# generated using pymatgen
data_CaMnV4(CuO6)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.43806000
_cell_length_b   6.43806000
_cell_length_c   6.43806000
_cell_angle_alpha   110.50823942
_cell_angle_beta   108.98245334
_cell_angle_gamma   108.92797718
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaMnV4(CuO6)2
_chemical_formula_sum   'Ca1 Mn1 V4 Cu2 O12'
_cell_volume   205.36959020
_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  0.00000000  0.00000000  0.00000000  1.0
  Mn  Mn1  1  0.50000000  0.00000000  0.50000000  1.0
  V  V2  1  0.00000000  0.50000000  0.00000000  1.0
  V  V3  1  0.50000000  0.00000000  0.00000000  1.0
  V  V4  1  0.00000000  0.00000000  0.50000000  1.0
  V  V5  1  0.50000000  0.50000000  0.50000000  1.0
  Cu  Cu6  1  0.50000000  0.50000000  0.00000000  1.0
  Cu  Cu7  1  0.00000000  0.50000000  0.50000000  1.0
  O  O8  1  0.69409800  0.17624000  0.87033800  1.0
  O  O9  1  0.30590200  0.82376000  0.12966200  1.0
  O  O10  1  0.30590200  0.17624000  0.48214200  1.0
  O  O11  1  0.69409800  0.82376000  0.51785800  1.0
  O  O12  1  0.88203500  0.70199500  0.18004000  1.0
  O  O13  1  0.11796500  0.29800500  0.81996000  1.0
  O  O14  1  0.47804500  0.29800500  0.18004000  1.0
  O  O15  1  0.52195500  0.70199500  0.81996000  1.0
  O  O16  1  0.18305900  0.87826200  0.69520300  1.0
  O  O17  1  0.81694100  0.12173800  0.30479700  1.0
  O  O18  1  0.18305900  0.48785600  0.30479700  1.0
  O  O19  1  0.81694100  0.51214400  0.69520300  1.0