data_MnCoP2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.82
_cell_length_b   3.82
_cell_length_c   4.68
_cell_angle_alpha   102.44
_cell_angle_beta   102.44
_cell_angle_gamma   41.99
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnCoP2
_chemical_formula_sum   'Mn1 Co1 P2'
_cell_volume   44.48
_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
  Mn  Mn1  1  0.0  0.0  0.0  1.0
  Co  Co0  1  0.03  0.0  0.28  1.0
  P  P2  1  0.97  0.0  0.48  1.0
  P  P3  1  0.09  0.0  0.08  1.0

data_MnCoP2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.74
_cell_length_b   3.82
_cell_length_c   4.68
_cell_angle_alpha   102.44
_cell_angle_beta   90.0
_cell_angle_gamma   110.99
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnCoP2
_chemical_formula_sum   'Mn1 Co1 P2'
_cell_volume   44.48
_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
  Mn  Mn0  1  0.0  0.0  0.0  1.0
  Co  Co1  1  0.0  0.97  0.72  1.0
  P  P2  1  0.0  0.03  0.52  1.0
  P  P3  1  0.0  0.91  0.92  1.0

Mn Co P P