# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.09740291
_cell_length_b   11.09585659
_cell_length_c   47.75901752
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   84.26082952
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni252
_cell_volume   5851.33779459
_cell_formula_units_Z   252
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  0.927512  0.261086  0.299274  1
  Ni  Ni2  1  0.260845  0.927753  0.299274  1
  Ni  Ni3  1  0.229559  0.229804  0.322037  1
  Ni  Ni4  1  0.594178  0.594420  0.299274  1
  Ni  Ni5  1  0.562892  0.896471  0.322037  1
  Ni  Ni6  1  0.627134  0.294063  0.278110  1
  Ni  Ni7  1  0.896226  0.563137  0.322037  1
  Ni  Ni8  1  0.960467  0.960730  0.278110  1
  Ni  Ni9  1  0.293800  0.627397  0.278110  1
  Ni  Ni10  1  0.062892  0.396471  0.322037  1
  Ni  Ni11  1  0.396226  0.063137  0.322037  1
  Ni  Ni12  1  0.460467  0.460730  0.278110  1
  Ni  Ni13  1  0.729559  0.729804  0.322037  1
  Ni  Ni14  1  0.793800  0.127397  0.278110  1
  Ni  Ni15  1  0.760845  0.427753  0.299274  1
  Ni  Ni16  1  0.127134  0.794063  0.278110  1
  Ni  Ni17  1  0.094178  0.094420  0.299274  1
  Ni  Ni18  1  0.427512  0.761086  0.299274  1
  Ni  Ni19  1  0.960467  0.460730  0.278110  1
  Ni  Ni20  1  0.293800  0.127397  0.278110  1
  Ni  Ni21  1  0.260845  0.427753  0.299274  1
  Ni  Ni22  1  0.627134  0.794063  0.278110  1
  Ni  Ni23  1  0.594178  0.094420  0.299274  1
  Ni  Ni24  1  0.562892  0.396471  0.322037  1
  Ni  Ni25  1  0.927512  0.761086  0.299274  1
  Ni  Ni26  1  0.896226  0.063137  0.322037  1
  Ni  Ni27  1  0.229559  0.729804  0.322037  1
  Ni  Ni28  1  0.127134  0.294063  0.278110  1
  Ni  Ni29  1  0.460467  0.960730  0.278110  1
  Ni  Ni30  1  0.427512  0.261086  0.299274  1
  Ni  Ni31  1  0.793800  0.627397  0.278110  1
  Ni  Ni32  1  0.760845  0.927753  0.299274  1
  Ni  Ni33  1  0.729559  0.229804  0.322037  1
  Ni  Ni34  1  0.094178  0.594420  0.299274  1
  Ni  Ni35  1  0.062892  0.896471  0.322037  1
  Ni  Ni36  1  0.396226  0.563137  0.322037  1
  Ni  Ni37  1  0.835416  0.168983  0.366268  1
  Ni  Ni38  1  0.168749  0.835649  0.366268  1
  Ni  Ni39  1  0.138194  0.138421  0.388311  1
  Ni  Ni40  1  0.502083  0.502316  0.366268  1
  Ni  Ni41  1  0.471527  0.805088  0.388311  1
  Ni  Ni42  1  0.532291  0.199194  0.343630  1
  Ni  Ni43  1  0.804860  0.471754  0.388311  1
  Ni  Ni44  1  0.865624  0.865860  0.343630  1
  Ni  Ni45  1  0.198957  0.532527  0.343630  1
  Ni  Ni46  1  0.971527  0.305088  0.388311  1
  Ni  Ni47  1  0.304860  0.971754  0.388311  1
  Ni  Ni48  1  0.365624  0.365860  0.343630  1
  Ni  Ni49  1  0.638194  0.638421  0.388311  1
  Ni  Ni50  1  0.698957  0.032527  0.343630  1
  Ni  Ni51  1  0.668749  0.335649  0.366268  1
  Ni  Ni52  1  0.032291  0.699194  0.343630  1
  Ni  Ni53  1  0.002083  0.002316  0.366268  1
  Ni  Ni54  1  0.335416  0.668983  0.366268  1
  Ni  Ni55  1  0.865624  0.365860  0.343630  1
  Ni  Ni56  1  0.198957  0.032527  0.343630  1
  Ni  Ni57  1  0.168749  0.335649  0.366268  1
  Ni  Ni58  1  0.532291  0.699194  0.343630  1
  Ni  Ni59  1  0.502083  0.002316  0.366268  1
  Ni  Ni60  1  0.471527  0.305088  0.388311  1
  Ni  Ni61  1  0.835416  0.668983  0.366268  1
  Ni  Ni62  1  0.804860  0.971754  0.388311  1
  Ni  Ni63  1  0.138194  0.638421  0.388311  1
  Ni  Ni64  1  0.032291  0.199194  0.343630  1
  Ni  Ni65  1  0.365624  0.865860  0.343630  1
  Ni  Ni66  1  0.335416  0.168983  0.366268  1
  Ni  Ni67  1  0.698957  0.532527  0.343630  1
  Ni  Ni68  1  0.668749  0.835649  0.366268  1
  Ni  Ni69  1  0.638194  0.138421  0.388311  1
  Ni  Ni70  1  0.002083  0.502316  0.366268  1
  Ni  Ni71  1  0.971527  0.805088  0.388311  1
  Ni  Ni72  1  0.304860  0.471754  0.388311  1
  Ni  Ni73  1  0.743968  0.077519  0.432907  1
  Ni  Ni74  1  0.077301  0.744185  0.432907  1
  Ni  Ni75  1  0.046872  0.047085  0.455220  1
  Ni  Ni76  1  0.410635  0.410852  0.432907  1
  Ni  Ni77  1  0.380206  0.713752  0.455220  1
  Ni  Ni78  1  0.441120  0.108009  0.410721  1
  Ni  Ni79  1  0.713539  0.380418  0.455220  1
  Ni  Ni80  1  0.774453  0.774676  0.410721  1
  Ni  Ni81  1  0.107786  0.441343  0.410721  1
  Ni  Ni82  1  0.880206  0.213752  0.455220  1
  Ni  Ni83  1  0.213539  0.880418  0.455220  1
  Ni  Ni84  1  0.274453  0.274676  0.410721  1
  Ni  Ni85  1  0.546872  0.547085  0.455220  1
  Ni  Ni86  1  0.607786  0.941343  0.410721  1
  Ni  Ni87  1  0.577301  0.244185  0.432907  1
  Ni  Ni88  1  0.941120  0.608009  0.410721  1
  Ni  Ni89  1  0.910635  0.910852  0.432907  1
  Ni  Ni90  1  0.243968  0.577519  0.432907  1
  Ni  Ni91  1  0.774453  0.274676  0.410721  1
  Ni  Ni92  1  0.107786  0.941343  0.410721  1
  Ni  Ni93  1  0.077301  0.244185  0.432907  1
  Ni  Ni94  1  0.441120  0.608009  0.410721  1
  Ni  Ni95  1  0.410635  0.910852  0.432907  1
  Ni  Ni96  1  0.380206  0.213752  0.455220  1
  Ni  Ni97  1  0.743968  0.577519  0.432907  1
  Ni  Ni98  1  0.713539  0.880418  0.455220  1
  Ni  Ni99  1  0.046872  0.547085  0.455220  1
  Ni  Ni100  1  0.941120  0.108009  0.410721  1
  Ni  Ni101  1  0.274453  0.774676  0.410721  1
  Ni  Ni102  1  0.243968  0.077519  0.432907  1
  Ni  Ni103  1  0.607786  0.441343  0.410721  1
  Ni  Ni104  1  0.577301  0.744185  0.432907  1
  Ni  Ni105  1  0.546872  0.047085  0.455220  1
  Ni  Ni106  1  0.910635  0.410852  0.432907  1
  Ni  Ni107  1  0.880206  0.713752  0.455220  1
  Ni  Ni108  1  0.213539  0.380418  0.455220  1
  Ni  Ni109  1  0.652638  0.986174  0.499737  1
  Ni  Ni110  1  0.985972  0.652841  0.499737  1
  Ni  Ni111  1  0.955527  0.955725  0.522011  1
  Ni  Ni112  1  0.319305  0.319508  0.499737  1
  Ni  Ni113  1  0.288861  0.622391  0.522011  1
  Ni  Ni114  1  0.349749  0.016624  0.477463  1
  Ni  Ni115  1  0.622194  0.289058  0.522011  1
  Ni  Ni116  1  0.683083  0.683290  0.477463  1
  Ni  Ni117  1  0.016416  0.349957  0.477463  1
  Ni  Ni118  1  0.788861  0.122391  0.522011  1
  Ni  Ni119  1  0.122194  0.789058  0.522011  1
  Ni  Ni120  1  0.183083  0.183290  0.477463  1
  Ni  Ni121  1  0.455527  0.455725  0.522011  1
  Ni  Ni122  1  0.516416  0.849957  0.477463  1
  Ni  Ni123  1  0.485972  0.152841  0.499737  1
  Ni  Ni124  1  0.849749  0.516624  0.477463  1
  Ni  Ni125  1  0.819305  0.819508  0.499737  1
  Ni  Ni126  1  0.152638  0.486174  0.499737  1
  Ni  Ni127  1  0.683083  0.183290  0.477463  1
  Ni  Ni128  1  0.016416  0.849957  0.477463  1
  Ni  Ni129  1  0.985972  0.152841  0.499737  1
  Ni  Ni130  1  0.349749  0.516624  0.477463  1
  Ni  Ni131  1  0.319305  0.819508  0.499737  1
  Ni  Ni132  1  0.288861  0.122391  0.522011  1
  Ni  Ni133  1  0.652638  0.486174  0.499737  1
  Ni  Ni134  1  0.622194  0.789058  0.522011  1
  Ni  Ni135  1  0.955527  0.455725  0.522011  1
  Ni  Ni136  1  0.849749  0.016624  0.477463  1
  Ni  Ni137  1  0.183083  0.683290  0.477463  1
  Ni  Ni138  1  0.152638  0.986174  0.499737  1
  Ni  Ni139  1  0.516416  0.349957  0.477463  1
  Ni  Ni140  1  0.485972  0.652841  0.499737  1
  Ni  Ni141  1  0.455527  0.955725  0.522011  1
  Ni  Ni142  1  0.819305  0.319508  0.499737  1
  Ni  Ni143  1  0.788861  0.622391  0.522011  1
  Ni  Ni144  1  0.122194  0.289058  0.522011  1
  Ni  Ni145  1  0.561309  0.894830  0.566567  1
  Ni  Ni146  1  0.894642  0.561496  0.566567  1
  Ni  Ni147  1  0.864157  0.864339  0.588753  1
  Ni  Ni148  1  0.227976  0.228163  0.566567  1
  Ni  Ni149  1  0.197490  0.531006  0.588753  1
  Ni  Ni150  1  0.258404  0.925263  0.544254  1
  Ni  Ni151  1  0.530824  0.197673  0.588753  1
  Ni  Ni152  1  0.591738  0.591930  0.544254  1
  Ni  Ni153  1  0.925071  0.258597  0.544254  1
  Ni  Ni154  1  0.697490  0.031006  0.588753  1
  Ni  Ni155  1  0.030824  0.697673  0.588753  1
  Ni  Ni156  1  0.091738  0.091930  0.544254  1
  Ni  Ni157  1  0.364157  0.364339  0.588753  1
  Ni  Ni158  1  0.425071  0.758597  0.544254  1
  Ni  Ni159  1  0.394642  0.061496  0.566567  1
  Ni  Ni160  1  0.758404  0.425263  0.544254  1
  Ni  Ni161  1  0.727976  0.728163  0.566567  1
  Ni  Ni162  1  0.061309  0.394830  0.566567  1
  Ni  Ni163  1  0.591738  0.091930  0.544254  1
  Ni  Ni164  1  0.925071  0.758597  0.544254  1
  Ni  Ni165  1  0.894642  0.061496  0.566567  1
  Ni  Ni166  1  0.258404  0.425263  0.544254  1
  Ni  Ni167  1  0.227976  0.728163  0.566567  1
  Ni  Ni168  1  0.197490  0.031006  0.588753  1
  Ni  Ni169  1  0.561309  0.394830  0.566567  1
  Ni  Ni170  1  0.530824  0.697673  0.588753  1
  Ni  Ni171  1  0.864157  0.364339  0.588753  1
  Ni  Ni172  1  0.758404  0.925263  0.544254  1
  Ni  Ni173  1  0.091738  0.591930  0.544254  1
  Ni  Ni174  1  0.061309  0.894830  0.566567  1
  Ni  Ni175  1  0.425071  0.258597  0.544254  1
  Ni  Ni176  1  0.394642  0.561496  0.566567  1
  Ni  Ni177  1  0.364157  0.864339  0.588753  1
  Ni  Ni178  1  0.727976  0.228163  0.566567  1
  Ni  Ni179  1  0.697490  0.531006  0.588753  1
  Ni  Ni180  1  0.030824  0.197673  0.588753  1
  Ni  Ni181  1  0.469861  0.803366  0.633206  1
  Ni  Ni182  1  0.803194  0.470032  0.633206  1
  Ni  Ni183  1  0.772986  0.773155  0.655844  1
  Ni  Ni184  1  0.136527  0.136699  0.633206  1
  Ni  Ni185  1  0.106320  0.439821  0.655844  1
  Ni  Ni186  1  0.167083  0.833927  0.611164  1
  Ni  Ni187  1  0.439653  0.106488  0.655844  1
  Ni  Ni188  1  0.500417  0.500594  0.611164  1
  Ni  Ni189  1  0.833750  0.167261  0.611164  1
  Ni  Ni190  1  0.606320  0.939821  0.655844  1
  Ni  Ni191  1  0.939653  0.606488  0.655844  1
  Ni  Ni192  1  1.000417  1.000594  0.611164  1
  Ni  Ni193  1  0.272986  0.273155  0.655844  1
  Ni  Ni194  1  0.333750  0.667261  0.611164  1
  Ni  Ni195  1  0.303194  0.970032  0.633206  1
  Ni  Ni196  1  0.667083  0.333927  0.611164  1
  Ni  Ni197  1  0.636527  0.636699  0.633206  1
  Ni  Ni198  1  0.969861  0.303366  0.633206  1
  Ni  Ni199  1  0.500417  1.000594  0.611164  1
  Ni  Ni200  1  0.833750  0.667261  0.611164  1
  Ni  Ni201  1  0.803194  0.970032  0.633206  1
  Ni  Ni202  1  0.167083  0.333927  0.611164  1
  Ni  Ni203  1  0.136527  0.636699  0.633206  1
  Ni  Ni204  1  0.106320  0.939821  0.655844  1
  Ni  Ni205  1  0.469861  0.303366  0.633206  1
  Ni  Ni206  1  0.439653  0.606488  0.655844  1
  Ni  Ni207  1  0.772986  0.273155  0.655844  1
  Ni  Ni208  1  0.667083  0.833927  0.611164  1
  Ni  Ni209  1  1.000417  0.500594  0.611164  1
  Ni  Ni210  1  0.969861  0.803366  0.633206  1
  Ni  Ni211  1  0.333750  0.167261  0.611164  1
  Ni  Ni212  1  0.303194  0.470032  0.633206  1
  Ni  Ni213  1  0.272986  0.773155  0.655844  1
  Ni  Ni214  1  0.636527  0.136699  0.633206  1
  Ni  Ni215  1  0.606320  0.439821  0.655844  1
  Ni  Ni216  1  0.939653  0.106488  0.655844  1
  Ni  Ni217  1  0.377765  0.711262  0.700200  1
  Ni  Ni218  1  0.711099  0.377929  0.700200  1
  Ni  Ni219  1  0.678143  0.678285  0.721364  1
  Ni  Ni220  1  0.044432  0.044596  0.700200  1
  Ni  Ni221  1  0.011476  0.344952  0.721364  1
  Ni  Ni222  1  0.075718  0.742544  0.677437  1
  Ni  Ni223  1  0.344810  0.011618  0.721364  1
  Ni  Ni224  1  0.409051  0.409211  0.677437  1
  Ni  Ni225  1  0.742384  0.075878  0.677437  1
  Ni  Ni226  1  0.511476  0.844952  0.721364  1
  Ni  Ni227  1  0.844810  0.511618  0.721364  1
  Ni  Ni228  1  0.909051  0.909211  0.677437  1
  Ni  Ni229  1  0.178143  0.178285  0.721364  1
  Ni  Ni230  1  0.242384  0.575878  0.677437  1
  Ni  Ni231  1  0.211099  0.877929  0.700200  1
  Ni  Ni232  1  0.575718  0.242544  0.677437  1
  Ni  Ni233  1  0.544432  0.544596  0.700200  1
  Ni  Ni234  1  0.877765  0.211262  0.700200  1
  Ni  Ni235  1  0.409051  0.909211  0.677437  1
  Ni  Ni236  1  0.742384  0.575878  0.677437  1
  Ni  Ni237  1  0.711099  0.877929  0.700200  1
  Ni  Ni238  1  0.075718  0.242544  0.677437  1
  Ni  Ni239  1  0.044432  0.544596  0.700200  1
  Ni  Ni240  1  0.011476  0.844952  0.721364  1
  Ni  Ni241  1  0.377765  0.211262  0.700200  1
  Ni  Ni242  1  0.344810  0.511618  0.721364  1
  Ni  Ni243  1  0.678143  0.178285  0.721364  1
  Ni  Ni244  1  0.575718  0.742544  0.677437  1
  Ni  Ni245  1  0.909051  0.409211  0.677437  1
  Ni  Ni246  1  0.877765  0.711262  0.700200  1
  Ni  Ni247  1  0.242384  0.075878  0.677437  1
  Ni  Ni248  1  0.211099  0.377929  0.700200  1
  Ni  Ni249  1  0.178143  0.678285  0.721364  1
  Ni  Ni250  1  0.544432  0.044596  0.700200  1
  Ni  Ni251  1  0.511476  0.344952  0.721364  1
  Ni  Ni252  1  0.844810  0.011618  0.721364  1
