# generated using pymatgen
data_Zr2Ni7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.32246347
_cell_length_b   10.17195563
_cell_length_c   52.39422322
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   113.49522301
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr2Ni7
_chemical_formula_sum   'Zr48 Ni168'
_cell_volume   6022.80678618
_cell_formula_units_Z   24
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
  Zr  Zr1  1  0.690128  0.676832  0.327016  1
  Zr  Zr2  1  0.060138  0.912186  0.292562  1
  Zr  Zr3  1  0.246396  0.187772  0.321409  1
  Zr  Zr4  1  0.612085  0.414061  0.283560  1
  Zr  Zr5  1  0.370613  0.790487  0.307905  1
  Zr  Zr6  1  0.737881  0.035300  0.275678  1
  Zr  Zr7  1  0.561163  0.065829  0.339589  1
  Zr  Zr8  1  0.933498  0.305109  0.301572  1
  Zr  Zr9  1  0.960601  0.208925  0.405946  1
  Zr  Zr10  1  0.329237  0.444534  0.366749  1
  Zr  Zr11  1  0.509950  0.715569  0.395119  1
  Zr  Zr12  1  0.881181  0.948038  0.358215  1
  Zr  Zr13  1  0.645965  0.326121  0.386999  1
  Zr  Zr14  1  0.014549  0.562210  0.346776  1
  Zr  Zr15  1  0.823993  0.598740  0.414168  1
  Zr  Zr16  1  0.196213  0.832341  0.376488  1
  Zr  Zr17  1  0.219804  0.753695  0.483452  1
  Zr  Zr18  1  0.589946  0.979711  0.444740  1
  Zr  Zr19  1  0.764184  0.251915  0.470915  1
  Zr  Zr20  1  0.136540  0.482106  0.432703  1
  Zr  Zr21  1  0.905048  0.866877  0.464167  1
  Zr  Zr22  1  0.274983  0.093552  0.425498  1
  Zr  Zr23  1  0.078904  0.137885  0.490006  1
  Zr  Zr24  1  0.450338  0.367098  0.451864  1
  Zr  Zr25  1  0.478434  0.301942  0.560450  1
  Zr  Zr26  1  0.849331  0.527752  0.521823  1
  Zr  Zr27  1  0.023017  0.794801  0.547494  1
  Zr  Zr28  1  0.393023  0.023159  0.509098  1
  Zr  Zr29  1  0.163981  0.414751  0.541208  1
  Zr  Zr30  1  0.534346  0.640641  0.502618  1
  Zr  Zr31  1  0.338366  0.681329  0.566811  1
  Zr  Zr32  1  0.707940  0.908937  0.528163  1
  Zr  Zr33  1  0.741528  0.849795  0.636891  1
  Zr  Zr34  1  0.109147  0.075772  0.598887  1
  Zr  Zr35  1  0.286595  0.340851  0.625919  1
  Zr  Zr36  1  0.653754  0.567607  0.586221  1
  Zr  Zr37  1  0.425076  0.962295  0.618045  1
  Zr  Zr38  1  0.793022  0.189119  0.579586  1
  Zr  Zr39  1  0.603443  0.228147  0.645821  1
  Zr  Zr40  1  0.970077  0.453492  0.605791  1
  Zr  Zr41  1  0.002815  0.382142  0.710268  1
  Zr  Zr42  1  0.371004  0.611112  0.673085  1
  Zr  Zr43  1  0.552775  0.884298  0.700416  1
  Zr  Zr44  1  0.925648  0.115946  0.666616  1
  Zr  Zr45  1  0.680719  0.489032  0.691739  1
  Zr  Zr46  1  0.057061  0.731713  0.655446  1
  Zr  Zr47  1  0.861063  0.755879  0.717178  1
  Zr  Zr48  1  0.243653  1.002261  0.684254  1
  Ni  Ni49  1  0.470245  0.436986  0.323379  1
  Ni  Ni50  1  0.828633  0.672859  0.282303  1
  Ni  Ni51  1  0.520933  0.033173  0.286003  1
  Ni  Ni52  1  0.161542  0.789551  0.320338  1
  Ni  Ni53  1  0.322986  0.992889  0.338628  1
  Ni  Ni54  1  0.692262  0.230112  0.302022  1
  Ni  Ni55  1  0.463751  0.195795  0.309161  1
  Ni  Ni56  1  0.818819  0.408010  0.269584  1
  Ni  Ni57  1  0.302451  0.998258  0.291840  1
  Ni  Ni58  1  0.931866  0.746528  0.327845  1
  Ni  Ni59  1  0.631030  0.377750  0.333604  1
  Ni  Ni60  1  0.997497  0.619035  0.290950  1
  Ni  Ni61  1  0.193469  0.765836  0.271840  1
  Ni  Ni62  1  0.817120  0.495387  0.312916  1
  Ni  Ni63  1  0.507140  0.817968  0.264455  1
  Ni  Ni64  1  0.153644  0.555595  0.300734  1
  Ni  Ni65  1  0.476203  0.673408  0.339495  1
  Ni  Ni66  1  0.839418  0.902764  0.303986  1
  Ni  Ni67  1  0.371119  0.335922  0.282101  1
  Ni  Ni68  1  0.005041  0.109314  0.319822  1
  Ni  Ni69  1  0.145851  0.293643  0.287655  1
  Ni  Ni70  1  0.778382  0.071275  0.326618  1
  Ni  Ni71  1  0.607265  0.866353  0.309187  1
  Ni  Ni72  1  0.966505  0.087330  0.273662  1
  Ni  Ni73  1  0.312091  0.491932  0.311748  1
  Ni  Ni74  1  0.682410  0.757927  0.272185  1
  Ni  Ni75  1  0.498481  0.613346  0.290735  1
  Ni  Ni76  1  0.130257  0.375883  0.332335  1
  Ni  Ni77  1  0.718983  0.945082  0.403799  1
  Ni  Ni78  1  0.100371  0.192795  0.363470  1
  Ni  Ni79  1  0.796941  0.557904  0.359855  1
  Ni  Ni80  1  0.427753  0.321640  0.399054  1
  Ni  Ni81  1  0.584724  0.531921  0.415460  1
  Ni  Ni82  1  0.957753  0.761705  0.377206  1
  Ni  Ni83  1  0.728902  0.721975  0.383872  1
  Ni  Ni84  1  0.095875  0.952915  0.345315  1
  Ni  Ni85  1  0.569749  0.517910  0.367187  1
  Ni  Ni86  1  0.201136  0.281020  0.405789  1
  Ni  Ni87  1  0.890697  0.911762  0.409718  1
  Ni  Ni88  1  0.261412  0.138376  0.372338  1
  Ni  Ni89  1  0.448163  0.255257  0.353916  1
  Ni  Ni90  1  0.083404  1.009769  0.393419  1
  Ni  Ni91  1  0.786255  0.314385  0.343894  1
  Ni  Ni92  1  0.409836  0.067112  0.383828  1
  Ni  Ni93  1  0.743593  0.204551  0.418278  1
  Ni  Ni94  1  0.112544  0.438964  0.378977  1
  Ni  Ni95  1  0.641165  0.875859  0.357867  1
  Ni  Ni96  1  0.270277  0.646359  0.395978  1
  Ni  Ni97  1  0.411610  0.836511  0.364182  1
  Ni  Ni98  1  0.042843  0.606715  0.402908  1
  Ni  Ni99  1  0.887011  0.398976  0.386448  1
  Ni  Ni100  1  0.251208  0.631745  0.346608  1
  Ni  Ni101  1  0.576255  0.024058  0.390973  1
  Ni  Ni102  1  0.946545  0.256351  0.352657  1
  Ni  Ni103  1  0.766196  0.130437  0.373522  1
  Ni  Ni104  1  0.401102  0.888122  0.413279  1
  Ni  Ni105  1  0.958696  0.472561  0.482356  1
  Ni  Ni106  1  0.335530  0.704725  0.443494  1
  Ni  Ni107  1  0.058092  0.089244  0.437553  1
  Ni  Ni108  1  0.686384  0.859049  0.475653  1
  Ni  Ni109  1  0.840220  0.075909  0.492403  1
  Ni  Ni110  1  0.212171  0.303807  0.453851  1
  Ni  Ni111  1  0.983825  0.262909  0.460498  1
  Ni  Ni112  1  0.356169  0.492205  0.421930  1
  Ni  Ni113  1  0.830316  0.048156  0.444302  1
  Ni  Ni114  1  0.458934  0.818305  0.482385  1
  Ni  Ni115  1  0.147302  0.464496  0.484085  1
  Ni  Ni116  1  0.518298  0.688200  0.446500  1
  Ni  Ni117  1  0.718349  0.770308  0.433047  1
  Ni  Ni118  1  0.351641  0.538261  0.471817  1
  Ni  Ni119  1  0.027482  0.824813  0.423827  1
  Ni  Ni120  1  0.646728  0.588392  0.463079  1
  Ni  Ni121  1  1.000973  0.744719  0.494724  1
  Ni  Ni122  1  0.372129  0.973454  0.456596  1
  Ni  Ni123  1  0.897998  0.417090  0.434654  1
  Ni  Ni124  1  0.525709  0.189583  0.473178  1
  Ni  Ni125  1  0.669763  0.377087  0.441335  1
  Ni  Ni126  1  0.297981  0.148771  0.479779  1
  Ni  Ni127  1  0.144800  0.932878  0.463443  1
  Ni  Ni128  1  0.515477  0.163396  0.425175  1
  Ni  Ni129  1  0.832863  0.576340  0.465345  1
  Ni  Ni130  1  0.204487  0.799869  0.427934  1
  Ni  Ni131  1  0.035485  0.653489  0.452516  1
  Ni  Ni132  1  0.667459  0.423875  0.491108  1
  Ni  Ni133  1  0.213508  0.017848  0.559006  1
  Ni  Ni134  1  0.585020  0.244487  0.520843  1
  Ni  Ni135  1  0.315121  0.630553  0.513807  1
  Ni  Ni136  1  0.944016  0.402985  0.552106  1
  Ni  Ni137  1  0.098992  0.619566  0.569099  1
  Ni  Ni138  1  0.468777  0.847795  0.530715  1
  Ni  Ni139  1  0.241925  0.806722  0.537498  1
  Ni  Ni140  1  0.612299  0.034614  0.499016  1
  Ni  Ni141  1  0.087795  0.590176  0.520597  1
  Ni  Ni142  1  0.716181  0.363144  0.558748  1
  Ni  Ni143  1  0.406579  0.014931  0.560017  1
  Ni  Ni144  1  0.776623  0.239821  0.522094  1
  Ni  Ni145  1  0.983209  0.310185  0.510282  1
  Ni  Ni146  1  0.613861  0.083808  0.548310  1
  Ni  Ni147  1  0.271674  0.358519  0.501646  1
  Ni  Ni148  1  0.899059  0.131149  0.540032  1
  Ni  Ni149  1  0.258400  0.289238  0.571323  1
  Ni  Ni150  1  0.629465  0.516829  0.532901  1
  Ni  Ni151  1  0.154401  0.962056  0.511647  1
  Ni  Ni152  1  0.783744  0.733718  0.549816  1
  Ni  Ni153  1  0.927324  0.920919  0.518245  1
  Ni  Ni154  1  0.557073  0.692834  0.556581  1
  Ni  Ni155  1  0.401983  0.476641  0.539744  1
  Ni  Ni156  1  0.773450  0.704372  0.501468  1
  Ni  Ni157  1  0.091709  0.127823  0.541133  1
  Ni  Ni158  1  0.461771  0.352155  0.503143  1
  Ni  Ni159  1  0.298485  0.196923  0.529393  1
  Ni  Ni160  1  0.930188  0.971654  0.567269  1
  Ni  Ni161  1  0.485155  0.569565  0.633823  1
  Ni  Ni162  1  0.845777  0.793958  0.596427  1
  Ni  Ni163  1  0.572198  0.175812  0.590238  1
  Ni  Ni164  1  0.204491  0.949093  0.629100  1
  Ni  Ni165  1  0.363258  0.159575  0.646575  1
  Ni  Ni166  1  0.729148  0.388538  0.607258  1
  Ni  Ni167  1  0.503429  0.348335  0.614510  1
  Ni  Ni168  1  0.872451  0.578327  0.575753  1
  Ni  Ni169  1  0.344940  0.135308  0.597102  1
  Ni  Ni170  1  0.976029  0.910596  0.634951  1
  Ni  Ni171  1  0.670951  0.554482  0.637163  1
  Ni  Ni172  1  0.039206  0.788835  0.598122  1
  Ni  Ni173  1  0.245981  0.859865  0.586420  1
  Ni  Ni174  1  0.875020  0.635844  0.623583  1
  Ni  Ni175  1  0.528929  0.905501  0.577768  1
  Ni  Ni176  1  0.164524  0.681591  0.615446  1
  Ni  Ni177  1  0.521372  0.835752  0.647960  1
  Ni  Ni178  1  0.887371  0.062232  0.609345  1
  Ni  Ni179  1  0.414058  0.504882  0.588200  1
  Ni  Ni180  1  0.045434  0.271411  0.626881  1
  Ni  Ni181  1  0.188189  0.463505  0.595111  1
  Ni  Ni182  1  0.820103  0.231638  0.633942  1
  Ni  Ni183  1  0.659374  0.022849  0.615910  1
  Ni  Ni184  1  0.030436  0.249098  0.578035  1
  Ni  Ni185  1  0.355366  0.673844  0.617431  1
  Ni  Ni186  1  0.722525  0.902526  0.578806  1
  Ni  Ni187  1  0.561813  0.748772  0.605155  1
  Ni  Ni188  1  0.187018  0.519904  0.642746  1
  Ni  Ni189  1  0.776453  0.113098  0.713300  1
  Ni  Ni190  1  0.128168  0.341129  0.672623  1
  Ni  Ni191  1  0.835637  0.718649  0.666424  1
  Ni  Ni192  1  0.465200  0.493207  0.705156  1
  Ni  Ni193  1  0.631861  0.702278  0.719931  1
  Ni  Ni194  1  1.000548  0.925874  0.683546  1
  Ni  Ni195  1  0.769904  0.890713  0.690063  1
  Ni  Ni196  1  0.137586  0.117117  0.653989  1
  Ni  Ni197  1  0.609293  0.680301  0.673266  1
  Ni  Ni198  1  0.242342  0.454871  0.710904  1
  Ni  Ni199  1  0.936117  0.044444  0.719316  1
  Ni  Ni200  1  0.303733  0.312928  0.678264  1
  Ni  Ni201  1  0.498624  0.405869  0.662078  1
  Ni  Ni202  1  0.130178  0.172797  0.703921  1
  Ni  Ni203  1  0.806834  0.456625  0.652609  1
  Ni  Ni204  1  0.448813  0.230669  0.693927  1
  Ni  Ni205  1  0.794184  0.386340  0.723507  1
  Ni  Ni206  1  0.149495  0.600011  0.684960  1
  Ni  Ni207  1  0.681861  0.047708  0.665635  1
  Ni  Ni208  1  0.307283  0.799168  0.701961  1
  Ni  Ni209  1  0.451768  1.004034  0.673050  1
  Ni  Ni210  1  0.086946  0.769977  0.709475  1
  Ni  Ni211  1  0.922016  0.564711  0.691475  1
  Ni  Ni212  1  0.293570  0.796304  0.654464  1
  Ni  Ni213  1  0.617466  0.184121  0.700449  1
  Ni  Ni214  1  0.987059  0.431660  0.657669  1
  Ni  Ni215  1  0.809531  0.290171  0.681799  1
  Ni  Ni216  1  0.427038  0.029220  0.721848  1
