# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.96740608
_cell_length_b   11.06872796
_cell_length_c   48.57423609
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   102.92096638
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni108
_cell_volume   2603.12582434
_cell_formula_units_Z   108
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  0.022950  0.709349  0.282736  1
  Ni  Ni2  1  0.178211  0.019803  0.297872  1
  Ni  Ni3  1  0.337386  0.338277  0.315683  1
  Ni  Ni4  1  0.337386  0.838277  0.315683  1
  Ni  Ni5  1  0.022950  0.209349  0.282736  1
  Ni  Ni6  1  0.178211  0.519803  0.297872  1
  Ni  Ni7  1  0.837386  0.838277  0.315683  1
  Ni  Ni8  1  0.522950  0.209349  0.282736  1
  Ni  Ni9  1  0.678211  0.519803  0.297872  1
  Ni  Ni10  1  0.522950  0.709349  0.282736  1
  Ni  Ni11  1  0.678211  0.019803  0.297872  1
  Ni  Ni12  1  0.837386  0.338277  0.315683  1
  Ni  Ni13  1  0.494170  0.651955  0.331986  1
  Ni  Ni14  1  0.652899  0.969483  0.348774  1
  Ni  Ni15  1  0.810294  0.284392  0.365275  1
  Ni  Ni16  1  0.810294  0.784392  0.365275  1
  Ni  Ni17  1  0.494170  0.151955  0.331986  1
  Ni  Ni18  1  0.652899  0.469483  0.348774  1
  Ni  Ni19  1  0.310294  0.784392  0.365275  1
  Ni  Ni20  1  0.994170  0.151955  0.331986  1
  Ni  Ni21  1  0.152899  0.469483  0.348774  1
  Ni  Ni22  1  0.994170  0.651955  0.331986  1
  Ni  Ni23  1  0.152899  0.969483  0.348774  1
  Ni  Ni24  1  0.310294  0.284392  0.365275  1
  Ni  Ni25  1  0.968256  0.600394  0.382082  1
  Ni  Ni26  1  0.125904  0.915793  0.398686  1
  Ni  Ni27  1  0.283775  0.231620  0.415383  1
  Ni  Ni28  1  0.283775  0.731620  0.415383  1
  Ni  Ni29  1  0.968256  0.100394  0.382082  1
  Ni  Ni30  1  0.125904  0.415793  0.398686  1
  Ni  Ni31  1  0.783775  0.731620  0.415383  1
  Ni  Ni32  1  0.468256  0.100394  0.382082  1
  Ni  Ni33  1  0.625904  0.415793  0.398686  1
  Ni  Ni34  1  0.468256  0.600394  0.382082  1
  Ni  Ni35  1  0.625904  0.915793  0.398686  1
  Ni  Ni36  1  0.783775  0.231620  0.415383  1
  Ni  Ni37  1  0.441509  0.547187  0.432051  1
  Ni  Ni38  1  0.599312  0.862882  0.448728  1
  Ni  Ni39  1  0.757085  0.178523  0.465399  1
  Ni  Ni40  1  0.757085  0.678523  0.465399  1
  Ni  Ni41  1  0.441509  0.047187  0.432051  1
  Ni  Ni42  1  0.599312  0.362882  0.448728  1
  Ni  Ni43  1  0.257085  0.678523  0.465399  1
  Ni  Ni44  1  0.941509  0.047187  0.432051  1
  Ni  Ni45  1  0.099312  0.362882  0.448728  1
  Ni  Ni46  1  0.941509  0.547187  0.432051  1
  Ni  Ni47  1  0.099312  0.862882  0.448728  1
  Ni  Ni48  1  0.257085  0.178523  0.465399  1
  Ni  Ni49  1  0.914871  0.494186  0.482075  1
  Ni  Ni50  1  0.072651  0.809840  0.498748  1
  Ni  Ni51  1  0.230432  0.125495  0.515421  1
  Ni  Ni52  1  0.230432  0.625495  0.515421  1
  Ni  Ni53  1  0.914871  0.994186  0.482075  1
  Ni  Ni54  1  0.072651  0.309840  0.498748  1
  Ni  Ni55  1  0.730432  0.625495  0.515421  1
  Ni  Ni56  1  0.414871  0.994186  0.482075  1
  Ni  Ni57  1  0.572651  0.309840  0.498748  1
  Ni  Ni58  1  0.414871  0.494186  0.482075  1
  Ni  Ni59  1  0.572651  0.809840  0.498748  1
  Ni  Ni60  1  0.730432  0.125495  0.515421  1
  Ni  Ni61  1  0.388218  0.441158  0.532097  1
  Ni  Ni62  1  0.545991  0.756799  0.548768  1
  Ni  Ni63  1  0.703794  0.072494  0.565445  1
  Ni  Ni64  1  0.703794  0.572494  0.565445  1
  Ni  Ni65  1  0.388218  0.941158  0.532097  1
  Ni  Ni66  1  0.545991  0.256799  0.548768  1
  Ni  Ni67  1  0.203794  0.572494  0.565445  1
  Ni  Ni68  1  0.888218  0.941158  0.532097  1
  Ni  Ni69  1  0.045991  0.256799  0.548768  1
  Ni  Ni70  1  0.888218  0.441158  0.532097  1
  Ni  Ni71  1  0.045991  0.756799  0.548768  1
  Ni  Ni72  1  0.203794  0.072494  0.565445  1
  Ni  Ni73  1  0.861528  0.388060  0.582113  1
  Ni  Ni74  1  0.019399  0.703888  0.598810  1
  Ni  Ni75  1  0.177047  0.019286  0.615414  1
  Ni  Ni76  1  0.177047  0.519286  0.615414  1
  Ni  Ni77  1  0.861528  0.888060  0.582113  1
  Ni  Ni78  1  0.019399  0.203888  0.598810  1
  Ni  Ni79  1  0.677047  0.519286  0.615414  1
  Ni  Ni80  1  0.361528  0.888060  0.582113  1
  Ni  Ni81  1  0.519399  0.203888  0.598810  1
  Ni  Ni82  1  0.361528  0.388060  0.582113  1
  Ni  Ni83  1  0.519399  0.703888  0.598810  1
  Ni  Ni84  1  0.677047  0.019286  0.615414  1
  Ni  Ni85  1  0.335009  0.335288  0.632221  1
  Ni  Ni86  1  0.492404  0.650197  0.648722  1
  Ni  Ni87  1  0.651133  0.967726  0.665510  1
  Ni  Ni88  1  0.651133  0.467726  0.665510  1
  Ni  Ni89  1  0.335009  0.835288  0.632221  1
  Ni  Ni90  1  0.492404  0.150197  0.648722  1
  Ni  Ni91  1  0.151133  0.467726  0.665510  1
  Ni  Ni92  1  0.835009  0.835288  0.632221  1
  Ni  Ni93  1  0.992404  0.150197  0.648722  1
  Ni  Ni94  1  0.835009  0.335288  0.632221  1
  Ni  Ni95  1  0.992404  0.650197  0.648722  1
  Ni  Ni96  1  0.151133  0.967726  0.665510  1
  Ni  Ni97  1  0.807917  0.281404  0.681813  1
  Ni  Ni98  1  0.967092  0.599877  0.699624  1
  Ni  Ni99  1  0.122353  0.910331  0.714760  1
  Ni  Ni100  1  0.122353  0.410331  0.714760  1
  Ni  Ni101  1  0.807917  0.781404  0.681813  1
  Ni  Ni102  1  0.967092  0.099877  0.699624  1
  Ni  Ni103  1  0.622353  0.410331  0.714760  1
  Ni  Ni104  1  0.307917  0.781404  0.681813  1
  Ni  Ni105  1  0.467092  0.099877  0.699624  1
  Ni  Ni106  1  0.307917  0.281404  0.681813  1
  Ni  Ni107  1  0.467092  0.599877  0.699624  1
  Ni  Ni108  1  0.622353  0.910331  0.714760  1
