# generated using pymatgen
data_V
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.94009166
_cell_length_b   9.74471620
_cell_length_c   52.04288548
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   102.92096638
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V
_chemical_formula_sum   V96
_cell_volume   2936.19917289
_cell_formula_units_Z   96
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
  V  V1  1  0.653383  0.153256  0.283490  1
  V  V2  1  0.369911  0.570909  0.248539  1
  V  V3  1  0.508496  0.864493  0.263725  1
  V  V4  1  0.367376  1.070795  0.248699  1
  V  V5  1  0.509330  0.364452  0.263585  1
  V  V6  1  0.656174  0.653099  0.283366  1
  V  V7  1  0.867376  1.070795  0.248699  1
  V  V8  1  0.009330  0.364452  0.263585  1
  V  V9  1  0.156174  0.653099  0.283366  1
  V  V10  1  0.153383  0.153256  0.283490  1
  V  V11  1  0.869911  0.570909  0.248539  1
  V  V12  1  0.008496  0.864493  0.263725  1
  V  V13  1  0.115610  1.045193  0.338872  1
  V  V14  1  0.818423  0.446235  0.300709  1
  V  V15  1  0.964080  0.748381  0.319554  1
  V  V16  1  0.817536  0.946314  0.300899  1
  V  V17  1  0.961082  0.248751  0.319534  1
  V  V18  1  0.120444  0.544867  0.338634  1
  V  V19  1  0.317536  0.946314  0.300899  1
  V  V20  1  0.461082  0.248751  0.319534  1
  V  V21  1  0.620444  0.544867  0.338634  1
  V  V22  1  0.615610  1.045193  0.338872  1
  V  V23  1  0.318423  0.446235  0.300709  1
  V  V24  1  0.464080  0.748381  0.319554  1
  V  V25  1  0.564586  0.943270  0.394627  1
  V  V26  1  0.265287  0.346572  0.357134  1
  V  V27  1  0.424833  0.642750  0.375648  1
  V  V28  1  0.265458  0.846447  0.357201  1
  V  V29  1  0.407659  0.147643  0.375806  1
  V  V30  1  0.582288  0.439215  0.394240  1
  V  V31  1  0.765458  0.846447  0.357201  1
  V  V32  1  0.907659  0.147643  0.375806  1
  V  V33  1  0.082288  0.439215  0.394240  1
  V  V34  1  0.064586  0.943270  0.394627  1
  V  V35  1  0.765287  0.346572  0.357134  1
  V  V36  1  0.924833  0.642750  0.375648  1
  V  V37  1  0.019127  0.838556  0.450486  1
  V  V38  1  0.722276  0.240957  0.413063  1
  V  V39  1  0.881622  0.537814  0.431698  1
  V  V40  1  0.722004  0.740948  0.413126  1
  V  V41  1  0.861468  1.042770  0.431965  1
  V  V42  1  0.039796  0.333910  0.450191  1
  V  V43  1  0.222004  0.740948  0.413126  1
  V  V44  1  0.361468  1.042770  0.431965  1
  V  V45  1  0.539796  0.333910  0.450191  1
  V  V46  1  0.519127  0.838556  0.450486  1
  V  V47  1  0.222276  0.240957  0.413063  1
  V  V48  1  0.381622  0.537814  0.431698  1
  V  V49  1  0.474749  0.733486  0.506416  1
  V  V50  1  0.178988  0.135735  0.469067  1
  V  V51  1  0.337049  0.432661  0.487713  1
  V  V52  1  0.177897  0.635631  0.469050  1
  V  V53  1  0.318609  0.937268  0.487894  1
  V  V54  1  0.494963  0.228890  0.506310  1
  V  V55  1  0.677897  0.635631  0.469050  1
  V  V56  1  0.818609  0.937268  0.487894  1
  V  V57  1  0.994963  0.228890  0.506310  1
  V  V58  1  0.974749  0.733486  0.506416  1
  V  V59  1  0.678988  0.135735  0.469067  1
  V  V60  1  0.837049  0.432661  0.487713  1
  V  V61  1  0.929804  0.628408  0.562451  1
  V  V62  1  0.636812  1.030379  0.524840  1
  V  V63  1  0.790218  0.328234  0.543855  1
  V  V64  1  0.632272  0.530557  0.524996  1
  V  V65  1  0.777501  0.831942  0.543728  1
  V  V66  1  0.946427  1.125498  0.562603  1
  V  V67  1  0.132272  0.530557  0.524996  1
  V  V68  1  0.277501  0.831942  0.543728  1
  V  V69  1  0.446427  1.125498  0.562603  1
  V  V70  1  0.429804  0.628408  0.562451  1
  V  V71  1  0.136812  1.030379  0.524840  1
  V  V72  1  0.290218  0.328234  0.543855  1
  V  V73  1  0.376839  0.525667  0.619110  1
  V  V74  1  0.093652  0.927603  0.580192  1
  V  V75  1  0.245854  0.223069  0.600125  1
  V  V76  1  0.082498  0.426038  0.581198  1
  V  V77  1  0.241975  0.720731  0.598885  1
  V  V78  1  0.402378  1.023055  0.619669  1
  V  V79  1  0.582498  0.426038  0.581198  1
  V  V80  1  0.741975  0.720731  0.598885  1
  V  V81  1  0.902378  1.023055  0.619669  1
  V  V82  1  0.876839  0.525667  0.619110  1
  V  V83  1  0.593652  0.927603  0.580192  1
  V  V84  1  0.745854  0.223069  0.600125  1
  V  V85  1  0.820052  0.403394  0.671095  1
  V  V86  1  0.554513  0.819891  0.633583  1
  V  V87  1  0.705634  1.105557  0.655876  1
  V  V88  1  0.540260  0.322599  0.637102  1
  V  V89  1  0.659868  0.629555  0.656741  1
  V  V90  1  0.900094  0.886042  0.672287  1
  V  V91  1  0.040260  0.322599  0.637102  1
  V  V92  1  0.159868  0.629555  0.656741  1
  V  V93  1  0.400094  0.886042  0.672287  1
  V  V94  1  0.320052  0.403394  0.671095  1
  V  V95  1  0.054513  0.819891  0.633583  1
  V  V96  1  0.205634  1.105557  0.655876  1
