# generated using pymatgen
data_Mn9Nb12As3N4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.20564753
_cell_length_b   8.16671845
_cell_length_c   8.16671803
_cell_angle_alpha   60.00000170
_cell_angle_beta   60.15681424
_cell_angle_gamma   60.15681701
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn9Nb12As3N4
_chemical_formula_sum   'Mn9 Nb12 As3 N4'
_cell_volume   387.89872186
_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
  Mn  Mn0  1  0.12500000  0.62500000  0.62500000  1.0
  Mn  Mn1  1  0.74772770  0.41742410  0.41742410  1.0
  Mn  Mn2  1  0.41148188  0.74591039  0.42130437  1.0
  Mn  Mn3  1  0.41148188  0.42130437  0.74591039  1.0
  Mn  Mn4  1  0.41148188  0.42130437  0.42130437  1.0
  Mn  Mn5  1  0.50227230  0.83257590  0.83257590  1.0
  Mn  Mn6  1  0.83851812  0.50408961  0.82869563  1.0
  Mn  Mn7  1  0.83851812  0.82869563  0.50408961  1.0
  Mn  Mn8  1  0.83851812  0.82869563  0.82869563  1.0
  Nb  Nb9  1  0.80873042  0.80677675  0.19224641  1.0
  Nb  Nb10  1  0.19212863  0.19497445  0.80644846  1.0
  Nb  Nb11  1  0.80873042  0.19224641  0.80677675  1.0
  Nb  Nb12  1  0.19212863  0.80644846  0.19497445  1.0
  Nb  Nb13  1  0.19212863  0.80644846  0.80644846  1.0
  Nb  Nb14  1  0.80873042  0.19224641  0.19224641  1.0
  Nb  Nb15  1  0.44126958  0.44322325  0.05775359  1.0
  Nb  Nb16  1  0.05787137  0.05502555  0.44355154  1.0
  Nb  Nb17  1  0.44126958  0.05775359  0.44322325  1.0
  Nb  Nb18  1  0.05787137  0.44355154  0.05502555  1.0
  Nb  Nb19  1  0.05787137  0.44355154  0.44355154  1.0
  Nb  Nb20  1  0.44126958  0.05775359  0.05775359  1.0
  As  As21  1  0.62500000  0.12500000  0.62500000  1.0
  As  As22  1  0.62500000  0.62500000  0.12500000  1.0
  As  As23  1  0.62500000  0.62500000  0.62500000  1.0
  N  N24  1  0.62500000  0.12500000  0.12500000  1.0
  N  N25  1  0.12500000  0.62500000  0.12500000  1.0
  N  N26  1  0.12500000  0.12500000  0.62500000  1.0
  N  N27  1  0.12500000  0.12500000  0.12500000  1.0