# generated using pymatgen data_BaSr9(Tc2N7)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.45304506 _cell_length_b 9.19294021 _cell_length_c 9.33022218 _cell_angle_alpha 114.45704591 _cell_angle_beta 99.08359475 _cell_angle_gamma 89.85023332 _symmetry_Int_Tables_number 1 _chemical_formula_structural BaSr9(Tc2N7)2 _chemical_formula_sum 'Ba1 Sr9 Tc4 N14' _cell_volume 496.29573738 _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 0.86989602 0.58590454 0.33641454 1.0 Sr Sr1 1 0.26973037 0.98751316 0.56761992 1.0 Sr Sr2 1 0.70312198 0.41227789 0.85277326 1.0 Sr Sr3 1 0.29987356 0.58814337 0.14502894 1.0 Sr Sr4 1 0.39907304 0.79037697 0.90777602 1.0 Sr Sr5 1 0.59506647 0.20870799 0.08823846 1.0 Sr Sr6 1 0.14440542 0.40506733 0.67014593 1.0 Sr Sr7 1 0.88828338 0.85042751 0.76314443 1.0 Sr Sr8 1 0.11146509 0.15149000 0.23688919 1.0 Sr Sr9 1 0.72917485 0.01197327 0.43052531 1.0 Tc Tc10 1 0.57470762 0.36060316 0.47741278 1.0 Tc Tc11 1 0.42300953 0.64014404 0.52531848 1.0 Tc Tc12 1 0.12202605 0.21681004 0.91158154 1.0 Tc Tc13 1 0.87938115 0.78281704 0.08352346 1.0 N N14 1 0.54182422 0.55024033 0.67318156 1.0 N N15 1 0.44453076 0.44539453 0.32882957 1.0 N N16 1 0.17734064 0.72074321 0.59827934 1.0 N N17 1 0.83110316 0.29101988 0.42283929 1.0 N N18 1 0.41636388 0.19553342 0.48132397 1.0 N N19 1 0.57569821 0.80401922 0.51775848 1.0 N N20 1 0.95710091 0.14269168 0.71267150 1.0 N N21 1 0.04665497 0.85980423 0.28111197 1.0 N N22 1 0.22765432 0.05316401 0.95989555 1.0 N N23 1 0.77341825 0.94834483 0.03841236 1.0 N N24 1 0.35464302 0.32916550 0.90510921 1.0 N N25 1 0.97593868 0.34128027 0.06557906 1.0 N N26 1 0.02171447 0.65267343 0.92703086 1.0 N N27 1 0.64679996 0.67366916 0.09158301 1.0