# generated using pymatgen
data_DyTh3(NiB4)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.91758750
_cell_length_b   6.91758883
_cell_length_c   6.91758848
_cell_angle_alpha   112.76342780
_cell_angle_beta   112.76343178
_cell_angle_gamma   103.07025936
_symmetry_Int_Tables_number   1
_chemical_formula_structural   DyTh3(NiB4)4
_chemical_formula_sum   'Dy1 Th3 Ni4 B16'
_cell_volume   252.47642719
_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
  Dy  Dy0  1  0.25000000  0.75000000  0.50000000  1.0
  Th  Th1  1  0.79510253  0.79510253  0.00000000  1.0
  Th  Th2  1  0.20489747  0.20489747  1.00000000  1.0
  Th  Th3  1  0.75000000  0.25000000  0.50000000  1.0
  Ni  Ni4  1  0.27316378  0.50155956  0.77160321  1.0
  Ni  Ni5  1  0.72995635  0.50155956  0.22839679  1.0
  Ni  Ni6  1  0.49844044  0.72683622  0.22839679  1.0
  Ni  Ni7  1  0.49844044  0.27004365  0.77160321  1.0
  B  B8  1  0.27492230  0.11204293  0.38589786  1.0
  B  B9  1  0.72614507  0.88902344  0.61410214  1.0
  B  B10  1  0.27492230  0.88902344  0.16287837  1.0
  B  B11  1  0.72614507  0.11204293  0.83712163  1.0
  B  B12  1  0.11097656  0.72507770  0.83712163  1.0
  B  B13  1  0.88795707  0.27385493  0.16287837  1.0
  B  B14  1  0.11097656  0.27385493  0.38589786  1.0
  B  B15  1  0.88795707  0.72507770  0.61410214  1.0
  B  B16  1  0.11569438  0.11280550  0.53267022  1.0
  B  B17  1  0.58013528  0.58302316  0.46732978  1.0
  B  B18  1  0.11569438  0.58302316  0.00288888  1.0
  B  B19  1  0.58013528  0.11280550  0.99711112  1.0
  B  B20  1  0.88719450  0.88430562  0.46732978  1.0
  B  B21  1  0.41697684  0.41986472  0.53267022  1.0
  B  B22  1  0.88719450  0.41986472  0.00288888  1.0
  B  B23  1  0.41697684  0.88430562  0.99711112  1.0