# generated using pymatgen
data_Ti3Mn3BeAs2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.48702207
_cell_length_b   6.48702219
_cell_length_c   3.51363471
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999938
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti3Mn3BeAs2
_chemical_formula_sum   'Ti3 Mn3 Be1 As2'
_cell_volume   128.04953381
_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
  Ti  Ti0  1  0.59554304  0.00000000  0.00000000  1.0
  Ti  Ti1  1  1.00000000  0.59554304  0.00000000  1.0
  Ti  Ti2  1  0.40445696  0.40445696  0.00000000  1.0
  Mn  Mn3  1  0.23682291  0.00000000  0.50000000  1.0
  Mn  Mn4  1  0.00000000  0.23682291  0.50000000  1.0
  Mn  Mn5  1  0.76317709  0.76317709  0.50000000  1.0
  Be  Be6  1  0.00000000  0.00000000  0.00000000  1.0
  As  As7  1  0.33333300  0.66666700  0.50000000  1.0
  As  As8  1  0.66666700  0.33333300  0.50000000  1.0