# generated using pymatgen data_Pr10B2Br15 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.40010273 _cell_length_b 10.26961527 _cell_length_c 11.04382010 _cell_angle_alpha 90.97645535 _cell_angle_beta 114.47940984 _cell_angle_gamma 111.11648689 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr10B2Br15 _chemical_formula_sum 'Pr10 B2 Br15' _cell_volume 887.59290497 _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 Pr Pr0 1 0.80625227 0.41351129 0.27905724 1.0 Pr Pr1 1 0.19374773 0.58648871 0.72094276 1.0 Pr Pr2 1 0.67608933 0.74467619 0.81809347 1.0 Pr Pr3 1 0.32391067 0.25532381 0.18190653 1.0 Pr Pr4 1 0.52583874 0.70451183 0.09861097 1.0 Pr Pr5 1 0.47416126 0.29548817 0.90138903 1.0 Pr Pr6 1 0.58840359 0.03810661 0.32804671 1.0 Pr Pr7 1 0.41159641 0.96189339 0.67195329 1.0 Pr Pr8 1 0.72741576 0.07618887 0.04851635 1.0 Pr Pr9 1 0.27258424 0.92381113 0.95148365 1.0 B B10 1 0.46513172 0.81473516 0.87300054 1.0 B B11 1 0.53486828 0.18526484 0.12699946 1.0 Br Br12 1 0.00000000 0.00000000 0.00000000 1.0 Br Br13 1 0.63848039 0.88399595 0.58252756 1.0 Br Br14 1 0.36151961 0.11600405 0.41747244 1.0 Br Br15 1 0.88454437 0.29757671 0.53034528 1.0 Br Br16 1 0.11545563 0.70242329 0.46965472 1.0 Br Br17 1 0.28653688 0.76034219 0.18187328 1.0 Br Br18 1 0.71346312 0.23965781 0.81812672 1.0 Br Br19 1 0.05872562 0.34537678 0.22762281 1.0 Br Br20 1 0.15874220 0.05667226 0.70102395 1.0 Br Br21 1 0.84125780 0.94332774 0.29897605 1.0 Br Br22 1 0.23102004 0.40929624 0.94414044 1.0 Br Br23 1 0.76897996 0.59070376 0.05585956 1.0 Br Br24 1 0.40543279 0.46156685 0.65604525 1.0 Br Br25 1 0.59456721 0.53843315 0.34395475 1.0 Br Br26 1 0.94127438 0.65462322 0.77237719 1.0