# generated using pymatgen
data_Ca4GaSi6Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.22340819
_cell_length_b   8.01857068
_cell_length_c   5.95474336
_cell_angle_alpha   70.33445238
_cell_angle_beta   66.66872726
_cell_angle_gamma   42.99477320
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca4GaSi6Ni
_chemical_formula_sum   'Ca4 Ga1 Si6 Ni1'
_cell_volume   245.18004239
_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
  Ca  Ca0  1  0.74710530  0.74709525  0.75290413  1.0
  Ca  Ca1  1  0.75442430  0.25150367  0.74849416  1.0
  Ca  Ca2  1  0.24708688  0.24710483  0.25290164  1.0
  Ca  Ca3  1  0.25150713  0.75442165  0.24560014  1.0
  Ga  Ga4  1  0.33408100  0.33402703  0.66600010  1.0
  Si  Si5  1  0.82316842  0.35234958  0.17675511  1.0
  Si  Si6  1  0.67929244  0.16030963  0.32070623  1.0
  Si  Si7  1  0.16032828  0.67926596  0.83977008  1.0
  Si  Si8  1  0.35237618  0.82316666  0.64768316  1.0
  Si  Si9  1  0.16056478  0.16062126  0.83936528  1.0
  Si  Si10  1  0.82388190  0.82393627  0.17605859  1.0
  Ni  Ni11  1  0.66618239  0.66619721  0.33376238  1.0