data_LaCoP2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.86
_cell_length_b   4.86
_cell_length_c   4.86
_cell_angle_alpha   134.16
_cell_angle_beta   105.92
_cell_angle_gamma   91.66
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaCoP2
_chemical_formula_sum   'La1 Co1 P2'
_cell_volume   75.14
_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  0.39  1.0
  Co  Co0  1  0.0  0.0  0.0  1.0
  P  P2  1  0.89  0.0  0.16  1.0
  P  P3  1  0.0  0.93  0.23  1.0

data_LaCoP2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.79
_cell_length_b   4.86
_cell_length_c   4.86
_cell_angle_alpha   74.08
_cell_angle_beta   67.08
_cell_angle_gamma   67.08
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaCoP2
_chemical_formula_sum   'La1 Co1 P2'
_cell_volume   75.14
_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  0.39  0.0  0.61  1.0
  Co  Co1  1  0.0  0.0  0.0  1.0
  P  P2  1  0.23  0.0  0.7  1.0
  P  P3  1  0.27  0.89  0.84  1.0

La Co P P
La Co P P 0 3 o - o 1 2 - o o 2 3 + - o 