# generated using pymatgen
data_LiHo(CoH3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.73336965
_cell_length_b   4.73336923
_cell_length_c   4.73336984
_cell_angle_alpha   59.97282800
_cell_angle_beta   59.97283701
_cell_angle_gamma   59.97283362
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiHo(CoH3)2
_chemical_formula_sum   'Li1 Ho1 Co2 H6'
_cell_volume   74.94257575
_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
  Li  Li0  1  0.75000000  0.75000000  0.75000000  1.0
  Ho  Ho1  1  0.25000000  0.25000000  0.25000000  1.0
  Co  Co2  1  0.00009928  0.00009928  0.00009928  1.0
  Co  Co3  1  0.49990072  0.49990072  0.49990072  1.0
  H  H4  1  0.74999900  0.24908600  0.25091500  1.0
  H  H5  1  0.74965398  0.75034402  0.25000100  1.0
  H  H6  1  0.25091300  0.75000100  0.24908600  1.0
  H  H7  1  0.75034602  0.24999900  0.74965398  1.0
  H  H8  1  0.24908500  0.25091600  0.74999900  1.0
  H  H9  1  0.25000100  0.74965398  0.75034502  1.0