# generated using pymatgen
data_Mn4Zn(CuO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.40091540
_cell_length_b   6.39632715
_cell_length_c   6.34768148
_cell_angle_alpha   109.88523713
_cell_angle_beta   107.21213369
_cell_angle_gamma   111.52259450
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn4Zn(CuO4)3
_chemical_formula_sum   'Mn4 Zn1 Cu3 O12'
_cell_volume   199.33686355
_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  0.50002800  0.00004400  0.00009900  1.0
  Mn  Mn1  1  0.99995800  0.99991300  0.49996000  1.0
  Mn  Mn2  1  0.50004600  0.49997100  0.49994900  1.0
  Mn  Mn3  1  0.00002300  0.50008200  0.00002800  1.0
  Zn  Zn4  1  0.99994600  0.00028100  0.00014000  1.0
  Cu  Cu5  1  0.00003400  0.50001600  0.49997500  1.0
  Cu  Cu6  1  0.49974500  0.99989000  0.49978600  1.0
  Cu  Cu7  1  0.50007300  0.49989000  0.99993000  1.0
  O  O8  1  0.13936600  0.82937600  0.31925400  1.0
  O  O9  1  0.86077700  0.17070900  0.68087800  1.0
  O  O10  1  0.50732500  0.82130100  0.68111300  1.0
  O  O11  1  0.16386500  0.29879900  0.46240300  1.0
  O  O12  1  0.32158400  0.47307500  0.18243200  1.0
  O  O13  1  0.29628400  0.13732100  0.82139800  1.0
  O  O14  1  0.17563400  0.69229800  0.86903200  1.0
  O  O15  1  0.67839000  0.52686900  0.81758100  1.0
  O  O16  1  0.49271200  0.17869900  0.31900600  1.0
  O  O17  1  0.83611000  0.70118900  0.53756000  1.0
  O  O18  1  0.70373300  0.86268900  0.17861600  1.0
  O  O19  1  0.82436800  0.30758800  0.13086100  1.0