# generated using pymatgen
data_Mn3VN3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.84923841
_cell_length_b   6.84923841
_cell_length_c   3.90230884
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn3VN3
_chemical_formula_sum   'Mn6 V2 N6'
_cell_volume   158.53926354
_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
  Mn  Mn0  1  0.84326700  0.68653400  0.25000000  1
  Mn  Mn1  1  0.84326700  0.15673300  0.25000000  1
  Mn  Mn2  1  0.31346600  0.15673300  0.25000000  1
  Mn  Mn3  1  0.15673300  0.31346600  0.75000000  1
  Mn  Mn4  1  0.15673300  0.84326700  0.75000000  1
  Mn  Mn5  1  0.68653400  0.84326700  0.75000000  1
  V  V6  1  0.66666700  0.33333300  0.75000000  1
  V  V7  1  0.33333300  0.66666700  0.25000000  1
  N  N8  1  0.82106400  0.64212800  0.75000000  1
  N  N9  1  0.82106400  0.17893600  0.75000000  1
  N  N10  1  0.35787200  0.17893600  0.75000000  1
  N  N11  1  0.17893600  0.35787200  0.25000000  1
  N  N12  1  0.17893600  0.82106400  0.25000000  1
  N  N13  1  0.64212800  0.82106400  0.25000000  1
