# generated using pymatgen
data_Mn3CuAs2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.54790600
_cell_length_b   7.28942600
_cell_length_c   12.70097600
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn3CuAs2
_chemical_formula_sum   'Mn12 Cu4 As8'
_cell_volume   328.47515918
_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
  Mn  Mn0  1  0.25000000  0.19174500  0.81025500  1.0
  Mn  Mn1  1  0.25000000  0.30825500  0.31025500  1.0
  Mn  Mn2  1  0.75000000  0.80825500  0.18974500  1.0
  Mn  Mn3  1  0.75000000  0.69174500  0.68974500  1.0
  Mn  Mn4  1  0.25000000  0.80033500  0.84796400  1.0
  Mn  Mn5  1  0.25000000  0.69966500  0.34796400  1.0
  Mn  Mn6  1  0.75000000  0.19966500  0.15203600  1.0
  Mn  Mn7  1  0.75000000  0.30033500  0.65203600  1.0
  Mn  Mn8  1  0.75000000  0.44769400  0.89316500  1.0
  Mn  Mn9  1  0.75000000  0.05230600  0.39316500  1.0
  Mn  Mn10  1  0.25000000  0.55230600  0.10683500  1.0
  Mn  Mn11  1  0.25000000  0.94769400  0.60683500  1.0
  Cu  Cu12  1  0.75000000  0.05959000  0.94106900  1.0
  Cu  Cu13  1  0.75000000  0.44041000  0.44106900  1.0
  Cu  Cu14  1  0.25000000  0.94041000  0.05893100  1.0
  Cu  Cu15  1  0.25000000  0.55959000  0.55893100  1.0
  As  As16  1  0.75000000  0.99837500  0.74715500  1.0
  As  As17  1  0.75000000  0.50162500  0.24715500  1.0
  As  As18  1  0.25000000  0.00162500  0.25284500  1.0
  As  As19  1  0.25000000  0.49837500  0.75284500  1.0
  As  As20  1  0.25000000  0.27548500  0.00165300  1.0
  As  As21  1  0.25000000  0.22451500  0.50165300  1.0
  As  As22  1  0.75000000  0.72451500  0.99834700  1.0
  As  As23  1  0.75000000  0.77548500  0.49834700  1.0