# generated using pymatgen
data_Si2NiP3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.50759932
_cell_length_b   5.28096872
_cell_length_c   6.37876067
_cell_angle_alpha   114.45317899
_cell_angle_beta   105.95866408
_cell_angle_gamma   90.00000129
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Si2NiP3
_chemical_formula_sum   'Si2 Ni1 P3'
_cell_volume   102.53503490
_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
  Si  Si0  1  0.83520738  0.07822942  0.67041477  1.0
  Si  Si1  1  0.16479262  0.40781465  0.32958523  1.0
  Ni  Ni2  1  0.50000000  0.75229670  0.00000000  1.0
  P  P3  1  0.00000000  0.99527882  0.00000000  1.0
  P  P4  1  0.33784069  0.34932990  0.67567938  1.0
  P  P5  1  0.66215931  0.67365052  0.32432062  1.0