# generated using pymatgen
data_YH3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.33228758
_cell_length_b   6.33228823
_cell_length_c   6.60184352
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00001240
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YH3
_chemical_formula_sum   'Y6 H18'
_cell_volume   229.25409839
_cell_formula_units_Z   6
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  0.67072413  0.67072413  0.75040946  1.0
  Y  Y1  1  0.32927555  0.00000003  0.75040950  1.0
  Y  Y2  1  0.00000003  0.32927555  0.75040950  1.0
  Y  Y3  1  0.32927587  0.32927587  0.25040946  1.0
  Y  Y4  1  0.67072445  -0.00000003  0.25040950  1.0
  Y  Y5  1  -0.00000003  0.67072445  0.25040950  1.0
  H  H6  1  0.30139357  0.30139357  0.59074146  1.0
  H  H7  1  0.69860566  -0.00000039  0.59074123  1.0
  H  H8  1  -0.00000039  0.69860566  0.59074123  1.0
  H  H9  1  0.69860643  0.69860643  0.09074146  1.0
  H  H10  1  0.30139434  0.00000039  0.09074123  1.0
  H  H11  1  0.00000039  0.30139434  0.09074123  1.0
  H  H12  1  0.35728262  0.35728262  0.90945278  1.0
  H  H13  1  0.64271714  0.99999994  0.90945265  1.0
  H  H14  1  0.99999994  0.64271714  0.90945265  1.0
  H  H15  1  0.64271738  0.64271738  0.40945278  1.0
  H  H16  1  0.35728286  0.00000006  0.40945265  1.0
  H  H17  1  0.00000006  0.35728286  0.40945265  1.0
  H  H18  1  -0.00000048  -0.00000048  0.81528708  1.0
  H  H19  1  0.00000048  0.00000048  0.31528708  1.0
  H  H20  1  0.33333314  0.66666668  0.70545173  1.0
  H  H21  1  0.66666668  0.33333314  0.70545173  1.0
  H  H22  1  0.66666686  0.33333332  0.20545173  1.0
  H  H23  1  0.33333332  0.66666686  0.20545173  1.0