# generated using pymatgen
data_Zr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   16.39783377
_cell_length_b   28.57591700
_cell_length_c   47.32878485
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   79.89738821
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr
_chemical_formula_sum   Zr432
_cell_volume   21833.6128905
_cell_formula_units_Z   432
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  0.263291  0.777193  0.306554  1
  Zr  Zr2  1  0.931680  0.609835  0.306883  1
  Zr  Zr3  1  0.879014  0.766118  0.333987  1
  Zr  Zr4  1  0.263867  0.278292  0.307301  1
  Zr  Zr5  1  0.211453  0.432513  0.332849  1
  Zr  Zr6  1  0.310287  0.623248  0.284524  1
  Zr  Zr7  1  0.598347  0.444476  0.307145  1
  Zr  Zr8  1  0.544819  0.599299  0.332982  1
  Zr  Zr9  1  0.643117  0.791931  0.282596  1
  Zr  Zr10  1  0.930558  0.111277  0.306955  1
  Zr  Zr11  1  0.877186  0.266665  0.332874  1
  Zr  Zr12  1  0.977746  0.456688  0.284581  1
  Zr  Zr13  1  0.211057  0.933522  0.333185  1
  Zr  Zr14  1  0.310130  0.125042  0.282553  1
  Zr  Zr15  1  0.597446  0.944152  0.307270  1
  Zr  Zr16  1  0.544970  0.099099  0.333769  1
  Zr  Zr17  1  0.643846  0.291166  0.283476  1
  Zr  Zr18  1  0.976226  0.958265  0.283332  1
  Zr  Zr19  1  0.021412  0.676224  0.346466  1
  Zr  Zr20  1  0.687919  0.509928  0.346630  1
  Zr  Zr21  1  0.786657  0.701597  0.294712  1
  Zr  Zr22  1  0.165942  0.214728  0.271956  1
  Zr  Zr23  1  0.121195  0.366595  0.294704  1
  Zr  Zr24  1  0.073121  0.521282  0.320099  1
  Zr  Zr25  1  0.501200  0.379632  0.272122  1
  Zr  Zr26  1  0.453977  0.533127  0.294832  1
  Zr  Zr27  1  0.405949  0.688061  0.319935  1
  Zr  Zr28  1  0.834654  0.046355  0.271836  1
  Zr  Zr29  1  0.788258  0.200469  0.294552  1
  Zr  Zr30  1  0.736828  0.355452  0.319515  1
  Zr  Zr31  1  0.121263  0.869691  0.294917  1
  Zr  Zr32  1  0.069940  0.022127  0.319375  1
  Zr  Zr33  1  0.498694  0.880799  0.271917  1
  Zr  Zr34  1  0.454152  0.032939  0.293994  1
  Zr  Zr35  1  0.402577  0.189100  0.320448  1
  Zr  Zr36  1  0.736440  0.855515  0.320377  1
  Zr  Zr37  1  0.212091  0.683223  0.332945  1
  Zr  Zr38  1  0.879480  0.516141  0.333323  1
  Zr  Zr39  1  0.975250  0.707751  0.283532  1
  Zr  Zr40  1  0.212067  0.182917  0.334010  1
  Zr  Zr41  1  0.312299  0.375101  0.283346  1
  Zr  Zr42  1  0.263559  0.527173  0.306777  1
  Zr  Zr43  1  0.546129  0.348944  0.333960  1
  Zr  Zr44  1  0.643161  0.541327  0.284420  1
  Zr  Zr45  1  0.597423  0.692908  0.306772  1
  Zr  Zr46  1  0.878827  0.016029  0.333782  1
  Zr  Zr47  1  0.977664  0.209335  0.283328  1
  Zr  Zr48  1  0.929598  0.360888  0.306839  1
  Zr  Zr49  1  0.310590  0.875178  0.283458  1
  Zr  Zr50  1  0.262808  0.026993  0.306831  1
  Zr  Zr51  1  0.545171  0.849393  0.334016  1
  Zr  Zr52  1  0.644331  0.042049  0.282522  1
  Zr  Zr53  1  0.597500  0.193938  0.307267  1
  Zr  Zr54  1  0.931805  0.860494  0.307125  1
  Zr  Zr55  1  0.070656  0.771708  0.319272  1
  Zr  Zr56  1  0.739998  0.604474  0.320135  1
  Zr  Zr57  1  0.834462  0.796574  0.271833  1
  Zr  Zr58  1  0.071560  0.272508  0.321360  1
  Zr  Zr59  1  0.021328  0.425893  0.346435  1
  Zr  Zr60  1  0.120270  0.619335  0.295096  1
  Zr  Zr61  1  0.405728  0.438630  0.321214  1
  Zr  Zr62  1  0.354439  0.592772  0.346377  1
  Zr  Zr63  1  0.453958  0.784919  0.294668  1
  Zr  Zr64  1  0.736487  0.105753  0.320407  1
  Zr  Zr65  1  0.688165  0.259194  0.346369  1
  Zr  Zr66  1  0.787910  0.453222  0.295144  1
  Zr  Zr67  1  0.021260  0.926268  0.346399  1
  Zr  Zr68  1  0.121180  0.118983  0.294560  1
  Zr  Zr69  1  0.404921  0.939007  0.321220  1
  Zr  Zr70  1  0.499660  0.129926  0.271881  1
  Zr  Zr71  1  0.455172  0.283005  0.294218  1
  Zr  Zr72  1  0.788080  0.949732  0.294061  1
  Zr  Zr73  1  0.117812  0.741745  0.384420  1
  Zr  Zr74  1  0.784815  0.574929  0.384882  1
  Zr  Zr75  1  0.737054  0.729283  0.410109  1
  Zr  Zr76  1  0.117940  0.241935  0.385333  1
  Zr  Zr77  1  0.070249  0.396131  0.410494  1
  Zr  Zr78  1  0.165634  0.586977  0.358158  1
  Zr  Zr79  1  0.451421  0.408382  0.385295  1
  Zr  Zr80  1  0.403387  0.562876  0.410397  1
  Zr  Zr81  1  0.499387  0.753018  0.358323  1
  Zr  Zr82  1  0.784495  0.075130  0.384951  1
  Zr  Zr83  1  0.737011  0.229489  0.410404  1
  Zr  Zr84  1  0.831866  0.420217  0.358192  1
  Zr  Zr85  1  0.070600  0.896093  0.410171  1
  Zr  Zr86  1  0.165507  0.086547  0.358209  1
  Zr  Zr87  1  0.451125  0.908428  0.385260  1
  Zr  Zr88  1  0.403681  0.062764  0.410169  1
  Zr  Zr89  1  0.498704  0.253361  0.358829  1
  Zr  Zr90  1  0.832206  0.919996  0.358619  1
  Zr  Zr91  1  0.880008  0.640153  0.423144  1
  Zr  Zr92  1  0.546564  0.473761  0.423372  1
  Zr  Zr93  1  0.641837  0.663996  0.371373  1
  Zr  Zr94  1  0.022205  0.177122  0.345580  1
  Zr  Zr95  1  0.974448  0.330924  0.371723  1
  Zr  Zr96  1  0.927215  0.485446  0.397764  1
  Zr  Zr97  1  0.356479  0.343331  0.345610  1
  Zr  Zr98  1  0.307961  0.497407  0.371555  1
  Zr  Zr99  1  0.260364  0.652411  0.397528  1
  Zr  Zr100  1  0.689950  0.009698  0.345497  1
  Zr  Zr101  1  0.641773  0.164095  0.372074  1
  Zr  Zr102  1  0.593953  0.318788  0.397859  1
  Zr  Zr103  1  0.975529  0.830750  0.371887  1
  Zr  Zr104  1  0.927191  0.985633  0.397660  1
  Zr  Zr105  1  0.355484  0.843436  0.345526  1
  Zr  Zr106  1  0.308114  0.997791  0.371635  1
  Zr  Zr107  1  0.260856  0.151972  0.397479  1
  Zr  Zr108  1  0.594203  0.818628  0.397584  1
  Zr  Zr109  1  0.070397  0.646106  0.410295  1
  Zr  Zr110  1  0.737025  0.479530  0.410460  1
  Zr  Zr111  1  0.832550  0.669737  0.358387  1
  Zr  Zr112  1  0.070405  0.146248  0.410043  1
  Zr  Zr113  1  0.166068  0.337394  0.358882  1
  Zr  Zr114  1  0.117863  0.491429  0.384665  1
  Zr  Zr115  1  0.403615  0.312963  0.410372  1
  Zr  Zr116  1  0.499054  0.503983  0.358800  1
  Zr  Zr117  1  0.451144  0.658191  0.384615  1
  Zr  Zr118  1  0.737075  0.979518  0.410236  1
  Zr  Zr119  1  0.832377  0.170582  0.358469  1
  Zr  Zr120  1  0.783957  0.325067  0.384535  1
  Zr  Zr121  1  0.165743  0.836766  0.357880  1
  Zr  Zr122  1  0.117352  0.991889  0.384496  1
  Zr  Zr123  1  0.403792  0.812698  0.410002  1
  Zr  Zr124  1  0.499440  0.003611  0.358855  1
  Zr  Zr125  1  0.450768  0.158205  0.384948  1
  Zr  Zr126  1  0.784243  0.825003  0.385024  1
  Zr  Zr127  1  0.927267  0.735479  0.397770  1
  Zr  Zr128  1  0.593911  0.569105  0.397821  1
  Zr  Zr129  1  0.689248  0.759690  0.345582  1
  Zr  Zr130  1  0.927242  0.235718  0.397451  1
  Zr  Zr131  1  0.879419  0.390249  0.423064  1
  Zr  Zr132  1  0.975333  0.580651  0.371607  1
  Zr  Zr133  1  0.260946  0.402262  0.397586  1
  Zr  Zr134  1  0.212944  0.556909  0.422959  1
  Zr  Zr135  1  0.308522  0.747670  0.371254  1
  Zr  Zr136  1  0.594351  0.068721  0.397608  1
  Zr  Zr137  1  0.546283  0.223501  0.423326  1
  Zr  Zr138  1  0.641732  0.414325  0.372005  1
  Zr  Zr139  1  0.879879  0.890181  0.423167  1
  Zr  Zr140  1  0.975119  0.081287  0.371709  1
  Zr  Zr141  1  0.260596  0.902224  0.397368  1
  Zr  Zr142  1  0.356082  0.092775  0.345320  1
  Zr  Zr143  1  0.308374  0.247974  0.372064  1
  Zr  Zr144  1  0.641854  0.914419  0.371993  1
  Zr  Zr145  1  0.975039  0.705414  0.461907  1
  Zr  Zr146  1  0.641706  0.538948  0.461981  1
  Zr  Zr147  1  0.593983  0.693433  0.487557  1
  Zr  Zr148  1  0.975034  0.205500  0.461674  1
  Zr  Zr149  1  0.927076  0.360257  0.487598  1
  Zr  Zr150  1  0.022512  0.550823  0.436101  1
  Zr  Zr151  1  0.308377  0.372280  0.461910  1
  Zr  Zr152  1  0.260523  0.526863  0.487492  1
  Zr  Zr153  1  0.355799  0.717608  0.435889  1
  Zr  Zr154  1  0.641844  0.038702  0.461899  1
  Zr  Zr155  1  0.593934  0.193395  0.487679  1
  Zr  Zr156  1  0.689086  0.384243  0.436229  1
  Zr  Zr157  1  0.927393  0.860034  0.487541  1
  Zr  Zr158  1  0.022419  0.050988  0.435990  1
  Zr  Zr159  1  0.308383  0.872059  0.461590  1
  Zr  Zr160  1  0.260545  0.026771  0.487453  1
  Zr  Zr161  1  0.355747  0.217577  0.436211  1
  Zr  Zr162  1  0.689171  0.884207  0.436218  1
  Zr  Zr163  1  0.736920  0.604184  0.500528  1
  Zr  Zr164  1  0.403525  0.437554  0.500524  1
  Zr  Zr165  1  0.498590  0.628256  0.449006  1
  Zr  Zr166  1  0.879739  0.140356  0.423116  1
  Zr  Zr167  1  0.831926  0.294927  0.448901  1
  Zr  Zr168  1  0.784416  0.449544  0.474759  1
  Zr  Zr169  1  0.213120  0.307134  0.423471  1
  Zr  Zr170  1  0.165336  0.461557  0.448965  1
  Zr  Zr171  1  0.117741  0.616121  0.474603  1
  Zr  Zr172  1  0.546518  0.973599  0.423409  1
  Zr  Zr173  1  0.498794  0.128037  0.449033  1
  Zr  Zr174  1  0.451095  0.282819  0.474789  1
  Zr  Zr175  1  0.832095  0.794747  0.449053  1
  Zr  Zr176  1  0.784569  0.949367  0.474667  1
  Zr  Zr177  1  0.213100  0.806846  0.422791  1
  Zr  Zr178  1  0.165329  0.961528  0.448785  1
  Zr  Zr179  1  0.117772  0.116098  0.474512  1
  Zr  Zr180  1  0.451188  0.782682  0.474552  1
  Zr  Zr181  1  0.927377  0.610145  0.487621  1
  Zr  Zr182  1  0.593987  0.443611  0.487717  1
  Zr  Zr183  1  0.689282  0.634295  0.436101  1
  Zr  Zr184  1  0.927274  0.110143  0.487450  1
  Zr  Zr185  1  0.022269  0.301066  0.436249  1
  Zr  Zr186  1  0.974815  0.455456  0.461907  1
  Zr  Zr187  1  0.260596  0.276901  0.487667  1
  Zr  Zr188  1  0.355718  0.467714  0.436188  1
  Zr  Zr189  1  0.308082  0.622184  0.461742  1
  Zr  Zr190  1  0.594072  0.943381  0.487660  1
  Zr  Zr191  1  0.689179  0.134182  0.436285  1
  Zr  Zr192  1  0.641616  0.288742  0.461947  1
  Zr  Zr193  1  0.022644  0.800819  0.436101  1
  Zr  Zr194  1  0.975043  0.955392  0.461747  1
  Zr  Zr195  1  0.260623  0.776812  0.487342  1
  Zr  Zr196  1  0.355691  0.967663  0.436131  1
  Zr  Zr197  1  0.308382  0.121983  0.461689  1
  Zr  Zr198  1  0.641768  0.788596  0.461764  1
  Zr  Zr199  1  0.784609  0.699414  0.474683  1
  Zr  Zr200  1  0.451117  0.532914  0.474767  1
  Zr  Zr201  1  0.546516  0.723350  0.423026  1
  Zr  Zr202  1  0.784521  0.199468  0.474662  1
  Zr  Zr203  1  0.736753  0.354174  0.500449  1
  Zr  Zr204  1  0.832082  0.544924  0.449097  1
  Zr  Zr205  1  0.117711  0.366278  0.474851  1
  Zr  Zr206  1  0.070072  0.520748  0.500423  1
  Zr  Zr207  1  0.165298  0.711590  0.448843  1
  Zr  Zr208  1  0.451226  0.032748  0.474708  1
  Zr  Zr209  1  0.403518  0.187358  0.500412  1
  Zr  Zr210  1  0.498779  0.378260  0.449204  1
  Zr  Zr211  1  0.736870  0.853947  0.500445  1
  Zr  Zr212  1  0.832096  0.044831  0.449012  1
  Zr  Zr213  1  0.117957  0.866090  0.474483  1
  Zr  Zr214  1  0.212823  0.056888  0.423007  1
  Zr  Zr215  1  0.165496  0.211472  0.449033  1
  Zr  Zr216  1  0.498816  0.878036  0.449055  1
  Zr  Zr217  1  0.832143  0.669460  0.539146  1
  Zr  Zr218  1  0.498655  0.502873  0.539177  1
  Zr  Zr219  1  0.451158  0.657186  0.564676  1
  Zr  Zr220  1  0.832001  0.169409  0.538887  1
  Zr  Zr221  1  0.784528  0.324011  0.564557  1
  Zr  Zr222  1  0.879659  0.514793  0.513396  1
  Zr  Zr223  1  0.165174  0.336232  0.539139  1
  Zr  Zr224  1  0.117681  0.490622  0.564751  1
  Zr  Zr225  1  0.212848  0.681423  0.513159  1
  Zr  Zr226  1  0.498866  1.002680  0.539053  1
  Zr  Zr227  1  0.451422  0.157167  0.564656  1
  Zr  Zr228  1  0.546391  0.348085  0.513381  1
  Zr  Zr229  1  0.784528  0.823841  0.564808  1
  Zr  Zr230  1  0.879687  0.014636  0.513212  1
  Zr  Zr231  1  0.165422  0.836163  0.538824  1
  Zr  Zr232  1  0.117867  0.990611  0.564516  1
  Zr  Zr233  1  0.213076  0.181313  0.513138  1
  Zr  Zr234  1  0.546386  0.847932  0.513287  1
  Zr  Zr235  1  0.593953  0.568051  0.577803  1
  Zr  Zr236  1  0.260582  0.401388  0.577704  1
  Zr  Zr237  1  0.355723  0.592088  0.526147  1
  Zr  Zr238  1  0.736893  0.104049  0.500478  1
  Zr  Zr239  1  0.689165  0.258684  0.526155  1
  Zr  Zr240  1  0.641516  0.413485  0.551948  1
  Zr  Zr241  1  0.070144  0.270832  0.500423  1
  Zr  Zr242  1  0.022312  0.425513  0.526307  1
  Zr  Zr243  1  0.974980  0.579967  0.551928  1
  Zr  Zr244  1  0.403555  0.937386  0.500404  1
  Zr  Zr245  1  0.355919  0.091970  0.526031  1
  Zr  Zr246  1  0.308212  0.246724  0.551772  1
  Zr  Zr247  1  0.689164  0.758674  0.526201  1
  Zr  Zr248  1  0.641684  0.913179  0.551871  1
  Zr  Zr249  1  0.070213  0.770780  0.500375  1
  Zr  Zr250  1  0.022538  0.925333  0.526029  1
  Zr  Zr251  1  0.974849  0.079988  0.551631  1
  Zr  Zr252  1  0.308167  0.746719  0.551630  1
  Zr  Zr253  1  0.784547  0.573964  0.564881  1
  Zr  Zr254  1  0.451244  0.407286  0.564791  1
  Zr  Zr255  1  0.546366  0.598129  0.513354  1
  Zr  Zr256  1  0.784549  0.073925  0.564710  1
  Zr  Zr257  1  0.879721  0.264762  0.513153  1
  Zr  Zr258  1  0.831828  0.419597  0.539153  1
  Zr  Zr259  1  0.117965  0.240539  0.564568  1
  Zr  Zr260  1  0.212991  0.431502  0.513318  1
  Zr  Zr261  1  0.165183  0.586060  0.538912  1
  Zr  Zr262  1  0.451210  0.907253  0.564782  1
  Zr  Zr263  1  0.546559  0.097955  0.513361  1
  Zr  Zr264  1  0.498664  0.252691  0.539140  1
  Zr  Zr265  1  0.879782  0.764683  0.513405  1
  Zr  Zr266  1  0.832079  0.919220  0.538965  1
  Zr  Zr267  1  0.117727  0.740758  0.564663  1
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  Zr  Zr281  1  0.260632  0.151125  0.577380  1
  Zr  Zr282  1  0.355839  0.342152  0.526255  1
  Zr  Zr283  1  0.593774  0.817913  0.577752  1
  Zr  Zr284  1  0.689305  0.008636  0.526238  1
  Zr  Zr285  1  0.975101  0.829925  0.551896  1
  Zr  Zr286  1  0.070119  0.020734  0.500241  1
  Zr  Zr287  1  0.022559  0.175364  0.526001  1
  Zr  Zr288  1  0.355879  0.842074  0.526068  1
  Zr  Zr289  1  0.689258  0.633243  0.616126  1
  Zr  Zr290  1  0.356134  0.466511  0.616028  1
  Zr  Zr291  1  0.307729  0.621351  0.642009  1
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  Zr  Zr293  1  0.641308  0.287594  0.642345  1
  Zr  Zr294  1  0.736448  0.478844  0.590851  1
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  Zr  Zr297  1  0.069808  0.645412  0.590532  1
  Zr  Zr298  1  0.355958  0.966821  0.616087  1
  Zr  Zr299  1  0.307725  0.120837  0.641965  1
  Zr  Zr300  1  0.403321  0.311941  0.590699  1
  Zr  Zr301  1  0.640955  0.787957  0.642591  1
  Zr  Zr302  1  0.736733  0.978534  0.590512  1
  Zr  Zr303  1  0.022775  0.799995  0.616400  1
  Zr  Zr304  1  0.974506  0.954179  0.642132  1
  Zr  Zr305  1  0.070080  0.145269  0.590445  1
  Zr  Zr306  1  0.403286  0.812118  0.590589  1
  Zr  Zr307  1  0.450753  0.532022  0.655522  1
  Zr  Zr308  1  0.117803  0.364994  0.655297  1
  Zr  Zr309  1  0.212996  0.555862  0.603059  1
  Zr  Zr310  1  0.594272  0.067871  0.577888  1
  Zr  Zr311  1  0.546361  0.222545  0.603449  1
  Zr  Zr312  1  0.498560  0.376921  0.629003  1
  Zr  Zr313  1  0.927327  0.234573  0.577433  1
  Zr  Zr314  1  0.879528  0.389557  0.603347  1
  Zr  Zr315  1  0.831705  0.543932  0.629460  1
  Zr  Zr316  1  0.260639  0.901474  0.577604  1
  Zr  Zr317  1  0.212728  0.056039  0.603168  1
  Zr  Zr318  1  0.165539  0.210237  0.628792  1
  Zr  Zr319  1  0.546152  0.722681  0.603253  1
  Zr  Zr320  1  0.498510  0.877167  0.629363  1
  Zr  Zr321  1  0.927329  0.734743  0.578036  1
  Zr  Zr322  1  0.879909  0.888979  0.603153  1
  Zr  Zr323  1  0.831914  0.043817  0.628938  1
  Zr  Zr324  1  0.164837  0.710777  0.628863  1
  Zr  Zr325  1  0.640932  0.538370  0.642582  1
  Zr  Zr326  1  0.308004  0.371484  0.642240  1
  Zr  Zr327  1  0.403397  0.562044  0.590702  1
  Zr  Zr328  1  0.641890  0.037840  0.642735  1
  Zr  Zr329  1  0.736574  0.228648  0.590412  1
  Zr  Zr330  1  0.689307  0.383052  0.615881  1
  Zr  Zr331  1  0.974957  0.204723  0.641948  1
  Zr  Zr332  1  0.069747  0.395506  0.590800  1
  Zr  Zr333  1  0.022568  0.549726  0.616295  1
  Zr  Zr334  1  0.307973  0.871830  0.642265  1
  Zr  Zr335  1  0.403496  0.062054  0.590378  1
  Zr  Zr336  1  0.355849  0.216373  0.615577  1
  Zr  Zr337  1  0.736610  0.728832  0.590623  1
  Zr  Zr338  1  0.688882  0.883017  0.616089  1
  Zr  Zr339  1  0.974946  0.704841  0.642908  1
  Zr  Zr340  1  0.070151  0.895449  0.590356  1
  Zr  Zr341  1  0.022166  0.049902  0.615523  1
  Zr  Zr342  1  0.355612  0.716556  0.615505  1
  Zr  Zr343  1  0.498655  0.627268  0.629270  1
  Zr  Zr344  1  0.164952  0.460566  0.629086  1
  Zr  Zr345  1  0.260255  0.651254  0.577490  1
  Zr  Zr346  1  0.499279  0.127258  0.629173  1
  Zr  Zr347  1  0.451085  0.281450  0.655396  1
  Zr  Zr348  1  0.546150  0.472811  0.603465  1
  Zr  Zr349  1  0.831848  0.293926  0.628647  1
  Zr  Zr350  1  0.784437  0.448360  0.655357  1
  Zr  Zr351  1  0.880029  0.639231  0.603268  1
  Zr  Zr352  1  0.165483  0.961008  0.629087  1
  Zr  Zr353  1  0.117307  0.114956  0.655221  1
  Zr  Zr354  1  0.212829  0.306111  0.603273  1
  Zr  Zr355  1  0.451095  0.781459  0.655112  1
  Zr  Zr356  1  0.546582  0.972559  0.603193  1
  Zr  Zr357  1  0.832045  0.794190  0.629494  1
  Zr  Zr358  1  0.927098  0.984444  0.577535  1
  Zr  Zr359  1  0.879618  0.139371  0.602992  1
  Zr  Zr360  1  0.212976  0.806217  0.602950  1
  Zr  Zr361  1  0.543488  0.598250  0.694009  1
  Zr  Zr362  1  0.209450  0.431134  0.693799  1
  Zr  Zr363  1  0.164488  0.583263  0.717411  1
  Zr  Zr364  1  0.544147  0.097305  0.694036  1
  Zr  Zr365  1  0.495494  0.249527  0.717498  1
  Zr  Zr366  1  0.595084  0.441938  0.667028  1
  Zr  Zr367  1  0.875964  0.263814  0.693431  1
  Zr  Zr368  1  0.830339  0.416102  0.718279  1
  Zr  Zr369  1  0.928427  0.608205  0.667680  1
  Zr  Zr370  1  0.209617  0.931676  0.693791  1
  Zr  Zr371  1  0.161568  0.083079  0.717422  1
  Zr  Zr372  1  0.262130  0.275505  0.666950  1
  Zr  Zr373  1  0.495892  0.749816  0.717334  1
  Zr  Zr374  1  0.594456  0.941778  0.667647  1
  Zr  Zr375  1  0.876453  0.764522  0.694270  1
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  Zr  Zr377  1  0.927501  0.109273  0.666917  1
  Zr  Zr378  1  0.260693  0.775861  0.666716  1
  Zr  Zr379  1  0.306427  0.495611  0.729000  1
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  Zr  Zr422  1  0.640131  0.410916  0.729091  1
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  Zr  Zr430  1  0.785863  0.948047  0.654323  1
  Zr  Zr431  1  0.736720  0.102736  0.681375  1
  Zr  Zr432  1  0.069693  0.769944  0.681504  1
