# generated using pymatgen
data_Ca5Sn3H
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.44522888
_cell_length_b   9.44522888
_cell_length_c   9.44522888
_cell_angle_alpha   128.63989556
_cell_angle_beta   128.63989556
_cell_angle_gamma   75.59069112
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca5Sn3H
_chemical_formula_sum   'Ca10 Sn6 H2'
_cell_volume   500.15588497
_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
  Ca  Ca0  1  0.50000000  0.50000000  -0.00000000  1.0
  Ca  Ca1  1  0.00000000  -0.00000000  -0.00000000  1.0
  Ca  Ca2  1  0.51017781  0.01017781  0.82371338  1.0
  Ca  Ca3  1  0.18646443  0.68646443  0.17628662  1.0
  Ca  Ca4  1  0.01017781  0.18646443  0.50000000  1.0
  Ca  Ca5  1  0.68646443  0.51017781  0.50000000  1.0
  Ca  Ca6  1  0.48982219  0.98982219  0.17628662  1.0
  Ca  Ca7  1  0.81353557  0.31353557  0.82371338  1.0
  Ca  Ca8  1  0.98982219  0.81353557  0.50000000  1.0
  Ca  Ca9  1  0.31353557  0.48982219  0.50000000  1.0
  Sn  Sn10  1  0.25000000  0.25000000  -0.00000000  1.0
  Sn  Sn11  1  0.75000000  0.75000000  -0.00000000  1.0
  Sn  Sn12  1  0.87410004  0.37410004  0.24820108  1.0
  Sn  Sn13  1  0.12589996  0.62589996  0.75179892  1.0
  Sn  Sn14  1  0.37410004  0.12589996  0.50000000  1.0
  Sn  Sn15  1  0.62589996  0.87410004  0.50000000  1.0
  H  H16  1  0.25000000  0.75000000  0.50000000  1.0
  H  H17  1  0.75000000  0.25000000  0.50000000  1.0