# generated using pymatgen data_BaVNiP2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.97986713 _cell_length_b 6.97986730 _cell_length_c 6.97986652 _cell_angle_alpha 147.42325418 _cell_angle_beta 147.42324890 _cell_angle_gamma 46.73749352 _symmetry_Int_Tables_number 1 _chemical_formula_structural BaVNiP2 _chemical_formula_sum 'Ba1 V1 Ni1 P2' _cell_volume 98.22212375 _cell_formula_units_Z 1 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 Ba Ba0 1 0.00000000 0.00000000 0.00000000 1.0 V V1 1 0.75000000 0.25000000 0.50000000 1.0 Ni Ni2 1 0.25000000 0.75000000 0.50000000 1.0 P P3 1 0.65372996 0.65372996 1.00000000 1.0 P P4 1 0.34627004 0.34627004 0.00000000 1.0