# generated using pymatgen
data_YH3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.66388371
_cell_length_b   3.66388371
_cell_length_c   6.61199897
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000771
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YH3
_chemical_formula_sum   'Y2 H6'
_cell_volume   76.86820440
_cell_formula_units_Z   2
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
  Y  Y0  1  0.33333300  0.66666700  0.25000000  1.0
  Y  Y1  1  0.66666700  0.33333300  0.75000000  1.0
  H  H2  1  0.33333300  0.66666700  0.90731749  1.0
  H  H3  1  0.66666700  0.33333300  0.09268251  1.0
  H  H4  1  0.33333300  0.66666700  0.59268251  1.0
  H  H5  1  0.66666700  0.33333300  0.40731749  1.0
  H  H6  1  -0.00000000  -0.00000000  0.25000000  1.0
  H  H7  1  -0.00000000  -0.00000000  0.75000000  1.0