data_LaCrPt
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.92
_cell_length_b   5.92
_cell_length_c   5.92
_cell_angle_alpha   151.12
_cell_angle_beta   142.53
_cell_angle_gamma   47.99
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaCrPt
_chemical_formula_sum   'La1 Cr1 Pt1'
_cell_volume   60.79
_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
  La  La1  1  0.0  0.0  0.23  1.0
  Cr  Cr0  1  0.0  0.0  0.34  1.0
  Pt  Pt2  1  0.0  0.0  0.07  1.0

data_LaCrPt
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.95
_cell_length_b   3.8
_cell_length_c   5.92
_cell_angle_alpha   108.74
_cell_angle_beta   104.44
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaCrPt
_chemical_formula_sum   'La1 Cr1 Pt1'
_cell_volume   60.79
_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
  La  La0  1  0.0  0.23  0.23  1.0
  Cr  Cr1  1  0.0  0.34  0.34  1.0
  Pt  Pt2  1  0.0  0.07  0.07  1.0

La Cr Pt
La Cr Pt 0 1 o o o 0 2 o o o 