# generated using pymatgen
data_Ni3H
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   20.56792615
_cell_length_b   16.60443255
_cell_length_c   46.90038070
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.19621716
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni3H
_chemical_formula_sum   'Ni540 H180'
_cell_volume   13982.4222104
_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  0.663948  0.174719  0.337787  1
  Ni  Ni2  1  0.772086  0.236436  0.306738  1
  Ni  Ni3  1  0.997282  0.174719  0.337787  1
  Ni  Ni4  1  0.885419  0.308567  0.279545  1
  Ni  Ni5  1  0.105419  0.236436  0.306738  1
  Ni  Ni6  1  0.163948  0.674719  0.337787  1
  Ni  Ni7  1  0.330615  0.174719  0.337787  1
  Ni  Ni8  1  0.218752  0.308567  0.279545  1
  Ni  Ni9  1  0.272086  0.736436  0.306738  1
  Ni  Ni10  1  0.438753  0.236436  0.306738  1
  Ni  Ni11  1  0.497282  0.674719  0.337787  1
  Ni  Ni12  1  0.385419  0.808567  0.279545  1
  Ni  Ni13  1  0.552085  0.308567  0.279545  1
  Ni  Ni14  1  0.605419  0.736436  0.306738  1
  Ni  Ni15  1  0.830615  0.674719  0.337787  1
  Ni  Ni16  1  0.718752  0.808567  0.279545  1
  Ni  Ni17  1  0.938753  0.736436  0.306738  1
  Ni  Ni18  1  0.052085  0.808567  0.279545  1
  Ni  Ni19  1  0.598743  0.086546  0.297093  1
  Ni  Ni20  1  0.859759  0.444340  0.354133  1
  Ni  Ni21  1  0.932076  0.086546  0.297093  1
  Ni  Ni22  1  0.973646  0.512082  0.323881  1
  Ni  Ni23  1  0.193093  0.444340  0.354133  1
  Ni  Ni24  1  0.098743  0.586546  0.297093  1
  Ni  Ni25  1  0.265409  0.086546  0.297093  1
  Ni  Ni26  1  0.306980  0.512082  0.323881  1
  Ni  Ni27  1  0.359759  0.944340  0.354133  1
  Ni  Ni28  1  0.526426  0.444340  0.354133  1
  Ni  Ni29  1  0.432076  0.586546  0.297093  1
  Ni  Ni30  1  0.473646  0.012082  0.323881  1
  Ni  Ni31  1  0.640313  0.512082  0.323881  1
  Ni  Ni32  1  0.693093  0.944340  0.354133  1
  Ni  Ni33  1  0.765409  0.586546  0.297093  1
  Ni  Ni34  1  0.806980  0.012082  0.323881  1
  Ni  Ni35  1  0.026426  0.944340  0.354133  1
  Ni  Ni36  1  0.140313  0.012082  0.323881  1
  Ni  Ni37  1  0.610706  0.241937  0.307878  1
  Ni  Ni38  1  0.719270  0.306808  0.279472  1
  Ni  Ni39  1  0.944039  0.241937  0.307878  1
  Ni  Ni40  1  0.995896  0.670866  0.338502  1
  Ni  Ni41  1  0.052603  0.306808  0.279472  1
  Ni  Ni42  1  0.110706  0.741937  0.307878  1
  Ni  Ni43  1  0.277373  0.241937  0.307878  1
  Ni  Ni44  1  0.329229  0.670866  0.338502  1
  Ni  Ni45  1  0.219270  0.806808  0.279472  1
  Ni  Ni46  1  0.385936  0.306808  0.279472  1
  Ni  Ni47  1  0.444039  0.741937  0.307878  1
  Ni  Ni48  1  0.495896  0.170866  0.338502  1
  Ni  Ni49  1  0.662562  0.670866  0.338502  1
  Ni  Ni50  1  0.552603  0.806808  0.279472  1
  Ni  Ni51  1  0.777373  0.741937  0.307878  1
  Ni  Ni52  1  0.829229  0.170866  0.338502  1
  Ni  Ni53  1  0.885936  0.806808  0.279472  1
  Ni  Ni54  1  0.162562  0.170866  0.338502  1
  Ni  Ni55  1  0.682001  0.415784  0.298880  1
  Ni  Ni56  1  0.953693  0.772970  0.360049  1
  Ni  Ni57  1  0.015335  0.415784  0.298880  1
  Ni  Ni58  1  0.065223  0.842494  0.329603  1
  Ni  Ni59  1  0.287026  0.772970  0.360049  1
  Ni  Ni60  1  0.182001  0.915784  0.298880  1
  Ni  Ni61  1  0.348668  0.415784  0.298880  1
  Ni  Ni62  1  0.398556  0.842494  0.329603  1
  Ni  Ni63  1  0.453693  0.272970  0.360049  1
  Ni  Ni64  1  0.620359  0.772970  0.360049  1
  Ni  Ni65  1  0.515335  0.915784  0.298880  1
  Ni  Ni66  1  0.565223  0.342494  0.329603  1
  Ni  Ni67  1  0.731889  0.842494  0.329603  1
  Ni  Ni68  1  0.787026  0.272970  0.360049  1
  Ni  Ni69  1  0.848668  0.915784  0.298880  1
  Ni  Ni70  1  0.898556  0.342494  0.329603  1
  Ni  Ni71  1  0.120359  0.272970  0.360049  1
  Ni  Ni72  1  0.231889  0.342494  0.329603  1
  Ni  Ni73  1  0.758263  0.500195  0.343308  1
  Ni  Ni74  1  0.872062  0.567058  0.314750  1
  Ni  Ni75  1  0.091596  0.500195  0.343308  1
  Ni  Ni76  1  0.991764  0.632911  0.288971  1
  Ni  Ni77  1  0.205396  0.567058  0.314750  1
  Ni  Ni78  1  0.258263  1.000195  0.343308  1
  Ni  Ni79  1  0.424930  0.500195  0.343308  1
  Ni  Ni80  1  0.325097  0.632911  0.288971  1
  Ni  Ni81  1  0.372062  0.067058  0.314750  1
  Ni  Ni82  1  0.538729  0.567058  0.314750  1
  Ni  Ni83  1  0.591596  1.000195  0.343308  1
  Ni  Ni84  1  0.491764  0.132911  0.288971  1
  Ni  Ni85  1  0.658431  0.632911  0.288971  1
  Ni  Ni86  1  0.705396  0.067058  0.314750  1
  Ni  Ni87  1  0.924930  1.000195  0.343308  1
  Ni  Ni88  1  0.825097  0.132911  0.288971  1
  Ni  Ni89  1  0.038729  0.067058  0.314750  1
  Ni  Ni90  1  0.158431  0.132911  0.288971  1
  Ni  Ni91  1  0.734707  0.348047  0.330383  1
  Ni  Ni92  1  0.844025  0.416293  0.299394  1
  Ni  Ni93  1  0.068041  0.348047  0.330383  1
  Ni  Ni94  1  0.121051  0.777924  0.360644  1
  Ni  Ni95  1  0.177358  0.416293  0.299394  1
  Ni  Ni96  1  0.234707  0.848047  0.330383  1
  Ni  Ni97  1  0.401374  0.348047  0.330383  1
  Ni  Ni98  1  0.454385  0.777924  0.360644  1
  Ni  Ni99  1  0.344025  0.916293  0.299394  1
  Ni  Ni100  1  0.510691  0.416293  0.299394  1
  Ni  Ni101  1  0.568041  0.848047  0.330383  1
  Ni  Ni102  1  0.621051  0.277924  0.360644  1
  Ni  Ni103  1  0.787718  0.777924  0.360644  1
  Ni  Ni104  1  0.677358  0.916293  0.299394  1
  Ni  Ni105  1  0.901374  0.848047  0.330383  1
  Ni  Ni106  1  0.954385  0.277924  0.360644  1
  Ni  Ni107  1  0.010691  0.916293  0.299394  1
  Ni  Ni108  1  0.287718  0.277924  0.360644  1
  Ni  Ni109  1  0.823224  0.463340  0.428976  1
  Ni  Ni110  1  0.937355  0.534000  0.398206  1
  Ni  Ni111  1  0.156557  0.463340  0.428976  1
  Ni  Ni112  1  0.051169  0.603721  0.366931  1
  Ni  Ni113  1  0.270688  0.534000  0.398206  1
  Ni  Ni114  1  0.323224  0.963340  0.428976  1
  Ni  Ni115  1  0.489890  0.463340  0.428976  1
  Ni  Ni116  1  0.384503  0.603721  0.366931  1
  Ni  Ni117  1  0.437355  0.034000  0.398206  1
  Ni  Ni118  1  0.604021  0.534000  0.398206  1
  Ni  Ni119  1  0.656557  0.963340  0.428976  1
  Ni  Ni120  1  0.551169  0.103721  0.366931  1
  Ni  Ni121  1  0.717836  0.603721  0.366931  1
  Ni  Ni122  1  0.770688  0.034000  0.398206  1
  Ni  Ni123  1  0.989890  0.963340  0.428976  1
  Ni  Ni124  1  0.884503  0.103721  0.366931  1
  Ni  Ni125  1  0.104021  0.034000  0.398206  1
  Ni  Ni126  1  0.217836  0.103721  0.366931  1
  Ni  Ni127  1  0.746576  0.374341  0.384780  1
  Ni  Ni128  1  0.019727  0.732759  0.446138  1
  Ni  Ni129  1  0.079909  0.374341  0.384780  1
  Ni  Ni130  1  0.133106  0.803686  0.415380  1
  Ni  Ni131  1  0.353060  0.732759  0.446138  1
  Ni  Ni132  1  0.246576  0.874341  0.384780  1
  Ni  Ni133  1  0.413243  0.374341  0.384780  1
  Ni  Ni134  1  0.466439  0.803686  0.415380  1
  Ni  Ni135  1  0.519727  0.232759  0.446138  1
  Ni  Ni136  1  0.686393  0.732759  0.446138  1
  Ni  Ni137  1  0.579909  0.874341  0.384780  1
  Ni  Ni138  1  0.633106  0.303686  0.415380  1
  Ni  Ni139  1  0.799772  0.803686  0.415380  1
  Ni  Ni140  1  0.853060  0.232759  0.446138  1
  Ni  Ni141  1  0.913243  0.874341  0.384780  1
  Ni  Ni142  1  0.966439  0.303686  0.415380  1
  Ni  Ni143  1  0.186393  0.232759  0.446138  1
  Ni  Ni144  1  0.299772  0.303686  0.415380  1
  Ni  Ni145  1  0.769464  0.529082  0.397879  1
  Ni  Ni146  1  0.882328  0.599111  0.367800  1
  Ni  Ni147  1  0.102797  0.529082  0.397879  1
  Ni  Ni148  1  0.156555  0.958666  0.428332  1
  Ni  Ni149  1  0.215662  0.599111  0.367800  1
  Ni  Ni150  1  0.269464  0.029082  0.397879  1
  Ni  Ni151  1  0.436131  0.529082  0.397879  1
  Ni  Ni152  1  0.489889  0.958666  0.428332  1
  Ni  Ni153  1  0.382328  0.099111  0.367800  1
  Ni  Ni154  1  0.548995  0.599111  0.367800  1
  Ni  Ni155  1  0.602797  0.029082  0.397879  1
  Ni  Ni156  1  0.656555  0.458666  0.428332  1
  Ni  Ni157  1  0.823222  0.958666  0.428332  1
  Ni  Ni158  1  0.715662  0.099111  0.367800  1
  Ni  Ni159  1  0.936131  0.029082  0.397879  1
  Ni  Ni160  1  0.989889  0.458666  0.428332  1
  Ni  Ni161  1  0.048995  0.099111  0.367800  1
  Ni  Ni162  1  0.323222  0.458666  0.428332  1
  Ni  Ni163  1  0.840934  0.702830  0.390819  1
  Ni  Ni164  1  0.114428  0.061469  0.451783  1
  Ni  Ni165  1  0.174267  0.702830  0.390819  1
  Ni  Ni166  1  0.227779  0.132050  0.421067  1
  Ni  Ni167  1  0.447761  0.061469  0.451783  1
  Ni  Ni168  1  0.340934  0.202830  0.390819  1
  Ni  Ni169  1  0.507600  0.702830  0.390819  1
  Ni  Ni170  1  0.561113  0.132050  0.421067  1
  Ni  Ni171  1  0.614428  0.561469  0.451783  1
  Ni  Ni172  1  0.781094  0.061469  0.451783  1
  Ni  Ni173  1  0.674267  0.202830  0.390819  1
  Ni  Ni174  1  0.727779  0.632050  0.421067  1
  Ni  Ni175  1  0.894446  0.132050  0.421067  1
  Ni  Ni176  1  0.947761  0.561469  0.451783  1
  Ni  Ni177  1  1.007600  0.202830  0.390819  1
  Ni  Ni178  1  0.061113  0.632050  0.421067  1
  Ni  Ni179  1  0.281094  0.561469  0.451783  1
  Ni  Ni180  1  0.394446  0.632050  0.421067  1
  Ni  Ni181  1  0.917620  0.791884  0.434805  1
  Ni  Ni182  1  0.031037  0.862563  0.404070  1
  Ni  Ni183  1  0.250953  0.791884  0.434805  1
  Ni  Ni184  1  0.144434  0.932828  0.373175  1
  Ni  Ni185  1  0.364370  0.862563  0.404070  1
  Ni  Ni186  1  0.417620  0.291884  0.434805  1
  Ni  Ni187  1  0.584287  0.791884  0.434805  1
  Ni  Ni188  1  0.477767  0.932828  0.373175  1
  Ni  Ni189  1  0.531037  0.362563  0.404070  1
  Ni  Ni190  1  0.697704  0.862563  0.404070  1
  Ni  Ni191  1  0.750953  0.291884  0.434805  1
  Ni  Ni192  1  0.644434  0.432828  0.373175  1
  Ni  Ni193  1  0.811101  0.932828  0.373175  1
  Ni  Ni194  1  0.864370  0.362563  0.404070  1
  Ni  Ni195  1  0.084287  0.291884  0.434805  1
  Ni  Ni196  1  0.977767  0.432828  0.373175  1
  Ni  Ni197  1  0.197704  0.362563  0.404070  1
  Ni  Ni198  1  0.311101  0.432828  0.373175  1
  Ni  Ni199  1  0.893756  0.636110  0.422044  1
  Ni  Ni200  1  1.007416  0.706825  0.391527  1
  Ni  Ni201  1  0.227089  0.636110  0.422044  1
  Ni  Ni202  1  0.280183  0.065564  0.452603  1
  Ni  Ni203  1  0.340750  0.706825  0.391527  1
  Ni  Ni204  1  0.393756  0.136110  0.422044  1
  Ni  Ni205  1  0.560423  0.636110  0.422044  1
  Ni  Ni206  1  0.613516  0.065564  0.452603  1
  Ni  Ni207  1  0.507416  0.206825  0.391527  1
  Ni  Ni208  1  0.674083  0.706825  0.391527  1
  Ni  Ni209  1  0.727089  0.136110  0.422044  1
  Ni  Ni210  1  0.780183  0.565564  0.452603  1
  Ni  Ni211  1  0.946849  0.065564  0.452603  1
  Ni  Ni212  1  0.840750  0.206825  0.391527  1
  Ni  Ni213  1  0.060423  0.136110  0.422044  1
  Ni  Ni214  1  0.113516  0.565564  0.452603  1
  Ni  Ni215  1  0.174083  0.206825  0.391527  1
  Ni  Ni216  1  0.446849  0.565564  0.452603  1
  Ni  Ni217  1  0.982394  0.751099  0.520912  1
  Ni  Ni218  1  0.095924  0.821806  0.490290  1
  Ni  Ni219  1  0.315727  0.751099  0.520912  1
  Ni  Ni220  1  0.209488  0.892506  0.459641  1
  Ni  Ni221  1  0.429257  0.821806  0.490290  1
  Ni  Ni222  1  0.482394  0.251099  0.520912  1
  Ni  Ni223  1  0.649061  0.751099  0.520912  1
  Ni  Ni224  1  0.542821  0.892506  0.459641  1
  Ni  Ni225  1  0.595924  0.321806  0.490290  1
  Ni  Ni226  1  0.762591  0.821806  0.490290  1
  Ni  Ni227  1  0.815727  0.251099  0.520912  1
  Ni  Ni228  1  0.709488  0.392506  0.459641  1
  Ni  Ni229  1  0.876155  0.892506  0.459641  1
  Ni  Ni230  1  0.929257  0.321806  0.490290  1
  Ni  Ni231  1  0.149061  0.251099  0.520912  1
  Ni  Ni232  1  0.042821  0.392506  0.459641  1
  Ni  Ni233  1  0.262591  0.321806  0.490290  1
  Ni  Ni234  1  0.376155  0.392506  0.459641  1
  Ni  Ni235  1  0.906176  0.662108  0.476699  1
  Ni  Ni236  1  0.179254  0.020770  0.537939  1
  Ni  Ni237  1  0.239509  0.662108  0.476699  1
  Ni  Ni238  1  0.292687  0.091483  0.507285  1
  Ni  Ni239  1  0.512588  0.020770  0.537939  1
  Ni  Ni240  1  0.406176  0.162108  0.476699  1
  Ni  Ni241  1  0.572842  0.662108  0.476699  1
  Ni  Ni242  1  0.626020  0.091483  0.507285  1
  Ni  Ni243  1  0.679254  0.520770  0.537939  1
  Ni  Ni244  1  0.845921  0.020770  0.537939  1
  Ni  Ni245  1  0.739509  0.162108  0.476699  1
  Ni  Ni246  1  0.792687  0.591483  0.507285  1
  Ni  Ni247  1  0.959353  0.091483  0.507285  1
  Ni  Ni248  1  0.012588  0.520770  0.537939  1
  Ni  Ni249  1  0.072842  0.162108  0.476699  1
  Ni  Ni250  1  0.126020  0.591483  0.507285  1
  Ni  Ni251  1  0.345921  0.520770  0.537939  1
  Ni  Ni252  1  0.459353  0.591483  0.507285  1
  Ni  Ni253  1  0.929914  0.817631  0.489511  1
  Ni  Ni254  1  0.043325  0.888235  0.458911  1
  Ni  Ni255  1  0.263248  0.817631  0.489511  1
  Ni  Ni256  1  0.316481  0.247023  0.520097  1
  Ni  Ni257  1  0.376658  0.888235  0.458911  1
  Ni  Ni258  1  0.429914  0.317631  0.489511  1
  Ni  Ni259  1  0.596581  0.817631  0.489511  1
  Ni  Ni260  1  0.649815  0.247023  0.520097  1
  Ni  Ni261  1  0.543325  0.388235  0.458911  1
  Ni  Ni262  1  0.709991  0.888235  0.458911  1
  Ni  Ni263  1  0.763248  0.317631  0.489511  1
  Ni  Ni264  1  0.816481  0.747023  0.520097  1
  Ni  Ni265  1  0.983148  0.247023  0.520097  1
  Ni  Ni266  1  0.876658  0.388235  0.458911  1
  Ni  Ni267  1  0.096581  0.317631  0.489511  1
  Ni  Ni268  1  0.149815  0.747023  0.520097  1
  Ni  Ni269  1  0.209991  0.388235  0.458911  1
  Ni  Ni270  1  0.483148  0.747023  0.520097  1
  Ni  Ni271  1  1.000866  0.990818  0.482397  1
  Ni  Ni272  1  0.273771  0.349411  0.543668  1
  Ni  Ni273  1  0.334199  0.990818  0.482397  1
  Ni  Ni274  1  0.387336  0.420111  0.513019  1
  Ni  Ni275  1  0.607105  0.349411  0.543668  1
  Ni  Ni276  1  0.500866  0.490818  0.482397  1
  Ni  Ni277  1  0.667532  0.990818  0.482397  1
  Ni  Ni278  1  0.720669  0.420111  0.513019  1
  Ni  Ni279  1  0.773771  0.849411  0.543668  1
  Ni  Ni280  1  0.940438  0.349411  0.543668  1
  Ni  Ni281  1  0.834199  0.490818  0.482397  1
  Ni  Ni282  1  0.887336  0.920111  0.513019  1
  Ni  Ni283  1  0.054002  0.420111  0.513019  1
  Ni  Ni284  1  0.107105  0.849411  0.543668  1
  Ni  Ni285  1  0.167532  0.490818  0.482397  1
  Ni  Ni286  1  0.220669  0.920111  0.513019  1
  Ni  Ni287  1  0.440438  0.849411  0.543668  1
  Ni  Ni288  1  0.554002  0.920111  0.513019  1
  Ni  Ni289  1  0.077084  0.079810  0.526610  1
  Ni  Ni290  1  0.190573  0.150434  0.496024  1
  Ni  Ni291  1  0.410417  0.079810  0.526610  1
  Ni  Ni292  1  0.304005  0.221147  0.465370  1
  Ni  Ni293  1  0.523906  0.150434  0.496024  1
  Ni  Ni294  1  0.577084  0.579810  0.526610  1
  Ni  Ni295  1  0.743751  0.079810  0.526610  1
  Ni  Ni296  1  0.637338  0.221147  0.465370  1
  Ni  Ni297  1  0.690573  0.650434  0.496024  1
  Ni  Ni298  1  0.857239  0.150434  0.496024  1
  Ni  Ni299  1  0.910417  0.579810  0.526610  1
  Ni  Ni300  1  0.804005  0.721147  0.465370  1
  Ni  Ni301  1  0.970672  0.221147  0.465370  1
  Ni  Ni302  1  0.023906  0.650434  0.496024  1
  Ni  Ni303  1  0.243751  0.579810  0.526610  1
  Ni  Ni304  1  0.137338  0.721147  0.465370  1
  Ni  Ni305  1  0.357239  0.650434  0.496024  1
  Ni  Ni306  1  0.470672  0.721147  0.465370  1
  Ni  Ni307  1  0.053345  0.924286  0.513798  1
  Ni  Ni308  1  0.166778  0.994895  0.483212  1
  Ni  Ni309  1  0.386678  0.924286  0.513798  1
  Ni  Ni310  1  0.439935  0.353682  0.544398  1
  Ni  Ni311  1  0.500112  0.994895  0.483212  1
  Ni  Ni312  1  0.553345  0.424286  0.513798  1
  Ni  Ni313  1  0.720012  0.924286  0.513798  1
  Ni  Ni314  1  0.773268  0.353682  0.544398  1
  Ni  Ni315  1  0.666778  0.494895  0.483212  1
  Ni  Ni316  1  0.833445  0.994895  0.483212  1
  Ni  Ni317  1  0.886678  0.424286  0.513798  1
  Ni  Ni318  1  0.939935  0.853682  0.544398  1
  Ni  Ni319  1  0.106601  0.353682  0.544398  1
  Ni  Ni320  1  1.000112  0.494895  0.483212  1
  Ni  Ni321  1  0.220012  0.424286  0.513798  1
  Ni  Ni322  1  0.273268  0.853682  0.544398  1
  Ni  Ni323  1  0.333445  0.494895  0.483212  1
  Ni  Ni324  1  0.606601  0.853682  0.544398  1
  Ni  Ni325  1  0.142326  0.039087  0.612490  1
  Ni  Ni326  1  0.255480  0.109868  0.582242  1
  Ni  Ni327  1  0.475659  0.039087  0.612490  1
  Ni  Ni328  1  0.368832  0.180448  0.551526  1
  Ni  Ni329  1  0.588814  0.109868  0.582242  1
  Ni  Ni330  1  0.642326  0.539087  0.612490  1
  Ni  Ni331  1  0.808993  0.039087  0.612490  1
  Ni  Ni332  1  0.702165  0.180448  0.551526  1
  Ni  Ni333  1  0.755480  0.609868  0.582242  1
  Ni  Ni334  1  0.922147  0.109868  0.582242  1
  Ni  Ni335  1  0.975659  0.539087  0.612490  1
  Ni  Ni336  1  0.868832  0.680448  0.551526  1
  Ni  Ni337  1  0.035498  0.180448  0.551526  1
  Ni  Ni338  1  0.088814  0.609868  0.582242  1
  Ni  Ni339  1  0.308993  0.539087  0.612490  1
  Ni  Ni340  1  0.202165  0.680448  0.551526  1
  Ni  Ni341  1  0.422147  0.609868  0.582242  1
  Ni  Ni342  1  0.535498  0.680448  0.551526  1
  Ni  Ni343  1  0.065639  0.950033  0.568504  1
  Ni  Ni344  1  0.338826  0.309089  0.630134  1
  Ni  Ni345  1  0.398973  0.950033  0.568504  1
  Ni  Ni346  1  0.452222  0.379354  0.599238  1
  Ni  Ni347  1  0.672159  0.309089  0.630134  1
  Ni  Ni348  1  0.565639  0.450033  0.568504  1
  Ni  Ni349  1  0.732306  0.950033  0.568504  1
  Ni  Ni350  1  0.785556  0.379354  0.599238  1
  Ni  Ni351  1  0.838826  0.809089  0.630134  1
  Ni  Ni352  1  1.005492  0.309089  0.630134  1
  Ni  Ni353  1  0.898973  0.450033  0.568504  1
  Ni  Ni354  1  0.952222  0.879354  0.599238  1
  Ni  Ni355  1  0.118889  0.379354  0.599238  1
  Ni  Ni356  1  0.172159  0.809089  0.630134  1
  Ni  Ni357  1  0.232306  0.450033  0.568504  1
  Ni  Ni358  1  0.285556  0.879354  0.599238  1
  Ni  Ni359  1  0.505492  0.809089  0.630134  1
  Ni  Ni360  1  0.618889  0.879354  0.599238  1
  Ni  Ni361  1  0.089503  0.105807  0.581265  1
  Ni  Ni362  1  0.203077  0.176353  0.550706  1
  Ni  Ni363  1  0.422837  0.105807  0.581265  1
  Ni  Ni364  1  0.475843  0.535092  0.611782  1
  Ni  Ni365  1  0.536410  0.176353  0.550706  1
  Ni  Ni366  1  0.589503  0.605807  0.581265  1
  Ni  Ni367  1  0.756170  0.105807  0.581265  1
  Ni  Ni368  1  0.809176  0.535092  0.611782  1
  Ni  Ni369  1  0.703077  0.676353  0.550706  1
  Ni  Ni370  1  0.869744  0.176353  0.550706  1
  Ni  Ni371  1  0.922837  0.605807  0.581265  1
  Ni  Ni372  1  0.975843  0.035092  0.611782  1
  Ni  Ni373  1  0.142510  0.535092  0.611782  1
  Ni  Ni374  1  0.036410  0.676353  0.550706  1
  Ni  Ni375  1  0.256170  0.605807  0.581265  1
  Ni  Ni376  1  0.309176  0.035092  0.611782  1
  Ni  Ni377  1  0.369744  0.676353  0.550706  1
  Ni  Ni378  1  0.642510  0.035092  0.611782  1
  Ni  Ni379  1  0.160036  0.278577  0.574333  1
  Ni  Ni380  1  0.432090  0.638196  0.636378  1
  Ni  Ni381  1  0.493369  0.278577  0.574333  1
  Ni  Ni382  1  0.545905  0.707917  0.605103  1
  Ni  Ni383  1  0.765423  0.638196  0.636378  1
  Ni  Ni384  1  0.660036  0.778577  0.574333  1
  Ni  Ni385  1  0.826702  0.278577  0.574333  1
  Ni  Ni386  1  0.879238  0.707917  0.605103  1
  Ni  Ni387  1  0.932090  0.138196  0.636378  1
  Ni  Ni388  1  0.098757  0.638196  0.636378  1
  Ni  Ni389  1  0.993369  0.778577  0.574333  1
  Ni  Ni390  1  0.045905  0.207917  0.605103  1
  Ni  Ni391  1  0.212572  0.707917  0.605103  1
  Ni  Ni392  1  0.265423  0.138196  0.636378  1
  Ni  Ni393  1  0.326702  0.778577  0.574333  1
  Ni  Ni394  1  0.379238  0.207917  0.605103  1
  Ni  Ni395  1  0.598757  0.138196  0.636378  1
  Ni  Ni396  1  0.712572  0.207917  0.605103  1
  Ni  Ni397  1  0.236684  0.367576  0.618529  1
  Ni  Ni398  1  0.350154  0.438231  0.587929  1
  Ni  Ni399  1  0.570017  0.367576  0.618529  1
  Ni  Ni400  1  0.463533  0.509158  0.557171  1
  Ni  Ni401  1  0.683487  0.438231  0.587929  1
  Ni  Ni402  1  0.736684  0.867576  0.618529  1
  Ni  Ni403  1  0.903350  0.367576  0.618529  1
  Ni  Ni404  1  0.796866  0.509158  0.557171  1
  Ni  Ni405  1  0.850154  0.938231  0.587929  1
  Ni  Ni406  1  0.016820  0.438231  0.587929  1
  Ni  Ni407  1  0.070017  0.867576  0.618529  1
  Ni  Ni408  1  0.963533  0.009158  0.557171  1
  Ni  Ni409  1  0.130199  0.509158  0.557171  1
  Ni  Ni410  1  0.183487  0.938231  0.587929  1
  Ni  Ni411  1  0.403350  0.867576  0.618529  1
  Ni  Ni412  1  0.296866  0.009158  0.557171  1
  Ni  Ni413  1  0.516820  0.938231  0.587929  1
  Ni  Ni414  1  0.630199  0.009158  0.557171  1
  Ni  Ni415  1  0.213796  0.212835  0.605430  1
  Ni  Ni416  1  0.326704  0.283251  0.574977  1
  Ni  Ni417  1  0.547129  0.212835  0.605430  1
  Ni  Ni418  1  0.600931  0.642806  0.635509  1
  Ni  Ni419  1  0.660037  0.283251  0.574977  1
  Ni  Ni420  1  0.713796  0.712835  0.605430  1
  Ni  Ni421  1  0.880462  0.212835  0.605430  1
  Ni  Ni422  1  0.934264  0.642806  0.635509  1
  Ni  Ni423  1  0.826704  0.783251  0.574977  1
  Ni  Ni424  1  0.993371  0.283251  0.574977  1
  Ni  Ni425  1  0.047129  0.712835  0.605430  1
  Ni  Ni426  1  0.100931  0.142806  0.635509  1
  Ni  Ni427  1  0.267598  0.642806  0.635509  1
  Ni  Ni428  1  0.160037  0.783251  0.574977  1
  Ni  Ni429  1  0.380462  0.712835  0.605430  1
  Ni  Ni430  1  0.434264  0.142806  0.635509  1
  Ni  Ni431  1  0.493371  0.783251  0.574977  1
  Ni  Ni432  1  0.767598  0.142806  0.635509  1
  Ni  Ni433  1  0.301258  0.326133  0.704429  1
  Ni  Ni434  1  0.418037  0.399423  0.673706  1
  Ni  Ni435  1  0.634591  0.326133  0.704429  1
  Ni  Ni436  1  0.529567  0.468947  0.643260  1
  Ni  Ni437  1  0.751370  0.399423  0.673706  1
  Ni  Ni438  1  0.801258  0.826133  0.704429  1
  Ni  Ni439  1  0.967925  0.326133  0.704429  1
  Ni  Ni440  1  0.862900  0.468947  0.643260  1
  Ni  Ni441  1  0.918037  0.899423  0.673706  1
  Ni  Ni442  1  0.084703  0.399423  0.673706  1
  Ni  Ni443  1  0.134591  0.826133  0.704429  1
  Ni  Ni444  1  0.029567  0.968947  0.643260  1
  Ni  Ni445  1  0.196233  0.468947  0.643260  1
  Ni  Ni446  1  0.251370  0.899423  0.673706  1
  Ni  Ni447  1  0.467925  0.826133  0.704429  1
  Ni  Ni448  1  0.362900  0.968947  0.643260  1
  Ni  Ni449  1  0.584703  0.899423  0.673706  1
  Ni  Ni450  1  0.696233  0.968947  0.643260  1
  Ni  Ni451  1  0.224996  0.241722  0.660001  1
  Ni  Ni452  1  0.491495  0.609006  0.714338  1
  Ni  Ni453  1  0.558330  0.241722  0.660001  1
  Ni  Ni454  1  0.611197  0.674859  0.688559  1
  Ni  Ni455  1  0.824829  0.609006  0.714338  1
  Ni  Ni456  1  0.724996  0.741722  0.660001  1
  Ni  Ni457  1  0.891663  0.241722  0.660001  1
  Ni  Ni458  1  0.944531  0.674859  0.688559  1
  Ni  Ni459  1  0.991495  0.109006  0.714338  1
  Ni  Ni460  1  0.158162  0.609006  0.714338  1
  Ni  Ni461  1  0.058330  0.741722  0.660001  1
  Ni  Ni462  1  0.111197  0.174859  0.688559  1
  Ni  Ni463  1  0.277864  0.674859  0.688559  1
  Ni  Ni464  1  0.324829  0.109006  0.714338  1
  Ni  Ni465  1  0.391663  0.741722  0.660001  1
  Ni  Ni466  1  0.444531  0.174859  0.688559  1
  Ni  Ni467  1  0.658162  0.109006  0.714338  1
  Ni  Ni468  1  0.777864  0.174859  0.688559  1
  Ni  Ni469  1  0.248552  0.393870  0.672926  1
  Ni  Ni470  1  0.362208  0.463993  0.642665  1
  Ni  Ni471  1  0.581885  0.393870  0.672926  1
  Ni  Ni472  1  0.639235  0.825625  0.703915  1
  Ni  Ni473  1  0.695541  0.463993  0.642665  1
  Ni  Ni474  1  0.748552  0.893870  0.672926  1
  Ni  Ni475  1  0.915219  0.393870  0.672926  1
  Ni  Ni476  1  0.972568  0.825625  0.703915  1
  Ni  Ni477  1  0.862208  0.963993  0.642665  1
  Ni  Ni478  1  0.028875  0.463993  0.642665  1
  Ni  Ni479  1  0.081885  0.893870  0.672926  1
  Ni  Ni480  1  0.139235  0.325625  0.703915  1
  Ni  Ni481  1  0.305902  0.825625  0.703915  1
  Ni  Ni482  1  0.195541  0.963993  0.642665  1
  Ni  Ni483  1  0.415219  0.893870  0.672926  1
  Ni  Ni484  1  0.472568  0.325625  0.703915  1
  Ni  Ni485  1  0.528875  0.963993  0.642665  1
  Ni  Ni486  1  0.805902  0.325625  0.703915  1
  Ni  Ni487  1  0.319311  0.567198  0.665522  1
  Ni  Ni488  1  0.597841  0.933350  0.723764  1
  Ni  Ni489  1  0.652645  0.567198  0.665522  1
  Ni  Ni490  1  0.711173  0.005481  0.696571  1
  Ni  Ni491  1  0.931174  0.933350  0.723764  1
  Ni  Ni492  1  0.819311  0.067198  0.665522  1
  Ni  Ni493  1  0.985978  0.567198  0.665522  1
  Ni  Ni494  1  0.044507  0.005481  0.696571  1
  Ni  Ni495  1  0.097841  0.433350  0.723764  1
  Ni  Ni496  1  0.264507  0.933350  0.723764  1
  Ni  Ni497  1  0.152645  0.067198  0.665522  1
  Ni  Ni498  1  0.211173  0.505481  0.696571  1
  Ni  Ni499  1  0.377840  0.005481  0.696571  1
  Ni  Ni500  1  0.431174  0.433350  0.723764  1
  Ni  Ni501  1  0.485978  0.067198  0.665522  1
  Ni  Ni502  1  0.544507  0.505481  0.696571  1
  Ni  Ni503  1  0.764507  0.433350  0.723764  1
  Ni  Ni504  1  0.877840  0.505481  0.696571  1
  Ni  Ni505  1  0.384517  0.655371  0.706216  1
  Ni  Ni506  1  0.509613  0.729835  0.679428  1
  Ni  Ni507  1  0.717850  0.655371  0.706216  1
  Ni  Ni508  1  0.623500  0.797577  0.649176  1
  Ni  Ni509  1  0.842946  0.729835  0.679428  1
  Ni  Ni510  1  0.884517  0.155371  0.706216  1
  Ni  Ni511  1  0.051184  0.655371  0.706216  1
  Ni  Ni512  1  0.956834  0.797577  0.649176  1
  Ni  Ni513  1  0.009613  0.229835  0.679428  1
  Ni  Ni514  1  0.176280  0.729835  0.679428  1
  Ni  Ni515  1  0.217850  0.155371  0.706216  1
  Ni  Ni516  1  0.123500  0.297577  0.649176  1
  Ni  Ni517  1  0.290167  0.797577  0.649176  1
  Ni  Ni518  1  0.342946  0.229835  0.679428  1
  Ni  Ni519  1  0.551184  0.155371  0.706216  1
  Ni  Ni520  1  0.456834  0.297577  0.649176  1
  Ni  Ni521  1  0.676280  0.229835  0.679428  1
  Ni  Ni522  1  0.790167  0.297577  0.649176  1
  Ni  Ni523  1  0.372553  0.499980  0.695431  1
  Ni  Ni524  1  0.487364  0.571051  0.664807  1
  Ni  Ni525  1  0.705887  0.499980  0.695431  1
  Ni  Ni526  1  0.763990  0.935109  0.723837  1
  Ni  Ni527  1  0.820697  0.571051  0.664807  1
  Ni  Ni528  1  0.872553  0.999980  0.695431  1
  Ni  Ni529  1  0.039220  0.499980  0.695431  1
  Ni  Ni530  1  0.097323  0.935109  0.723837  1
  Ni  Ni531  1  0.987364  0.071051  0.664807  1
  Ni  Ni532  1  0.154031  0.571051  0.664807  1
  Ni  Ni533  1  0.205887  0.999980  0.695431  1
  Ni  Ni534  1  0.263990  0.435109  0.723837  1
  Ni  Ni535  1  0.430657  0.935109  0.723837  1
  Ni  Ni536  1  0.320697  0.071051  0.664807  1
  Ni  Ni537  1  0.539220  0.999980  0.695431  1
  Ni  Ni538  1  0.597323  0.435109  0.723837  1
  Ni  Ni539  1  0.654031  0.071051  0.664807  1
  Ni  Ni540  1  0.930657  0.435109  0.723837  1
  H  H541  1  0.673960  0.199269  0.292381  1
  H  H542  1  0.952511  0.544910  0.358811  1
  H  H543  1  1.007293  0.199269  0.292381  1
  H  H544  1  0.053581  0.624099  0.319544  1
  H  H545  1  0.285844  0.544910  0.358811  1
  H  H546  1  0.173960  0.699269  0.292381  1
  H  H547  1  0.340627  0.199269  0.292381  1
  H  H548  1  0.386914  0.624099  0.319544  1
  H  H549  1  0.452511  0.044910  0.358811  1
  H  H550  1  0.619178  0.544910  0.358811  1
  H  H551  1  0.507293  0.699269  0.292381  1
  H  H552  1  0.553581  0.124099  0.319544  1
  H  H553  1  0.720248  0.624099  0.319544  1
  H  H554  1  0.785844  0.044910  0.358811  1
  H  H555  1  0.840627  0.699269  0.292381  1
  H  H556  1  0.886914  0.124099  0.319544  1
  H  H557  1  0.119178  0.044910  0.358811  1
  H  H558  1  0.220248  0.124099  0.319544  1
  H  H559  1  0.665454  0.403762  0.336338  1
  H  H560  1  0.779905  0.479768  0.303859  1
  H  H561  1  0.998787  0.403762  0.336338  1
  H  H562  1  0.920093  0.526853  0.292091  1
  H  H563  1  0.113238  0.479768  0.303859  1
  H  H564  1  0.165454  0.903762  0.336338  1
  H  H565  1  0.332120  0.403762  0.336338  1
  H  H566  1  0.253426  0.526853  0.292091  1
  H  H567  1  0.279905  0.979768  0.303859  1
  H  H568  1  0.446571  0.479768  0.303859  1
  H  H569  1  0.498787  0.903762  0.336338  1
  H  H570  1  0.420093  0.026853  0.292091  1
  H  H571  1  0.586760  0.526853  0.292091  1
  H  H572  1  0.613238  0.979768  0.303859  1
  H  H573  1  0.832120  0.903762  0.336338  1
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  H  H629  1  0.437181  0.622473  0.542473  1
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  H  H631  1  0.985816  0.978007  0.522081  1
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  H  H634  1  0.212745  0.119444  0.460836  1
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  H  H650  1  0.430118  0.410732  0.634127  1
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  H  H660  1  0.043490  0.981560  0.603490  1
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  H  H663  1  0.323628  0.552138  0.572895  1
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  H  H667  1  0.144928  0.266785  0.613669  1
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  H  H720  1  0.697415  0.197007  0.644498  1
