# generated using pymatgen
data_Mn4(CuO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.28967501
_cell_length_b   6.29008442
_cell_length_c   6.30594239
_cell_angle_alpha   70.45674648
_cell_angle_beta   109.51133533
_cell_angle_gamma   70.59392090
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn4(CuO4)3
_chemical_formula_sum   'Mn4 Cu3 O12'
_cell_volume   191.93760849
_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  0.50000600  0.49999800  0.50000500  1.0
  Mn  Mn1  1  0.50000000  0.99999900  0.00000400  1.0
  Mn  Mn2  1  0.00000100  0.50000800  0.99999900  1.0
  Mn  Mn3  1  0.99999600  0.00000200  0.49999300  1.0
  Cu  Cu4  1  0.50000400  0.99999500  0.50000100  1.0
  Cu  Cu5  1  0.00000000  0.50000100  0.49999900  1.0
  Cu  Cu6  1  0.49999700  0.49999500  0.99999800  1.0
  O  O7  1  0.13583900  0.68605300  0.81810400  1.0
  O  O8  1  0.50388000  0.31671500  0.82115000  1.0
  O  O9  1  0.49612300  0.68328000  0.17885400  1.0
  O  O10  1  0.82046600  0.49616400  0.68260200  1.0
  O  O11  1  0.31679200  0.17941700  0.13790500  1.0
  O  O12  1  0.68320300  0.82058600  0.86209600  1.0
  O  O13  1  0.17814200  0.13578500  0.68227700  1.0
  O  O14  1  0.68613700  0.17812600  0.50415400  1.0
  O  O15  1  0.86415500  0.31395700  0.18188400  1.0
  O  O16  1  0.82185300  0.86422000  0.31771900  1.0
  O  O17  1  0.17953700  0.50383400  0.31740000  1.0
  O  O18  1  0.31386900  0.82187200  0.49584900  1.0