data_[V6Sn2H2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  V  1.6300  1.3500  0.7775
  Sn  1.9600  1.4500  0.8300
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [4.5521]
_cell_length_b [5.5056]
_cell_length_c [5.1238]
_cell_angle_alpha [90.0000]
_cell_angle_beta [92.6546]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [V3SnH]
_chemical_formula_sum '[V6 Sn2 H2]'
_cell_volume [128.2738]
_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
[
  V  V0  4  0.2479  0.5217  0.8509  1.0
  V  V1  2  0.2155  0.2500  0.3322  1.0
  Sn  Sn2  2  0.2597  0.7500  0.3514  1.0
  H  H3  2  0.4447  0.2500  0.0586  1.0
]