data_[Ca2Mn2Cr2P4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ca  1.0000  1.8000  1.1400
  Mn  1.5500  1.4000  0.6483
  Cr  1.6600  1.4000  0.9400
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [I-4m2]
_cell_length_a [3.8675]
_cell_length_b [3.8675]
_cell_length_c [10.3081]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [119]
_chemical_formula_structural [CaMnCrP2]
_chemical_formula_sum '[Ca2 Mn2 Cr2 P4]'
_cell_volume [154.1840]
_cell_formula_units_Z [2]
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
[
  Ca  Ca0  2  0.0000  0.0000  0.0000  1.0
  Mn  Mn1  2  0.0000  0.5000  0.2500  1.0
  Cr  Cr2  2  0.0000  0.5000  0.7500  1.0
  P  P3  4  0.0000  0.0000  0.3703  1.0
]