# generated using pymatgen
data_Mg3CrN3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.87017500
_cell_length_b   6.87101607
_cell_length_c   4.41296300
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99156767
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg3CrN3
_chemical_formula_sum   'Mg6 Cr2 N6'
_cell_volume   180.42078899
_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  0.82785700  0.65370000  0.25000000  1.0
  Mg  Mg1  1  0.82588700  0.17208200  0.25000000  1.0
  Mg  Mg2  1  0.34621600  0.17408000  0.25000000  1.0
  Mg  Mg3  1  0.17214300  0.34630000  0.75000000  1.0
  Mg  Mg4  1  0.17411300  0.82791800  0.75000000  1.0
  Mg  Mg5  1  0.65378400  0.82592000  0.75000000  1.0
  Cr  Cr6  1  0.66667800  0.33324800  0.75000000  1.0
  Cr  Cr7  1  0.33332200  0.66675200  0.25000000  1.0
  N  N8  1  0.81750700  0.63278500  0.75000000  1.0
  N  N9  1  0.81541000  0.18243300  0.75000000  1.0
  N  N10  1  0.36710900  0.18443000  0.75000000  1.0
  N  N11  1  0.18249300  0.36721500  0.25000000  1.0
  N  N12  1  0.18459000  0.81756700  0.25000000  1.0
  N  N13  1  0.63289100  0.81557000  0.25000000  1.0