data_ZrGaMo2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.06
_cell_length_b   5.06
_cell_length_c   4.61
_cell_angle_alpha   107.39
_cell_angle_beta   107.39
_cell_angle_gamma   38.67
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrGaMo2
_chemical_formula_sum   'Zr1 Ga1 Mo2'
_cell_volume   69.93
_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
  Zr  Zr3  1  0.04  0.0  0.19  1.0
  Ga  Ga0  1  0.0  0.0  0.0  1.0
  Mo  Mo1  1  0.26  0.0  0.44  1.0
  Mo  Mo2  1  0.83  0.0  0.93  1.0

data_ZrGaMo2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.35
_cell_length_b   4.61
_cell_length_c   5.06
_cell_angle_alpha   107.39
_cell_angle_beta   109.33
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrGaMo2
_chemical_formula_sum   'Zr1 Ga1 Mo2'
_cell_volume   69.93
_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
  Zr  Zr0  1  0.0  0.19  0.04  1.0
  Ga  Ga1  1  0.0  0.0  0.0  1.0
  Mo  Mo2  1  0.0  0.44  0.26  1.0
  Mo  Mo3  1  0.0  0.93  0.83  1.0

Zr Ga Mo Mo