data_[Sr1Tc2H8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Tc  1.9000  1.3500  0.7417
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [P31m]
_cell_length_a [4.9248]
_cell_length_b [4.9248]
_cell_length_c [4.6279]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [157]
_chemical_formula_structural [Sr(TcH4)2]
_chemical_formula_sum '[Sr1 Tc2 H8]'
_cell_volume [97.2040]
_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
[
  Sr  Sr0  1  0.0000  0.0000  0.9358  1
  Tc  Tc1  2  0.3333  0.6667  0.4455  1
  H  H2  3  0.0000  0.4034  0.6593  1
  H  H3  3  0.0000  0.6965  0.3350  1
  H  H4  2  0.3333  0.6667  0.0830  1
]