# generated using pymatgen
data_MnAl2N3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.66859693
_cell_length_b   5.53253118
_cell_length_c   4.96997179
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnAl2N3
_chemical_formula_sum   'Mn4 Al8 N12'
_cell_volume   265.85280649
_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  0.65937400  0.00000000  0.98873200  1
  Mn  Mn1  1  0.34062600  0.00000000  0.48873200  1
  Mn  Mn2  1  0.15937400  0.50000000  0.98873200  1
  Mn  Mn3  1  0.84062600  0.50000000  0.48873200  1
  Al  Al4  1  0.66171400  0.67030200  0.98972200  1
  Al  Al5  1  0.16171400  0.82969800  0.98972200  1
  Al  Al6  1  0.83828600  0.82969800  0.48972200  1
  Al  Al7  1  0.33828600  0.67030200  0.48972200  1
  Al  Al8  1  0.16171400  0.17030200  0.98972200  1
  Al  Al9  1  0.66171400  0.32969800  0.98972200  1
  Al  Al10  1  0.33828600  0.32969800  0.48972200  1
  Al  Al11  1  0.83828600  0.17030200  0.48972200  1
  N  N12  1  0.66259300  0.67371600  0.37168100  1
  N  N13  1  0.16259300  0.82628400  0.37168100  1
  N  N14  1  0.83740700  0.82628400  0.87168100  1
  N  N15  1  0.33740700  0.67371600  0.87168100  1
  N  N16  1  0.68576700  0.00000000  0.37646100  1
  N  N17  1  0.31423300  0.00000000  0.87646100  1
  N  N18  1  0.16259300  0.17371600  0.37168100  1
  N  N19  1  0.66259300  0.32628400  0.37168100  1
  N  N20  1  0.33740700  0.32628400  0.87168100  1
  N  N21  1  0.83740700  0.17371600  0.87168100  1
  N  N22  1  0.18576700  0.50000000  0.37646100  1
  N  N23  1  0.81423300  0.50000000  0.87646100  1
