# generated using pymatgen
data_CaMn4(CuO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.41090801
_cell_length_b   6.38532047
_cell_length_c   6.42492269
_cell_angle_alpha   70.44068961
_cell_angle_beta   110.92858237
_cell_angle_gamma   71.71372839
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaMn4(CuO4)3
_chemical_formula_sum   'Ca1 Mn4 Cu3 O12'
_cell_volume   201.47807095
_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
  Ca  Ca0  1  0.00009400  0.99994400  0.99995000  1.0
  Mn  Mn1  1  0.00005500  0.00000900  0.49999900  1.0
  Mn  Mn2  1  0.50001600  0.49995800  0.50001700  1.0
  Mn  Mn3  1  0.00001100  0.49996500  0.00007100  1.0
  Mn  Mn4  1  0.50004700  0.99996300  0.00003400  1.0
  Cu  Cu5  1  0.00033200  0.49988400  0.50007900  1.0
  Cu  Cu6  1  0.49972400  0.50014000  0.99989000  1.0
  Cu  Cu7  1  0.49992200  0.00017500  0.49994500  1.0
  O  O8  1  0.70297600  0.81709700  0.85988100  1.0
  O  O9  1  0.31420100  0.82359000  0.47990800  1.0
  O  O10  1  0.68571900  0.17630300  0.52008400  1.0
  O  O11  1  0.86210400  0.31431600  0.17328900  1.0
  O  O12  1  0.83192900  0.47356500  0.69447100  1.0
  O  O13  1  0.16808400  0.52635200  0.30563100  1.0
  O  O14  1  0.51552500  0.31731800  0.82052400  1.0
  O  O15  1  0.82366400  0.86848200  0.30580600  1.0
  O  O16  1  0.29710200  0.18276600  0.14028300  1.0
  O  O17  1  0.48428700  0.68283800  0.17939900  1.0
  O  O18  1  0.13784700  0.68579000  0.82668300  1.0
  O  O19  1  0.17635800  0.13154800  0.69405700  1.0