# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.55486883
_cell_length_b   13.24464656
_cell_length_c   46.36895199
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   108.84845280
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni204
_cell_volume   4972.15785326
_cell_formula_units_Z   204
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  0.638133  0.697660  0.295931  1
  Ni  Ni2  1  0.138133  0.697660  0.295931  1
  Ni  Ni3  1  0.059240  0.039143  0.288316  1
  Ni  Ni4  1  0.486708  0.381345  0.281000  1
  Ni  Ni5  1  0.559240  0.039143  0.288316  1
  Ni  Ni6  1  0.986708  0.381345  0.281000  1
  Ni  Ni7  1  0.735331  0.539155  0.288316  1
  Ni  Ni8  1  0.235331  0.539155  0.288316  1
  Ni  Ni9  1  0.150033  0.881331  0.281001  1
  Ni  Ni10  1  0.314939  0.197666  0.295932  1
  Ni  Ni11  1  0.650033  0.881331  0.281001  1
  Ni  Ni12  1  0.814939  0.197666  0.295932  1
  Ni  Ni13  1  0.381904  0.679753  0.322647  1
  Ni  Ni14  1  0.881904  0.679753  0.322647  1
  Ni  Ni15  1  0.802145  0.019154  0.314481  1
  Ni  Ni16  1  0.222813  0.356769  0.305135  1
  Ni  Ni17  1  0.302145  0.019154  0.314481  1
  Ni  Ni18  1  0.722813  0.356769  0.305135  1
  Ni  Ni19  1  0.472420  0.519154  0.314481  1
  Ni  Ni20  1  0.972420  0.519154  0.314481  1
  Ni  Ni21  1  0.889355  0.856768  0.305137  1
  Ni  Ni22  1  0.053257  0.179750  0.322647  1
  Ni  Ni23  1  0.389355  0.856768  0.305137  1
  Ni  Ni24  1  0.553257  0.179750  0.322647  1
  Ni  Ni25  1  0.123465  0.659821  0.349233  1
  Ni  Ni26  1  0.623465  0.659821  0.349233  1
  Ni  Ni27  1  0.542654  0.998820  0.340609  1
  Ni  Ni28  1  0.963523  0.338838  0.332382  1
  Ni  Ni29  1  0.042654  0.998820  0.340609  1
  Ni  Ni30  1  0.463523  0.338838  0.332382  1
  Ni  Ni31  1  0.211573  0.498820  0.340609  1
  Ni  Ni32  1  0.711573  0.498820  0.340609  1
  Ni  Ni33  1  0.630718  0.838837  0.332383  1
  Ni  Ni34  1  0.791762  0.159820  0.349234  1
  Ni  Ni35  1  0.130718  0.838837  0.332383  1
  Ni  Ni36  1  0.291762  0.159820  0.349234  1
  Ni  Ni37  1  0.863859  0.640480  0.375499  1
  Ni  Ni38  1  0.363859  0.640480  0.375499  1
  Ni  Ni39  1  0.283646  0.980397  0.366992  1
  Ni  Ni40  1  0.704377  0.320044  0.358227  1
  Ni  Ni41  1  0.783646  0.980397  0.366992  1
  Ni  Ni42  1  0.204377  0.320044  0.358227  1
  Ni  Ni43  1  0.952156  0.480397  0.366992  1
  Ni  Ni44  1  0.452156  0.480397  0.366992  1
  Ni  Ni45  1  0.371070  0.820044  0.358229  1
  Ni  Ni46  1  0.532026  0.140480  0.375500  1
  Ni  Ni47  1  0.871070  0.820044  0.358229  1
  Ni  Ni48  1  0.032026  0.140480  0.375500  1
  Ni  Ni49  1  0.604337  0.621117  0.402016  1
  Ni  Ni50  1  0.104337  0.621117  0.402016  1
  Ni  Ni51  1  0.024026  0.960895  0.393310  1
  Ni  Ni52  1  0.444368  0.300478  0.384666  1
  Ni  Ni53  1  0.524026  0.960895  0.393310  1
  Ni  Ni54  1  0.944368  0.300478  0.384666  1
  Ni  Ni55  1  0.692272  0.460895  0.393310  1
  Ni  Ni56  1  0.192272  0.460895  0.393310  1
  Ni  Ni57  1  0.111512  0.800478  0.384667  1
  Ni  Ni58  1  0.272181  0.121116  0.402017  1
  Ni  Ni59  1  0.611512  0.800478  0.384667  1
  Ni  Ni60  1  0.772181  0.121116  0.402017  1
  Ni  Ni61  1  0.344730  0.601788  0.428361  1
  Ni  Ni62  1  0.844730  0.601788  0.428361  1
  Ni  Ni63  1  0.764433  0.941524  0.419670  1
  Ni  Ni64  1  0.184541  0.281195  0.410894  1
  Ni  Ni65  1  0.264433  0.941524  0.419670  1
  Ni  Ni66  1  0.684541  0.281195  0.410894  1
  Ni  Ni67  1  0.432491  0.441523  0.419670  1
  Ni  Ni68  1  0.932491  0.441523  0.419670  1
  Ni  Ni69  1  0.852053  0.781194  0.410895  1
  Ni  Ni70  1  0.012458  0.101788  0.428361  1
  Ni  Ni71  1  0.352053  0.781194  0.410895  1
  Ni  Ni72  1  0.512458  0.101788  0.428361  1
  Ni  Ni73  1  0.085053  0.582410  0.454757  1
  Ni  Ni74  1  0.585053  0.582410  0.454757  1
  Ni  Ni75  1  0.504777  0.922175  0.446006  1
  Ni  Ni76  1  0.924826  0.261906  0.437273  1
  Ni  Ni77  1  0.004777  0.922175  0.446006  1
  Ni  Ni78  1  0.424826  0.261906  0.437273  1
  Ni  Ni79  1  0.172796  0.422175  0.446006  1
  Ni  Ni80  1  0.672796  0.422175  0.446006  1
  Ni  Ni81  1  0.592477  0.761905  0.437274  1
  Ni  Ni82  1  0.752755  0.082410  0.454758  1
  Ni  Ni83  1  0.092477  0.761905  0.437274  1
  Ni  Ni84  1  0.252755  0.082410  0.454758  1
  Ni  Ni85  1  0.825377  0.563081  0.481114  1
  Ni  Ni86  1  0.325377  0.563081  0.481114  1
  Ni  Ni87  1  0.245139  0.902840  0.472365  1
  Ni  Ni88  1  0.665131  0.242580  0.463595  1
  Ni  Ni89  1  0.745139  0.902840  0.472365  1
  Ni  Ni90  1  0.165131  0.242580  0.463595  1
  Ni  Ni91  1  0.913097  0.402840  0.472365  1
  Ni  Ni92  1  0.413097  0.402840  0.472365  1
  Ni  Ni93  1  0.332844  0.742580  0.463596  1
  Ni  Ni94  1  0.493099  0.063080  0.481115  1
  Ni  Ni95  1  0.832844  0.742580  0.463596  1
  Ni  Ni96  1  0.993099  0.063080  0.481115  1
  Ni  Ni97  1  0.565707  0.543745  0.507473  1
  Ni  Ni98  1  0.065707  0.543745  0.507473  1
  Ni  Ni99  1  0.985473  0.883498  0.498714  1
  Ni  Ni100  1  0.405462  0.223252  0.489954  1
  Ni  Ni101  1  0.485473  0.883498  0.498714  1
  Ni  Ni102  1  0.905462  0.223252  0.489954  1
  Ni  Ni103  1  0.653419  0.383498  0.498714  1
  Ni  Ni104  1  0.153419  0.383498  0.498714  1
  Ni  Ni105  1  0.073184  0.723252  0.489955  1
  Ni  Ni106  1  0.233430  0.043744  0.507474  1
  Ni  Ni107  1  0.573184  0.723252  0.489955  1
  Ni  Ni108  1  0.733430  0.043744  0.507474  1
  Ni  Ni109  1  0.306047  0.524417  0.533832  1
  Ni  Ni110  1  0.806047  0.524417  0.533832  1
  Ni  Ni111  1  0.725795  0.864156  0.525063  1
  Ni  Ni112  1  0.145793  0.203916  0.516313  1
  Ni  Ni113  1  0.225795  0.864156  0.525063  1
  Ni  Ni114  1  0.645793  0.203916  0.516313  1
  Ni  Ni115  1  0.393753  0.364156  0.525063  1
  Ni  Ni116  1  0.893753  0.364156  0.525063  1
  Ni  Ni117  1  0.813515  0.703916  0.516314  1
  Ni  Ni118  1  0.973760  0.024416  0.533833  1
  Ni  Ni119  1  0.313515  0.703916  0.516314  1
  Ni  Ni120  1  0.473760  0.024416  0.533833  1
  Ni  Ni121  1  0.046414  0.505091  0.560154  1
  Ni  Ni122  1  0.546414  0.505091  0.560154  1
  Ni  Ni123  1  0.466095  0.844822  0.551422  1
  Ni  Ni124  1  0.886137  0.184587  0.542670  1
  Ni  Ni125  1  0.966095  0.844822  0.551422  1
  Ni  Ni126  1  0.386137  0.184587  0.542670  1
  Ni  Ni127  1  0.134115  0.344821  0.551422  1
  Ni  Ni128  1  0.634115  0.344821  0.551422  1
  Ni  Ni129  1  0.553839  0.684586  0.542670  1
  Ni  Ni130  1  0.714066  0.005091  0.560155  1
  Ni  Ni131  1  0.053839  0.684586  0.542670  1
  Ni  Ni132  1  0.214066  0.005091  0.560155  1
  Ni  Ni133  1  0.786839  0.485803  0.586533  1
  Ni  Ni134  1  0.286839  0.485803  0.586533  1
  Ni  Ni135  1  0.206400  0.825473  0.577758  1
  Ni  Ni136  1  0.626433  0.165208  0.569066  1
  Ni  Ni137  1  0.706400  0.825473  0.577758  1
  Ni  Ni138  1  0.126433  0.165208  0.569066  1
  Ni  Ni139  1  0.874459  0.325473  0.577758  1
  Ni  Ni140  1  0.374459  0.325473  0.577758  1
  Ni  Ni141  1  0.294162  0.665208  0.569067  1
  Ni  Ni142  1  0.454350  0.985802  0.586534  1
  Ni  Ni143  1  0.794162  0.665208  0.569067  1
  Ni  Ni144  1  0.954350  0.985802  0.586534  1
  Ni  Ni145  1  0.527380  0.466519  0.612760  1
  Ni  Ni146  1  0.027380  0.466519  0.612760  1
  Ni  Ni147  1  0.946620  0.806101  0.604118  1
  Ni  Ni148  1  0.366710  0.145880  0.595411  1
  Ni  Ni149  1  0.446620  0.806101  0.604118  1
  Ni  Ni150  1  0.866710  0.145880  0.595411  1
  Ni  Ni151  1  0.614866  0.306101  0.604117  1
  Ni  Ni152  1  0.114866  0.306101  0.604117  1
  Ni  Ni153  1  0.034555  0.645880  0.595412  1
  Ni  Ni154  1  0.194524  0.966518  0.612762  1
  Ni  Ni155  1  0.534555  0.645880  0.595412  1
  Ni  Ni156  1  0.694524  0.966518  0.612762  1
  Ni  Ni157  1  0.267822  0.446953  0.639199  1
  Ni  Ni158  1  0.767822  0.446953  0.639199  1
  Ni  Ni159  1  0.686736  0.786600  0.630435  1
  Ni  Ni160  1  0.106866  0.126516  0.621928  1
  Ni  Ni161  1  0.186736  0.786600  0.630435  1
  Ni  Ni162  1  0.606866  0.126516  0.621928  1
  Ni  Ni163  1  0.355245  0.286599  0.630435  1
  Ni  Ni164  1  0.855245  0.286599  0.630435  1
  Ni  Ni165  1  0.775033  0.626516  0.621929  1
  Ni  Ni166  1  0.934514  0.946952  0.639201  1
  Ni  Ni167  1  0.275033  0.626516  0.621929  1
  Ni  Ni168  1  0.434514  0.946952  0.639201  1
  Ni  Ni169  1  0.008173  0.428159  0.665045  1
  Ni  Ni170  1  0.508173  0.428159  0.665045  1
  Ni  Ni171  1  0.427319  0.768176  0.656819  1
  Ni  Ni172  1  0.847130  0.107177  0.648194  1
  Ni  Ni173  1  0.927319  0.768176  0.656819  1
  Ni  Ni174  1  0.347130  0.107177  0.648194  1
  Ni  Ni175  1  0.096237  0.268176  0.656819  1
  Ni  Ni176  1  0.596237  0.268176  0.656819  1
  Ni  Ni177  1  0.515427  0.607175  0.648194  1
  Ni  Ni178  1  0.675369  0.928158  0.665046  1
  Ni  Ni179  1  0.015427  0.607175  0.648194  1
  Ni  Ni180  1  0.175369  0.928158  0.665046  1
  Ni  Ni181  1  0.749537  0.410228  0.692290  1
  Ni  Ni182  1  0.249537  0.410228  0.692290  1
  Ni  Ni183  1  0.166472  0.747842  0.682947  1
  Ni  Ni184  1  0.585635  0.087246  0.674781  1
  Ni  Ni185  1  0.666472  0.747842  0.682947  1
  Ni  Ni186  1  0.085635  0.087246  0.674781  1
  Ni  Ni187  1  0.836747  0.247842  0.682947  1
  Ni  Ni188  1  0.336747  0.247842  0.682947  1
  Ni  Ni189  1  0.256988  0.587243  0.674781  1
  Ni  Ni190  1  0.416079  0.910227  0.692293  1
  Ni  Ni191  1  0.756988  0.587243  0.674781  1
  Ni  Ni192  1  0.916079  0.910227  0.692293  1
  Ni  Ni193  1  0.488859  0.385665  0.716427  1
  Ni  Ni194  1  0.988859  0.385665  0.716427  1
  Ni  Ni195  1  0.903560  0.727841  0.709112  1
  Ni  Ni196  1  0.323953  0.069330  0.701496  1
  Ni  Ni197  1  0.403560  0.727841  0.709112  1
  Ni  Ni198  1  0.823953  0.069330  0.701496  1
  Ni  Ni199  1  0.579651  0.227853  0.709111  1
  Ni  Ni200  1  0.079651  0.227853  0.709111  1
  Ni  Ni201  1  1.000759  0.569337  0.701497  1
  Ni  Ni202  1  0.152184  0.885651  0.716428  1
  Ni  Ni203  1  0.500759  0.569337  0.701497  1
  Ni  Ni204  1  0.652184  0.885651  0.716428  1
