data_Co2MoAs
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.82
_cell_length_b   5.14
_cell_length_c   5.14
_cell_angle_alpha   31.09
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Co2MoAs
_chemical_formula_sum   'Co2 Mo1 As1'
_cell_volume   52.09
_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
  Co  Co1  1  0.91  0.0  0.04  1.0
  Co  Co2  1  0.0  0.0  0.26  1.0
  Mo  Mo3  1  0.91  0.0  0.58  1.0
  As  As0  1  0.0  0.0  0.81  1.0

data_Co2MoAs
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.76
_cell_length_b   3.82
_cell_length_c   5.14
_cell_angle_alpha   90.0
_cell_angle_beta   105.55
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Co2MoAs
_chemical_formula_sum   'Co2 Mo1 As1'
_cell_volume   52.09
_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
  Co  Co0  1  0.74  0.0  0.74  1.0
  Co  Co1  1  0.96  0.91  0.96  1.0
  Mo  Mo2  1  0.42  0.91  0.42  1.0
  As  As3  1  0.19  0.0  0.19  1.0

Co Co Mo As