# generated using pymatgen data_VCrAs2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.43703300 _cell_length_b 5.77868100 _cell_length_c 6.22008500 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural VCrAs2 _chemical_formula_sum 'V2 Cr2 As4' _cell_volume 123.54032579 _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 V V0 1 0.75000000 0.49308900 0.69323700 1.0 V V1 1 0.75000000 0.99308900 0.80676300 1.0 Cr Cr2 1 0.25000000 0.50715700 0.30714300 1.0 Cr Cr3 1 0.25000000 0.00715700 0.19285700 1.0 As As4 1 0.75000000 0.29901400 0.08019700 1.0 As As5 1 0.75000000 0.79901400 0.41980300 1.0 As As6 1 0.25000000 0.70074000 0.92618200 1.0 As As7 1 0.25000000 0.20074000 0.57381800 1.0