data_[Zn2Mo2H2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zn  1.6500  1.3500  0.8800
  Mo  2.1600  1.4500  0.7750
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [2.7702]
_cell_length_b [2.9573]
_cell_length_c [9.2754]
_cell_angle_alpha [82.3517]
_cell_angle_beta [86.1894]
_cell_angle_gamma [65.9518]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [ZnMoH]
_chemical_formula_sum '[Zn2 Mo2 H2]'
_cell_volume [68.7684]
_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
[
  Zn  Zn0  1  0.3195  0.7569  0.6688  1.0
  Zn  Zn1  1  0.8981  0.4761  0.9016  1.0
  Mo  Mo2  1  0.2331  0.6422  0.1645  1.0
  Mo  Mo3  1  0.7236  0.0500  0.4003  1.0
  H  H4  1  0.0484  0.3776  0.4957  1.0
  H  H5  1  0.5679  0.0446  0.0694  1.0
]