# generated using pymatgen data_Sr2CrN3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.15529590 _cell_length_b 10.95076952 _cell_length_c 12.28543105 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 27.18443376 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sr2CrN3 _chemical_formula_sum 'Sr8 Cr4 N12' _cell_volume 378.32371357 _cell_formula_units_Z 4 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 Sr Sr0 1 0.00000000 0.44374924 0.64339389 1.0 Sr Sr1 1 -0.00000000 0.55625076 0.35660611 1.0 Sr Sr2 1 -0.00000000 0.05625076 0.14339389 1.0 Sr Sr3 1 0.00000000 0.94374924 0.85660611 1.0 Sr Sr4 1 -0.00000000 0.14147842 0.57775783 1.0 Sr Sr5 1 0.00000000 0.85852158 0.42224217 1.0 Sr Sr6 1 0.00000000 0.35852158 0.07775783 1.0 Sr Sr7 1 -0.00000000 0.64147842 0.92224217 1.0 Cr Cr8 1 -0.00000000 0.25540656 0.83544432 1.0 Cr Cr9 1 0.00000000 0.74459344 0.16455568 1.0 Cr Cr10 1 0.00000000 0.24459344 0.33544432 1.0 Cr Cr11 1 -0.00000000 0.75540656 0.66455568 1.0 N N12 1 -0.00000000 0.16042962 0.95115449 1.0 N N13 1 0.00000000 0.83957038 0.04884551 1.0 N N14 1 0.00000000 0.33957038 0.45115449 1.0 N N15 1 -0.00000000 0.66042962 0.54884551 1.0 N N16 1 0.00000000 0.41151196 0.86824259 1.0 N N17 1 -0.00000000 0.58848804 0.13175741 1.0 N N18 1 -0.00000000 0.08848804 0.36824259 1.0 N N19 1 0.00000000 0.91151196 0.63175741 1.0 N N20 1 0.50000000 0.47171446 0.75000000 1.0 N N21 1 0.50000000 0.02828554 0.25000000 1.0 N N22 1 0.50000000 0.52828554 0.25000000 1.0 N N23 1 0.50000000 0.97171446 0.75000000 1.0