# generated using pymatgen
data_Zr2Ni7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.61301714
_cell_length_b   6.47086014
_cell_length_c   56.60537383
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   105.30243785
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr2Ni7
_chemical_formula_sum   'Zr12 Ni42'
_cell_volume   1629.77546003
_cell_formula_units_Z   6
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
  Zr  Zr1  1  0.603467  0.768945  0.300857  1
  Zr  Zr2  1  0.406973  0.230042  0.300857  1
  Zr  Zr3  1  0.103560  0.766982  0.367758  1
  Zr  Zr4  1  0.906879  0.232005  0.367758  1
  Zr  Zr5  1  0.605365  0.766800  0.438856  1
  Zr  Zr6  1  0.405074  0.232187  0.438856  1
  Zr  Zr7  1  0.105659  0.766618  0.510625  1
  Zr  Zr8  1  0.904781  0.232369  0.510625  1
  Zr  Zr9  1  0.605436  0.766671  0.582467  1
  Zr  Zr10  1  0.405004  0.232316  0.582467  1
  Zr  Zr11  1  0.101974  0.764746  0.653458  1
  Zr  Zr12  1  0.908466  0.234241  0.653458  1
  Ni  Ni13  1  1.005220  0.499493  0.292591  1
  Ni  Ni14  1  0.631307  0.848244  0.390979  1
  Ni  Ni15  1  0.379133  0.150743  0.390979  1
  Ni  Ni16  1  0.380417  0.148489  0.344617  1
  Ni  Ni17  1  0.630023  0.850498  0.344617  1
  Ni  Ni18  1  0.250678  0.498427  0.330798  1
  Ni  Ni19  1  0.255638  0.499548  0.403068  1
  Ni  Ni20  1  0.505220  0.499493  0.366768  1
  Ni  Ni21  1  0.130238  0.845670  0.320295  1
  Ni  Ni22  1  0.880202  0.153317  0.320295  1
  Ni  Ni23  1  0.877825  0.149962  0.415382  1
  Ni  Ni24  1  0.132615  0.849025  0.415382  1
  Ni  Ni25  1  0.754801  0.499439  0.403068  1
  Ni  Ni26  1  0.759762  0.500560  0.330798  1
  Ni  Ni27  1  1.005220  0.499493  0.438925  1
  Ni  Ni28  1  0.633655  0.848785  0.534193  1
  Ni  Ni29  1  0.376784  0.150202  0.534193  1
  Ni  Ni30  1  0.376637  0.150047  0.487067  1
  Ni  Ni31  1  0.633802  0.848940  0.487067  1
  Ni  Ni32  1  0.255314  0.499526  0.474771  1
  Ni  Ni33  1  0.255315  0.499531  0.546509  1
  Ni  Ni34  1  0.505220  0.499493  0.510638  1
  Ni  Ni35  1  0.133525  0.848816  0.462384  1
  Ni  Ni36  1  0.876915  0.150171  0.462384  1
  Ni  Ni37  1  0.876936  0.150112  0.558802  1
  Ni  Ni38  1  0.133504  0.848875  0.558802  1
  Ni  Ni39  1  0.755124  0.499455  0.546509  1
  Ni  Ni40  1  0.755125  0.499461  0.474771  1
  Ni  Ni41  1  1.005220  0.499493  0.582366  1
  Ni  Ni42  1  0.629035  0.843247  0.677082  1
  Ni  Ni43  1  0.381405  0.155740  0.677082  1
  Ni  Ni44  1  0.378277  0.150164  0.630452  1
  Ni  Ni45  1  0.632163  0.848823  0.630452  1
  Ni  Ni46  1  0.256820  0.499475  0.618259  1
  Ni  Ni47  1  0.248947  0.494590  0.692004  1
  Ni  Ni48  1  0.505220  0.499493  0.655201  1
  Ni  Ni49  1  0.133219  0.848931  0.605598  1
  Ni  Ni50  1  0.877220  0.150056  0.605598  1
  Ni  Ni51  1  0.873099  0.146941  0.699870  1
  Ni  Ni52  1  0.137341  0.852045  0.699870  1
  Ni  Ni53  1  0.761493  0.504397  0.692004  1
  Ni  Ni54  1  0.753619  0.499511  0.618259  1
