# generated using pymatgen
data_SmTh3(CoB4)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.91278691
_cell_length_b   6.91278675
_cell_length_c   6.91278743
_cell_angle_alpha   112.50883026
_cell_angle_beta   112.50882798
_cell_angle_gamma   103.55321580
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SmTh3(CoB4)4
_chemical_formula_sum   'Sm1 Th3 Co4 B16'
_cell_volume   252.28875635
_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
  Sm  Sm0  1  0.25000000  0.75000000  0.50000000  1.0
  Th  Th1  1  0.21502416  0.21502416  0.00000000  1.0
  Th  Th2  1  0.78497584  0.78497584  1.00000000  1.0
  Th  Th3  1  0.75000000  0.25000000  0.50000000  1.0
  Co  Co4  1  0.50080392  0.27134950  0.77054558  1.0
  Co  Co5  1  0.50080392  0.73025834  0.22945442  1.0
  Co  Co6  1  0.72865050  0.49919608  0.22945442  1.0
  Co  Co7  1  0.26974166  0.49919608  0.77054558  1.0
  B  B8  1  0.11210834  0.27664865  0.38904608  1.0
  B  B9  1  0.88760257  0.72306326  0.61095392  1.0
  B  B10  1  0.88760257  0.27664865  0.16454031  1.0
  B  B11  1  0.11210834  0.72306326  0.83545969  1.0
  B  B12  1  0.72335135  0.88789166  0.61095392  1.0
  B  B13  1  0.27693674  0.11239743  0.38904608  1.0
  B  B14  1  0.72335135  0.11239743  0.83545969  1.0
  B  B15  1  0.27693674  0.88789166  0.16454031  1.0
  B  B16  1  0.41748003  0.41894914  0.53764033  1.0
  B  B17  1  0.88130881  0.87983970  0.46235967  1.0
  B  B18  1  0.58105086  0.11869119  0.99853090  1.0
  B  B19  1  0.12016030  0.58251997  0.00146910  1.0
  B  B20  1  0.58105086  0.58251997  0.46235967  1.0
  B  B21  1  0.12016030  0.11869119  0.53764033  1.0
  B  B22  1  0.88130881  0.41894914  0.00146910  1.0
  B  B23  1  0.41748003  0.87983970  0.99853090  1.0