# generated using pymatgen
data_Zr2Mn4P3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.63527134
_cell_length_b   12.63527134
_cell_length_c   3.58499312
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr2Mn4P3
_chemical_formula_sum   'Zr8 Mn16 P12'
_cell_volume   495.66482907
_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
  Zr  Zr0  1  0.00000000  0.17165000  0.50000000  1
  Zr  Zr1  1  0.82835000  0.82835000  0.50000000  1
  Zr  Zr2  1  0.17165000  0.00000000  0.50000000  1
  Zr  Zr3  1  0.66666700  0.33333300  0.00000000  1
  Zr  Zr4  1  0.33333300  0.66666700  0.00000000  1
  Zr  Zr5  1  0.00000000  0.54441000  0.00000000  1
  Zr  Zr6  1  0.45559000  0.45559000  0.00000000  1
  Zr  Zr7  1  0.54441000  0.00000000  0.00000000  1
  Mn  Mn8  1  0.00000000  0.71619100  0.50000000  1
  Mn  Mn9  1  0.28380900  0.28380900  0.50000000  1
  Mn  Mn10  1  0.71619100  0.00000000  0.50000000  1
  Mn  Mn11  1  0.80161300  0.17427900  0.00000000  1
  Mn  Mn12  1  0.82572100  0.62733400  0.00000000  1
  Mn  Mn13  1  0.37266600  0.19838700  0.00000000  1
  Mn  Mn14  1  0.17427900  0.80161300  0.00000000  1
  Mn  Mn15  1  0.62733400  0.82572100  0.00000000  1
  Mn  Mn16  1  0.19838700  0.37266600  0.00000000  1
  Mn  Mn17  1  0.87450400  0.34264200  0.50000000  1
  Mn  Mn18  1  0.65735800  0.53186100  0.50000000  1
  Mn  Mn19  1  0.46813900  0.12549600  0.50000000  1
  Mn  Mn20  1  0.34264200  0.87450400  0.50000000  1
  Mn  Mn21  1  0.53186100  0.65735800  0.50000000  1
  Mn  Mn22  1  0.12549600  0.46813900  0.50000000  1
  Mn  Mn23  1  0.00000000  0.00000000  0.00000000  1
  P  P24  1  0.00000000  0.82596700  0.00000000  1
  P  P25  1  0.17403300  0.17403300  0.00000000  1
  P  P26  1  0.82596700  0.00000000  0.00000000  1
  P  P27  1  0.67939700  0.17046300  0.50000000  1
  P  P28  1  0.82953700  0.50893400  0.50000000  1
  P  P29  1  0.49106600  0.32060300  0.50000000  1
  P  P30  1  0.17046300  0.67939700  0.50000000  1
  P  P31  1  0.50893400  0.82953700  0.50000000  1
  P  P32  1  0.32060300  0.49106600  0.50000000  1
  P  P33  1  0.00000000  0.33659400  0.00000000  1
  P  P34  1  0.66340600  0.66340600  0.00000000  1
  P  P35  1  0.33659400  0.00000000  0.00000000  1
