# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.81995839
_cell_length_b   9.63742286
_cell_length_c   45.99852952
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   65.55302517
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni180
_cell_volume   4366.52856153
_cell_formula_units_Z   180
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
  Ni  Ni1  1  0.148081  0.306769  0.302760  1
  Ni  Ni2  1  0.536485  0.326942  0.293184  1
  Ni  Ni3  1  0.921301  0.348805  0.283862  1
  Ni  Ni4  1  0.148081  0.806769  0.302760  1
  Ni  Ni5  1  0.536485  0.826942  0.293184  1
  Ni  Ni6  1  0.921301  0.848805  0.283862  1
  Ni  Ni7  1  0.362686  0.093369  0.286205  1
  Ni  Ni8  1  0.749270  0.113102  0.276278  1
  Ni  Ni9  1  0.972768  0.074500  0.294807  1
  Ni  Ni10  1  0.362686  0.593369  0.286205  1
  Ni  Ni11  1  0.749270  0.613102  0.276278  1
  Ni  Ni12  1  0.972768  0.574500  0.294807  1
  Ni  Ni13  1  0.987213  0.249805  0.332997  1
  Ni  Ni14  1  0.374562  0.269902  0.322662  1
  Ni  Ni15  1  0.761412  0.289200  0.312903  1
  Ni  Ni16  1  0.987213  0.749805  0.332997  1
  Ni  Ni17  1  0.374562  0.769902  0.322662  1
  Ni  Ni18  1  0.761412  0.789200  0.312903  1
  Ni  Ni19  1  0.198974  0.034324  0.314189  1
  Ni  Ni20  1  0.587743  0.052866  0.304538  1
  Ni  Ni21  1  0.811764  0.016447  0.325035  1
  Ni  Ni22  1  0.198974  0.534324  0.314189  1
  Ni  Ni23  1  0.587743  0.552866  0.304538  1
  Ni  Ni24  1  0.811764  0.516447  0.325035  1
  Ni  Ni25  1  0.823943  0.194153  0.363161  1
  Ni  Ni26  1  0.211844  0.212035  0.352693  1
  Ni  Ni27  1  0.599286  0.231241  0.342793  1
  Ni  Ni28  1  0.823943  0.694153  0.363161  1
  Ni  Ni29  1  0.211844  0.712035  0.352693  1
  Ni  Ni30  1  0.599286  0.731241  0.342793  1
  Ni  Ni31  1  0.035633  0.977763  0.344484  1
  Ni  Ni32  1  0.423722  0.997381  0.334890  1
  Ni  Ni33  1  0.647502  0.959617  0.354764  1
  Ni  Ni34  1  0.035633  0.477763  0.344484  1
  Ni  Ni35  1  0.423722  0.497381  0.334890  1
  Ni  Ni36  1  0.647502  0.459617  0.354764  1
  Ni  Ni37  1  0.660900  0.136923  0.393493  1
  Ni  Ni38  1  0.048888  0.155321  0.383384  1
  Ni  Ni39  1  0.436036  0.175412  0.373126  1
  Ni  Ni40  1  0.660900  0.636923  0.393493  1
  Ni  Ni41  1  0.048888  0.655321  0.383384  1
  Ni  Ni42  1  0.436036  0.675412  0.373126  1
  Ni  Ni43  1  0.872415  0.921409  0.375123  1
  Ni  Ni44  1  0.259591  0.940593  0.364600  1
  Ni  Ni45  1  0.484456  0.902542  0.385129  1
  Ni  Ni46  1  0.872415  0.421409  0.375123  1
  Ni  Ni47  1  0.259591  0.440593  0.364600  1
  Ni  Ni48  1  0.484456  0.402542  0.385129  1
  Ni  Ni49  1  0.497667  0.080179  0.423851  1
  Ni  Ni50  1  0.885626  0.098888  0.413789  1
  Ni  Ni51  1  0.273273  0.117809  0.403513  1
  Ni  Ni52  1  0.497667  0.580179  0.423851  1
  Ni  Ni53  1  0.885626  0.598888  0.413789  1
  Ni  Ni54  1  0.273273  0.617809  0.403513  1
  Ni  Ni55  1  0.708888  0.864757  0.405373  1
  Ni  Ni56  1  0.096911  0.883261  0.395099  1
  Ni  Ni57  1  0.321062  0.845878  0.415379  1
  Ni  Ni58  1  0.708888  0.364757  0.405373  1
  Ni  Ni59  1  0.096911  0.383261  0.395099  1
  Ni  Ni60  1  0.321062  0.345878  0.415379  1
  Ni  Ni61  1  0.334533  0.023200  0.454256  1
  Ni  Ni62  1  0.722306  0.042139  0.444161  1
  Ni  Ni63  1  0.110154  0.060841  0.434022  1
  Ni  Ni64  1  0.334533  0.523200  0.454256  1
  Ni  Ni65  1  0.722306  0.542139  0.444161  1
  Ni  Ni66  1  0.110154  0.560841  0.434022  1
  Ni  Ni67  1  0.545630  0.807926  0.435736  1
  Ni  Ni68  1  0.933589  0.826668  0.425631  1
  Ni  Ni69  1  0.157990  0.788835  0.445810  1
  Ni  Ni70  1  0.545630  0.307926  0.435736  1
  Ni  Ni71  1  0.933589  0.326668  0.425631  1
  Ni  Ni72  1  0.157990  0.288835  0.445810  1
  Ni  Ni73  1  0.171362  0.966263  0.484695  1
  Ni  Ni74  1  0.559002  0.985389  0.474539  1
  Ni  Ni75  1  0.946875  0.004158  0.464436  1
  Ni  Ni76  1  0.171362  0.466263  0.484695  1
  Ni  Ni77  1  0.559002  0.485389  0.474539  1
  Ni  Ni78  1  0.946875  0.504158  0.464436  1
  Ni  Ni79  1  0.382357  0.751147  0.466082  1
  Ni  Ni80  1  0.770185  0.770007  0.455994  1
  Ni  Ni81  1  0.994743  0.732038  0.476256  1
  Ni  Ni82  1  0.382357  0.251147  0.466082  1
  Ni  Ni83  1  0.770185  0.270007  0.455994  1
  Ni  Ni84  1  0.994743  0.232038  0.476256  1
  Ni  Ni85  1  0.008088  0.909489  0.515086  1
  Ni  Ni86  1  0.395781  0.928517  0.504954  1
  Ni  Ni87  1  0.783555  0.947423  0.494818  1
  Ni  Ni88  1  0.008088  0.409489  0.515086  1
  Ni  Ni89  1  0.395781  0.428517  0.504954  1
  Ni  Ni90  1  0.783555  0.447423  0.494818  1
  Ni  Ni91  1  0.219181  0.694225  0.496505  1
  Ni  Ni92  1  0.606874  0.713253  0.486373  1
  Ni  Ni93  1  0.831407  0.675319  0.506641  1
  Ni  Ni94  1  0.219181  0.194225  0.496505  1
  Ni  Ni95  1  0.606874  0.213253  0.486373  1
  Ni  Ni96  1  0.831407  0.175319  0.506641  1
  Ni  Ni97  1  0.844777  0.852735  0.545465  1
  Ni  Ni98  1  0.232605  0.871595  0.535376  1
  Ni  Ni99  1  0.620219  0.890705  0.525202  1
  Ni  Ni100  1  0.844777  0.352735  0.545465  1
  Ni  Ni101  1  0.232605  0.371595  0.535376  1
  Ni  Ni102  1  0.620219  0.390705  0.525202  1
  Ni  Ni103  1  0.055960  0.637353  0.526920  1
  Ni  Ni104  1  0.443600  0.656480  0.516764  1
  Ni  Ni105  1  0.668087  0.618584  0.537023  1
  Ni  Ni106  1  0.055960  0.137353  0.526920  1
  Ni  Ni107  1  0.443600  0.156480  0.516764  1
  Ni  Ni108  1  0.668087  0.118584  0.537023  1
  Ni  Ni109  1  0.681373  0.796074  0.575827  1
  Ni  Ni110  1  0.069332  0.814816  0.565723  1
  Ni  Ni111  1  0.456971  0.833907  0.555648  1
  Ni  Ni112  1  0.681373  0.296074  0.575827  1
  Ni  Ni113  1  0.069332  0.314816  0.565723  1
  Ni  Ni114  1  0.456971  0.333907  0.555648  1
  Ni  Ni115  1  0.892656  0.580604  0.557297  1
  Ni  Ni116  1  0.280429  0.599542  0.547203  1
  Ni  Ni117  1  0.504808  0.561901  0.567437  1
  Ni  Ni118  1  0.892656  0.080604  0.557297  1
  Ni  Ni119  1  0.280429  0.099542  0.547203  1
  Ni  Ni120  1  0.504808  0.061901  0.567437  1
  Ni  Ni121  1  0.518051  0.739481  0.606360  1
  Ni  Ni122  1  0.906074  0.757985  0.596086  1
  Ni  Ni123  1  0.293900  0.776864  0.586080  1
  Ni  Ni124  1  0.518051  0.239481  0.606360  1
  Ni  Ni125  1  0.906074  0.257985  0.596086  1
  Ni  Ni126  1  0.293900  0.276864  0.586080  1
  Ni  Ni127  1  0.729336  0.523855  0.587670  1
  Ni  Ni128  1  0.117295  0.542563  0.577608  1
  Ni  Ni129  1  0.341689  0.504933  0.597946  1
  Ni  Ni130  1  0.729336  0.023855  0.587670  1
  Ni  Ni131  1  0.117295  0.042563  0.577608  1
  Ni  Ni132  1  0.341689  0.004933  0.597946  1
  Ni  Ni133  1  0.355371  0.682149  0.636858  1
  Ni  Ni134  1  0.742547  0.701333  0.626336  1
  Ni  Ni135  1  0.130505  0.720200  0.616330  1
  Ni  Ni136  1  0.355371  0.182149  0.636858  1
  Ni  Ni137  1  0.742547  0.201333  0.626336  1
  Ni  Ni138  1  0.130505  0.220200  0.616330  1
  Ni  Ni139  1  0.566074  0.467422  0.618075  1
  Ni  Ni140  1  0.954062  0.485819  0.607966  1
  Ni  Ni141  1  0.178926  0.447330  0.628333  1
  Ni  Ni142  1  0.566074  0.967422  0.618075  1
  Ni  Ni143  1  0.954062  0.985819  0.607966  1
  Ni  Ni144  1  0.178926  0.947330  0.628333  1
  Ni  Ni145  1  0.191240  0.625361  0.666569  1
  Ni  Ni146  1  0.579329  0.644979  0.656975  1
  Ni  Ni147  1  0.967460  0.663125  0.646695  1
  Ni  Ni148  1  0.191240  0.125361  0.666569  1
  Ni  Ni149  1  0.579329  0.144979  0.656975  1
  Ni  Ni150  1  0.967460  0.163125  0.646695  1
  Ni  Ni151  1  0.403118  0.410707  0.648765  1
  Ni  Ni152  1  0.791019  0.428589  0.638298  1
  Ni  Ni153  1  0.015676  0.391502  0.658666  1
  Ni  Ni154  1  0.403118  0.910707  0.648765  1
  Ni  Ni155  1  0.791019  0.928589  0.638298  1
  Ni  Ni156  1  0.015676  0.891502  0.658666  1
  Ni  Ni157  1  0.027219  0.569876  0.696921  1
  Ni  Ni158  1  0.415988  0.588418  0.687269  1
  Ni  Ni159  1  0.803198  0.606295  0.676423  1
  Ni  Ni160  1  0.027219  0.069876  0.696921  1
  Ni  Ni161  1  0.415988  0.088418  0.687269  1
  Ni  Ni162  1  0.803198  0.106295  0.676423  1
  Ni  Ni163  1  0.240400  0.352840  0.678797  1
  Ni  Ni164  1  0.627749  0.372937  0.668462  1
  Ni  Ni165  1  0.853550  0.333542  0.688556  1
  Ni  Ni166  1  0.240400  0.852840  0.678797  1
  Ni  Ni167  1  0.627749  0.872937  0.668462  1
  Ni  Ni168  1  0.853550  0.833542  0.688556  1
  Ni  Ni169  1  0.865692  0.509640  0.725181  1
  Ni  Ni170  1  0.252276  0.529373  0.715254  1
  Ni  Ni171  1  0.642194  0.548243  0.706652  1
  Ni  Ni172  1  0.865692  0.009640  0.725181  1
  Ni  Ni173  1  0.252276  0.029373  0.715254  1
  Ni  Ni174  1  0.642194  0.048243  0.706652  1
  Ni  Ni175  1  0.078477  0.295800  0.708275  1
  Ni  Ni176  1  0.466881  0.315973  0.698698  1
  Ni  Ni177  1  0.693661  0.273937  0.717596  1
  Ni  Ni178  1  0.078477  0.795800  0.708275  1
  Ni  Ni179  1  0.466881  0.815973  0.698698  1
  Ni  Ni180  1  0.693661  0.773937  0.717596  1
