# generated using pymatgen
data_VBr5N3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.90271700
_cell_length_b   10.40192700
_cell_length_c   13.59602100
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VBr5N3
_chemical_formula_sum   'V4 Br20 N12'
_cell_volume   976.21549496
_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
  V  V0  1  0.64908000  0.25000000  0.58960400  1.0
  V  V1  1  0.85092000  0.25000000  0.08960400  1.0
  V  V2  1  0.35092000  0.75000000  0.41039600  1.0
  V  V3  1  0.14908000  0.75000000  0.91039600  1.0
  Br  Br4  1  0.68393800  0.48375100  0.60793300  1.0
  Br  Br5  1  0.81606200  0.01624900  0.10793300  1.0
  Br  Br6  1  0.31606200  0.98375100  0.39206700  1.0
  Br  Br7  1  0.18393800  0.51624900  0.89206700  1.0
  Br  Br8  1  0.31606200  0.51624900  0.39206700  1.0
  Br  Br9  1  0.18393800  0.98375100  0.89206700  1.0
  Br  Br10  1  0.68393800  0.01624900  0.60793300  1.0
  Br  Br11  1  0.81606200  0.48375100  0.10793300  1.0
  Br  Br12  1  0.96069700  0.25000000  0.50547500  1.0
  Br  Br13  1  0.53930300  0.25000000  0.00547500  1.0
  Br  Br14  1  0.03930300  0.75000000  0.49452500  1.0
  Br  Br15  1  0.46069700  0.75000000  0.99452500  1.0
  Br  Br16  1  0.90711800  0.25000000  0.76029700  1.0
  Br  Br17  1  0.59288200  0.25000000  0.26029700  1.0
  Br  Br18  1  0.09288200  0.75000000  0.23970300  1.0
  Br  Br19  1  0.40711800  0.75000000  0.73970300  1.0
  Br  Br20  1  0.42066900  0.25000000  0.72570800  1.0
  Br  Br21  1  0.07933100  0.25000000  0.22570800  1.0
  Br  Br22  1  0.57933100  0.75000000  0.27429200  1.0
  Br  Br23  1  0.92066900  0.75000000  0.77429200  1.0
  N  N24  1  0.15105300  0.50095100  0.64572700  1.0
  N  N25  1  0.34894700  0.99904900  0.14572700  1.0
  N  N26  1  0.84894700  0.00095100  0.35427300  1.0
  N  N27  1  0.65105300  0.49904900  0.85427300  1.0
  N  N28  1  0.84894700  0.49904900  0.35427300  1.0
  N  N29  1  0.65105300  0.00095100  0.85427300  1.0
  N  N30  1  0.15105300  0.99904900  0.64572700  1.0
  N  N31  1  0.34894700  0.50095100  0.14572700  1.0
  N  N32  1  0.51099900  0.25000000  0.49359300  1.0
  N  N33  1  0.98900100  0.25000000  0.99359300  1.0
  N  N34  1  0.48900100  0.75000000  0.50640700  1.0
  N  N35  1  0.01099900  0.75000000  0.00640700  1.0