# generated using pymatgen
data_CaMn5P3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.63477234
_cell_length_b   10.93515717
_cell_length_c   12.34305531
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaMn5P3
_chemical_formula_sum   'Ca4 Mn20 P12'
_cell_volume   490.59703494
_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
  Ca  Ca0  1  0.25000000  0.58907740  0.70554447  1.0
  Ca  Ca1  1  0.75000000  0.41092260  0.29445553  1.0
  Ca  Ca2  1  0.75000000  0.08907740  0.79445553  1.0
  Ca  Ca3  1  0.25000000  0.91092260  0.20554447  1.0
  Mn  Mn4  1  0.25000000  0.40929075  0.49495159  1.0
  Mn  Mn5  1  0.75000000  0.70898164  0.31822130  1.0
  Mn  Mn6  1  0.75000000  0.79101836  0.81822130  1.0
  Mn  Mn7  1  0.25000000  0.29101836  0.68177870  1.0
  Mn  Mn8  1  0.25000000  0.61422349  0.19046654  1.0
  Mn  Mn9  1  0.75000000  0.38577651  0.80953346  1.0
  Mn  Mn10  1  0.75000000  0.11422349  0.30953346  1.0
  Mn  Mn11  1  0.25000000  0.88577651  0.69046654  1.0
  Mn  Mn12  1  0.25000000  0.03335042  0.43559190  1.0
  Mn  Mn13  1  0.75000000  0.96664958  0.56440810  1.0
  Mn  Mn14  1  0.75000000  0.53335042  0.06440810  1.0
  Mn  Mn15  1  0.25000000  0.46664958  0.93559190  1.0
  Mn  Mn16  1  0.75000000  0.90929075  0.00504841  1.0
  Mn  Mn17  1  0.25000000  0.09070925  0.99495159  1.0
  Mn  Mn18  1  0.25000000  0.71302082  0.97824329  1.0
  Mn  Mn19  1  0.75000000  0.28697918  0.02175671  1.0
  Mn  Mn20  1  0.75000000  0.21302082  0.52175671  1.0
  Mn  Mn21  1  0.25000000  0.78697918  0.47824329  1.0
  Mn  Mn22  1  0.25000000  0.20898164  0.18177870  1.0
  Mn  Mn23  1  0.75000000  0.59070925  0.50504841  1.0
  P  P24  1  0.25000000  0.58968856  0.38072208  1.0
  P  P25  1  0.75000000  0.41031144  0.61927792  1.0
  P  P26  1  0.75000000  0.08968856  0.11927792  1.0
  P  P27  1  0.25000000  0.91031144  0.88072208  1.0
  P  P28  1  0.75000000  0.76844990  0.62741139  1.0
  P  P29  1  0.25000000  0.23155010  0.37258861  1.0
  P  P30  1  0.25000000  0.41249893  0.11749439  1.0
  P  P31  1  0.75000000  0.58750107  0.88250561  1.0
  P  P32  1  0.75000000  0.91249893  0.38250561  1.0
  P  P33  1  0.25000000  0.08750107  0.61749439  1.0
  P  P34  1  0.25000000  0.26844990  0.87258861  1.0
  P  P35  1  0.75000000  0.73155010  0.12741139  1.0