# generated using pymatgen
data_MgCr4O6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.28343826
_cell_length_b   5.28343826
_cell_length_c   15.24271600
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   147.03179245
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgCr4O6
_chemical_formula_sum   'Mg2 Cr8 O12'
_cell_volume   231.54376463
_cell_formula_units_Z   2
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
  Mg  Mg0  1  0.34094300  0.65905700  0.75000000  1.0
  Mg  Mg1  1  0.65905700  0.34094300  0.25000000  1.0
  Cr  Cr2  1  0.13631700  0.86368300  0.04578100  1.0
  Cr  Cr3  1  0.59480200  0.40519800  0.63648500  1.0
  Cr  Cr4  1  0.86368300  0.13631700  0.95421900  1.0
  Cr  Cr5  1  0.40519800  0.59480200  0.36351500  1.0
  Cr  Cr6  1  0.13631700  0.86368300  0.45421900  1.0
  Cr  Cr7  1  0.86368300  0.13631700  0.54578100  1.0
  Cr  Cr8  1  0.40519800  0.59480200  0.13648500  1.0
  Cr  Cr9  1  0.59480200  0.40519800  0.86351500  1.0
  O  O10  1  0.50000000  0.50000000  0.50000000  1.0
  O  O11  1  0.50000000  0.50000000  0.00000000  1.0
  O  O12  1  0.95845100  0.04154900  0.83819200  1.0
  O  O13  1  0.04154900  0.95845100  0.16180800  1.0
  O  O14  1  0.04154900  0.95845100  0.33819200  1.0
  O  O15  1  0.95845100  0.04154900  0.66180800  1.0
  O  O16  1  0.21348500  0.78651500  0.91804600  1.0
  O  O17  1  0.78651500  0.21348500  0.08195400  1.0
  O  O18  1  0.78651500  0.21348500  0.41804600  1.0
  O  O19  1  0.21348500  0.78651500  0.58195400  1.0
  O  O20  1  0.69858100  0.30141900  0.75000000  1.0
  O  O21  1  0.30141900  0.69858100  0.25000000  1.0