# generated using pymatgen
data_Zr2Ni7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.92759528
_cell_length_b   12.61083692
_cell_length_c   50.93091378
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr2Ni7
_chemical_formula_sum   'Zr40 Ni140'
_cell_volume   5091.74737598
_cell_formula_units_Z   20
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  0.008865  0.708012  0.353784  1
  Zr  Zr2  1  0.008865  0.024125  0.306917  1
  Zr  Zr3  1  0.008865  0.475099  0.318402  1
  Zr  Zr4  1  0.008865  0.731646  0.274312  1
  Zr  Zr5  1  0.508865  0.187448  0.285506  1
  Zr  Zr6  1  0.508865  0.865926  0.329408  1
  Zr  Zr7  1  0.508865  0.628835  0.297611  1
  Zr  Zr8  1  0.508865  0.323099  0.339034  1
  Zr  Zr9  1  0.008865  0.069049  0.442307  1
  Zr  Zr10  1  0.008865  0.387986  0.397051  1
  Zr  Zr11  1  0.008865  0.840574  0.410021  1
  Zr  Zr12  1  0.008865  0.161171  0.362956  1
  Zr  Zr13  1  0.508865  0.545403  0.375667  1
  Zr  Zr14  1  0.508865  0.229235  0.419417  1
  Zr  Zr15  1  0.508865  1.002234  0.386518  1
  Zr  Zr16  1  0.508865  0.678162  0.432863  1
  Zr  Zr17  1  0.008865  0.429208  0.533791  1
  Zr  Zr18  1  0.008865  0.747402  0.488499  1
  Zr  Zr19  1  0.008865  0.200100  0.500041  1
  Zr  Zr20  1  0.008865  0.517876  0.455150  1
  Zr  Zr21  1  0.508865  0.908072  0.465504  1
  Zr  Zr22  1  0.508865  0.588114  0.511320  1
  Zr  Zr23  1  0.508865  0.358943  0.477561  1
  Zr  Zr24  1  0.508865  0.040695  0.522814  1
  Zr  Zr25  1  0.008865  0.784976  0.624723  1
  Zr  Zr26  1  0.008865  0.109817  0.578450  1
  Zr  Zr27  1  0.008865  0.558510  0.591930  1
  Zr  Zr28  1  0.008865  0.879754  0.545904  1
  Zr  Zr29  1  0.508865  0.270459  0.556076  1
  Zr  Zr30  1  0.508865  0.947783  0.601397  1
  Zr  Zr31  1  0.508865  0.719028  0.569207  1
  Zr  Zr32  1  0.508865  0.400873  0.613889  1
  Zr  Zr33  1  0.008865  0.143370  0.709105  1
  Zr  Zr34  1  0.008865  0.467148  0.673366  1
  Zr  Zr35  1  0.008865  0.919552  0.679925  1
  Zr  Zr36  1  0.008865  0.240394  0.635870  1
  Zr  Zr37  1  0.508865  0.626057  0.649082  1
  Zr  Zr38  1  0.508865  0.318204  0.690924  1
  Zr  Zr39  1  0.508865  0.081291  0.658929  1
  Zr  Zr40  1  0.508865  0.767834  0.702252  1
  Ni  Ni41  1  0.008865  0.933506  0.358018  1
  Ni  Ni42  1  0.008865  0.254106  0.310797  1
  Ni  Ni43  1  0.350888  0.686664  0.344987  1
  Ni  Ni44  1  0.342606  1.001864  0.297066  1
  Ni  Ni45  1  0.343207  0.498006  0.326041  1
  Ni  Ni46  1  0.341243  0.799838  0.283435  1
  Ni  Ni47  1  0.674523  0.498006  0.326041  1
  Ni  Ni48  1  0.676486  0.799838  0.283435  1
  Ni  Ni49  1  0.666841  0.686664  0.344987  1
  Ni  Ni50  1  0.675124  1.001864  0.297066  1
  Ni  Ni51  1  0.754625  0.339984  0.297769  1
  Ni  Ni52  1  0.758786  0.014570  0.345774  1
  Ni  Ni53  1  0.263104  0.339984  0.297769  1
  Ni  Ni54  1  0.258944  0.014570  0.345774  1
  Ni  Ni55  1  0.508865  0.427294  0.285532  1
  Ni  Ni56  1  0.508865  0.092716  0.333706  1
  Ni  Ni57  1  0.843066  0.161852  0.275602  1
  Ni  Ni58  1  0.848432  0.843661  0.320738  1
  Ni  Ni59  1  0.843618  0.656633  0.309618  1
  Ni  Ni60  1  0.842699  0.340377  0.348314  1
  Ni  Ni61  1  0.174112  0.656633  0.309618  1
  Ni  Ni62  1  0.175030  0.340377  0.348314  1
  Ni  Ni63  1  0.174663  0.161852  0.275602  1
  Ni  Ni64  1  0.169298  0.843661  0.320738  1
  Ni  Ni65  1  0.213910  0.525044  0.277713  1
  Ni  Ni66  1  0.257932  0.174946  0.322045  1
  Ni  Ni67  1  0.803819  0.525044  0.277713  1
  Ni  Ni68  1  0.759798  0.174946  0.322045  1
  Ni  Ni69  1  0.008865  0.293014  0.448455  1
  Ni  Ni70  1  0.008865  0.612655  0.403840  1
  Ni  Ni71  1  0.344351  0.047668  0.434011  1
  Ni  Ni72  1  0.343881  0.366871  0.388303  1
  Ni  Ni73  1  0.344520  0.861534  0.418290  1
  Ni  Ni74  1  0.345232  0.182950  0.371137  1
  Ni  Ni75  1  0.673210  0.861534  0.418290  1
  Ni  Ni76  1  0.672498  0.182950  0.371137  1
  Ni  Ni77  1  0.673379  0.047668  0.434011  1
  Ni  Ni78  1  0.673849  0.366871  0.388303  1
  Ni  Ni79  1  0.758244  0.694166  0.392865  1
  Ni  Ni80  1  0.759647  0.373411  0.437349  1
  Ni  Ni81  1  0.259486  0.694166  0.392865  1
  Ni  Ni82  1  0.258083  0.373411  0.437349  1
  Ni  Ni83  1  0.508865  0.774734  0.381840  1
  Ni  Ni84  1  0.508865  0.452368  0.426245  1
  Ni  Ni85  1  0.843028  0.526766  0.365948  1
  Ni  Ni86  1  0.843468  0.207757  0.410799  1
  Ni  Ni87  1  0.844207  0.022522  0.394767  1
  Ni  Ni88  1  0.844678  0.699532  0.441212  1
  Ni  Ni89  1  0.173522  0.022522  0.394767  1
  Ni  Ni90  1  0.173052  0.699532  0.441212  1
  Ni  Ni91  1  0.174701  0.526766  0.365948  1
  Ni  Ni92  1  0.174262  0.207757  0.410799  1
  Ni  Ni93  1  0.260503  0.855128  0.369566  1
  Ni  Ni94  1  0.258815  0.533026  0.414972  1
  Ni  Ni95  1  0.757227  0.855128  0.369566  1
  Ni  Ni96  1  0.758915  0.533026  0.414972  1
  Ni  Ni97  1  0.008865  0.654387  0.540110  1
  Ni  Ni98  1  0.008865  0.974023  0.494173  1
  Ni  Ni99  1  0.344295  0.408370  0.525167  1
  Ni  Ni100  1  0.344474  0.726567  0.480123  1
  Ni  Ni101  1  0.344319  0.221035  0.508583  1
  Ni  Ni102  1  0.344232  0.539182  0.463782  1
  Ni  Ni103  1  0.673411  0.221035  0.508583  1
  Ni  Ni104  1  0.673497  0.539182  0.463782  1
  Ni  Ni105  1  0.673434  0.408370  0.525167  1
  Ni  Ni106  1  0.673256  0.726567  0.480123  1
  Ni  Ni107  1  0.759150  0.054038  0.482681  1
  Ni  Ni108  1  0.758377  0.733994  0.528723  1
  Ni  Ni109  1  0.258580  0.054038  0.482681  1
  Ni  Ni110  1  0.259353  0.733994  0.528723  1
  Ni  Ni111  1  0.508865  0.133921  0.471242  1
  Ni  Ni112  1  0.508865  0.813962  0.517197  1
  Ni  Ni113  1  0.844554  0.886828  0.457225  1
  Ni  Ni114  1  0.844440  0.567163  0.502742  1
  Ni  Ni115  1  0.844447  0.379914  0.486143  1
  Ni  Ni116  1  0.844605  0.061411  0.531218  1
  Ni  Ni117  1  0.173283  0.379914  0.486143  1
  Ni  Ni118  1  0.173125  0.061411  0.531218  1
  Ni  Ni119  1  0.173176  0.886828  0.457225  1
  Ni  Ni120  1  0.173290  0.567163  0.502742  1
  Ni  Ni121  1  0.259385  0.213809  0.459836  1
  Ni  Ni122  1  0.258823  0.893965  0.505691  1
  Ni  Ni123  1  0.758344  0.213809  0.459836  1
  Ni  Ni124  1  0.758907  0.893965  0.505691  1
  Ni  Ni125  1  0.008865  0.013634  0.629258  1
  Ni  Ni126  1  0.008865  0.335629  0.585157  1
  Ni  Ni127  1  0.345428  0.765490  0.616838  1
  Ni  Ni128  1  0.344638  0.088458  0.570062  1
  Ni  Ni129  1  0.343023  0.580460  0.600621  1
  Ni  Ni130  1  0.344855  0.901196  0.554149  1
  Ni  Ni131  1  0.674707  0.580460  0.600621  1
  Ni  Ni132  1  0.672874  0.901196  0.554149  1
  Ni  Ni133  1  0.672302  0.765490  0.616838  1
  Ni  Ni134  1  0.673092  0.088458  0.570062  1
  Ni  Ni135  1  0.758284  0.414695  0.573973  1
  Ni  Ni136  1  0.757381  0.093535  0.618610  1
  Ni  Ni137  1  0.259446  0.414695  0.573973  1
  Ni  Ni138  1  0.260348  0.093535  0.618610  1
  Ni  Ni139  1  0.508865  0.495550  0.562841  1
  Ni  Ni140  1  0.508865  0.174879  0.607070  1
  Ni  Ni141  1  0.844291  0.248867  0.547552  1
  Ni  Ni142  1  0.844065  0.926463  0.592994  1
  Ni  Ni143  1  0.843867  0.740276  0.577408  1
  Ni  Ni144  1  0.845115  0.420719  0.623329  1
  Ni  Ni145  1  0.173863  0.740276  0.577408  1
  Ni  Ni146  1  0.172615  0.420719  0.623329  1
  Ni  Ni147  1  0.173439  0.248867  0.547552  1
  Ni  Ni148  1  0.173664  0.926463  0.592994  1
  Ni  Ni149  1  0.257970  0.574263  0.551526  1
  Ni  Ni150  1  0.258787  0.254873  0.596311  1
  Ni  Ni151  1  0.759760  0.574263  0.551526  1
  Ni  Ni152  1  0.758943  0.254873  0.596311  1
  Ni  Ni153  1  0.008865  0.336863  0.723096  1
  Ni  Ni154  1  0.008865  0.693376  0.677261  1
  Ni  Ni155  1  0.346373  0.145521  0.704888  1
  Ni  Ni156  1  0.342350  0.449633  0.662824  1
  Ni  Ni157  1  0.336002  0.950297  0.690941  1
  Ni  Ni158  1  0.346859  0.261407  0.644717  1
  Ni  Ni159  1  0.681728  0.950297  0.690941  1
  Ni  Ni160  1  0.670871  0.261407  0.644717  1
  Ni  Ni161  1  0.671356  0.145521  0.704888  1
  Ni  Ni162  1  0.675380  0.449633  0.662824  1
  Ni  Ni163  1  0.758997  0.772710  0.665522  1
  Ni  Ni164  1  0.767119  0.436485  0.711415  1
  Ni  Ni165  1  0.258733  0.772710  0.665522  1
  Ni  Ni166  1  0.250611  0.436485  0.711415  1
  Ni  Ni167  1  0.508865  0.856708  0.654435  1
  Ni  Ni168  1  0.508865  0.531583  0.701492  1
  Ni  Ni169  1  0.844848  0.603962  0.640758  1
  Ni  Ni170  1  0.845188  0.288188  0.682619  1
  Ni  Ni171  1  0.843351  0.101946  0.666155  1
  Ni  Ni172  1  0.843363  0.790627  0.712189  1
  Ni  Ni173  1  0.174378  0.101946  0.666155  1
  Ni  Ni174  1  0.174367  0.790627  0.712189  1
  Ni  Ni175  1  0.172882  0.603962  0.640758  1
  Ni  Ni176  1  0.172542  0.288188  0.682619  1
  Ni  Ni177  1  0.259239  0.932776  0.641801  1
  Ni  Ni178  1  0.261339  0.613308  0.690601  1
  Ni  Ni179  1  0.758491  0.932776  0.641801  1
  Ni  Ni180  1  0.756391  0.613308  0.690601  1
