# generated using pymatgen
data_Mg2VNi3S8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.08663941
_cell_length_b   7.03231146
_cell_length_c   7.07846508
_cell_angle_alpha   59.71063838
_cell_angle_beta   59.96651249
_cell_angle_gamma   59.77144735
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg2VNi3S8
_chemical_formula_sum   'Mg2 V1 Ni3 S8'
_cell_volume   248.39456927
_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
  Mg  Mg0  1  0.87463800  0.87650100  0.87428600  1.0
  Mg  Mg1  1  0.12536300  0.12350100  0.12571500  1.0
  V  V2  1  0.50000100  0.99999200  0.50001200  1.0
  Ni  Ni3  1  0.50000100  0.50001500  0.49998100  1.0
  Ni  Ni4  1  0.50000200  0.49999300  0.00000000  1.0
  Ni  Ni5  1  0.99999700  0.49999400  0.50001000  1.0
  S  S6  1  0.73679900  0.73177700  0.73656300  1.0
  S  S7  1  0.26332500  0.26845800  0.70494200  1.0
  S  S8  1  0.26746600  0.69747500  0.26759400  1.0
  S  S9  1  0.70521700  0.26812800  0.26344200  1.0
  S  S10  1  0.73252100  0.30252700  0.73239500  1.0
  S  S11  1  0.29478400  0.73186400  0.73655700  1.0
  S  S12  1  0.26320000  0.26821900  0.26344600  1.0
  S  S13  1  0.73668900  0.73155100  0.29505700  1.0