _cell_length_c 9.08572674 _cell_angle_alpha 80.69517556 _cell_angle_beta 69.56089187 _cell_angle_gamma 69.56121991 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca7RhN6 _chemical_formula_sum 'Ca14 Rh2 N12' _cell_volume 459.54270174 _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 0.27750600 0.95209900 0.04787800 1.0 Ca Ca1 1 0.72249400 0.04790100 0.95212200 1.0 Ca Ca2 1 0.22249700 0.45212100 0.54789900 1.0 Ca Ca3 1 0.77750300 0.54787900 0.45210100 1.0 Ca Ca4 1 0.76145900 0.15097300 0.58782100 1.0 Ca Ca5 1 0.49977000 0.58781100 0.15094600 1.0 Ca Ca6 1 0.73855200 0.91217600 0.34902400 1.0 Ca Ca7 1 0.00023900 0.34904800 0.91219100 1.0 Ca Ca8 1 0.23854100 0.84902700 0.41217900 1.0 Ca Ca9 1 0.50023000 0.41218900 0.84905400 1.0 Ca Ca10 1 0.26144800 0.08782400 0.65097600 1.0 Ca Ca11 1 0.99976100 0.65095200 0.08780900 1.0 Ca Ca12 1 0.25000200 0.24999700 0.25000100 1.0 Ca Ca13 1 0.74999800 0.75000300 0.74999900 1.0 Rh Rh14 1 0.74999200 0.25000700 0.24999500 1.0 Rh Rh15 1 0.25000800 0.74999300 0.75000500 1.0 N N16 1 0.00599100 0.07282500 0.30779400 1.0 N N17 1 0.61337500 0.30779900 0.07282800 1.0 N N18 1 0.49400000 0.19220500 0.42717900 1.0 N N19 1 0.88662200 0.42717200 0.19220200 1.0 N N20 1 0.99400900 0.92717500 0.69220600 1.0 N N21 1 0.38662500 0.69220100 0.92717200 1.0 N N22 1 0.50600000 0.80779500 0.57282100 1.0 N N23 1 0.11337800 0.57282800 0.80779800 1.0 N N24 1 0.89030300 0.35136200 0.64863500 1.0 N N25 1 0.10969700 0.64863800 0.35136500 1.0 N N26 1 0.60969900 0.85136500 0.14863600 1.0 N N27 1 0.39030100 0.14863500 0.85136400 1.0