data_LaAs3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.24
_cell_length_b   6.24
_cell_length_c   10.59
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaAs3
_chemical_formula_sum   'La4 As12'
_cell_volume   356.77
_cell_formula_units_Z   4
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
  La  La12  1  0.0  0.0  0.3  1.0
  La  La13  1  0.0  0.0  0.0  1.0
  La  La14  1  0.12  0.8  0.95  1.0
  La  La15  1  0.0  0.6  0.65  1.0
  As  As0  1  0.44  0.7  0.3  1.0
  As  As1  1  0.44  0.7  0.0  1.0
  As  As2  1  0.56  0.7  0.3  1.0
  As  As3  1  0.12  0.0  0.3  1.0
  As  As4  1  0.12  0.0  0.0  1.0
  As  As5  1  0.56  0.7  0.0  1.0
  As  As6  1  0.43  0.43  0.95  1.0
  As  As7  1  0.69  0.97  0.65  1.0
  As  As8  1  0.57  0.43  0.95  1.0
  As  As9  1  0.0  0.95  0.95  1.0
  As  As10  1  0.12  0.45  0.65  1.0
  As  As11  1  0.55  0.97  0.65  1.0

data_LaAs3
_symmetry_space_group_name_H-M   P1
_cell_length_a   6.24
_cell_length_b   6.24
_cell_length_c   10.59
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaAs3
_chemical_formula_sum   'La4 As12'
_cell_volume   356.77
_cell_formula_units_Z   4
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
  La  La0  1  0.0  0.0  0.0  1.0
  La  La1  1  0.0  0.0  0.3  1.0
  La  La2  1  0.0  0.6  0.65  1.0
  La  La3  1  0.12  0.8  0.95  1.0
  As  As4  1  0.0  0.95  0.95  1.0
  As  As5  1  0.12  0.0  -0.0  1.0
  As  As6  1  0.12  0.0  0.3  1.0
  As  As7  1  0.12  0.45  0.65  1.0
  As  As8  1  0.43  0.43  0.95  1.0
  As  As9  1  0.44  0.7  -0.0  1.0
  As  As10  1  0.44  0.7  0.3  1.0
  As  As11  1  0.55  0.97  0.65  1.0
  As  As12  1  0.56  0.7  -0.0  1.0
  As  As13  1  0.56  0.7  0.3  1.0
  As  As14  1  0.57  0.43  0.95  1.0
  As  As15  1  0.69  0.97  0.65  1.0

La La La La As As As As As As As As As As As As