# generated using pymatgen
data_NdTh3(CoB4)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.92282656
_cell_length_b   6.92282646
_cell_length_c   6.92282651
_cell_angle_alpha   112.50523766
_cell_angle_beta   112.50523129
_cell_angle_gamma   103.56004676
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NdTh3(CoB4)4
_chemical_formula_sum   'Nd1 Th3 Co4 B16'
_cell_volume   253.39416940
_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
  Nd  Nd0  1  0.25000000  0.75000000  0.50000000  1.0
  Th  Th1  1  0.21518826  0.21518826  1.00000000  1.0
  Th  Th2  1  0.78481174  0.78481174  0.00000000  1.0
  Th  Th3  1  0.75000000  0.25000000  0.50000000  1.0
  Co  Co4  1  0.50136490  0.27224420  0.77088030  1.0
  Co  Co5  1  0.50136490  0.73048459  0.22911970  1.0
  Co  Co6  1  0.72775580  0.49863510  0.22911970  1.0
  Co  Co7  1  0.26951541  0.49863510  0.77088030  1.0
  B  B8  1  0.11205122  0.27628332  0.38875972  1.0
  B  B9  1  0.88752360  0.72329250  0.61124028  1.0
  B  B10  1  0.88752360  0.27628332  0.16423210  1.0
  B  B11  1  0.11205122  0.72329250  0.83576790  1.0
  B  B12  1  0.72371668  0.88794878  0.61124028  1.0
  B  B13  1  0.27670750  0.11247640  0.38875972  1.0
  B  B14  1  0.72371668  0.11247640  0.83576790  1.0
  B  B15  1  0.27670750  0.88794878  0.16423210  1.0
  B  B16  1  0.41769915  0.41825094  0.53747190  1.0
  B  B17  1  0.88077904  0.88022726  0.46252810  1.0
  B  B18  1  0.58174906  0.11922096  0.99944822  1.0
  B  B19  1  0.11977274  0.58230085  0.00055178  1.0
  B  B20  1  0.58174906  0.58230085  0.46252810  1.0
  B  B21  1  0.11977274  0.11922096  0.53747190  1.0
  B  B22  1  0.88077904  0.41825094  0.00055178  1.0
  B  B23  1  0.41769915  0.88022726  0.99944822  1.0