# generated using pymatgen
data_Mo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.09896387
_cell_length_b   12.93037837
_cell_length_c   50.85419073
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mo
_chemical_formula_sum   Mo72
_cell_volume   2695.33078253
_cell_formula_units_Z   72
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
  Mo  Mo1  1  0.502474  0.255386  0.318634  1
  Mo  Mo2  1  0.502474  0.952914  0.295001  1
  Mo  Mo3  1  0.502474  0.661496  0.273242  1
  Mo  Mo4  1  0.002474  0.105080  0.306025  1
  Mo  Mo5  1  0.002474  0.804841  0.282974  1
  Mo  Mo6  1  0.002474  0.407254  0.332257  1
  Mo  Mo7  1  0.002474  0.308938  0.285387  1
  Mo  Mo8  1  0.002474  0.908246  0.332067  1
  Mo  Mo9  1  0.002474  0.605442  0.306374  1
  Mo  Mo10  1  0.502474  0.056653  0.344290  1
  Mo  Mo11  1  0.502474  0.758240  0.320137  1
  Mo  Mo12  1  0.502474  0.455728  0.293845  1
  Mo  Mo13  1  0.502474  0.155668  0.396025  1
  Mo  Mo14  1  0.502474  0.857326  0.370921  1
  Mo  Mo15  1  0.502474  0.556705  0.344641  1
  Mo  Mo16  1  0.002474  0.006729  0.383438  1
  Mo  Mo17  1  0.002474  0.706677  0.357952  1
  Mo  Mo18  1  0.002474  0.305022  0.408935  1
  Mo  Mo19  1  0.002474  0.205871  0.356925  1
  Mo  Mo20  1  0.002474  0.805945  0.409414  1
  Mo  Mo21  1  0.002474  0.506108  0.383516  1
  Mo  Mo22  1  0.502474  0.955773  0.422252  1
  Mo  Mo23  1  0.502474  0.655926  0.396415  1
  Mo  Mo24  1  0.502474  0.355705  0.370391  1
  Mo  Mo25  1  0.502474  0.054359  0.473734  1
  Mo  Mo26  1  0.502474  0.754958  0.448016  1
  Mo  Mo27  1  0.502474  0.455026  0.422040  1
  Mo  Mo28  1  0.002474  0.904733  0.460925  1
  Mo  Mo29  1  0.002474  0.605093  0.435061  1
  Mo  Mo30  1  0.002474  0.203900  0.486509  1
  Mo  Mo31  1  0.002474  0.105173  0.434956  1
  Mo  Mo32  1  0.002474  0.704096  0.486672  1
  Mo  Mo33  1  0.002474  0.404251  0.460658  1
  Mo  Mo34  1  0.502474  0.853883  0.499618  1
  Mo  Mo35  1  0.502474  0.554173  0.473672  1
  Mo  Mo36  1  0.502474  0.254565  0.447728  1
  Mo  Mo37  1  0.502474  0.952846  0.551250  1
  Mo  Mo38  1  0.502474  0.653238  0.525306  1
  Mo  Mo39  1  0.502474  0.353528  0.499360  1
  Mo  Mo40  1  0.002474  0.803160  0.538320  1
  Mo  Mo41  1  0.002474  0.503316  0.512305  1
  Mo  Mo42  1  0.002474  0.102238  0.564022  1
  Mo  Mo43  1  0.002474  1.003511  0.512469  1
  Mo  Mo44  1  0.002474  0.602318  0.563917  1
  Mo  Mo45  1  0.002474  0.302678  0.538052  1
  Mo  Mo46  1  0.502474  0.752385  0.576938  1
  Mo  Mo47  1  0.502474  0.452453  0.550962  1
  Mo  Mo48  1  0.502474  0.153052  0.525244  1
  Mo  Mo49  1  0.502474  0.851707  0.628587  1
  Mo  Mo50  1  0.502474  0.551485  0.602563  1
  Mo  Mo51  1  0.502474  0.251638  0.576726  1
  Mo  Mo52  1  0.002474  0.701303  0.615462  1
  Mo  Mo53  1  0.002474  0.401466  0.589564  1
  Mo  Mo54  1  0.002474  1.001540  0.642053  1
  Mo  Mo55  1  0.002474  0.902389  0.590043  1
  Mo  Mo56  1  0.002474  0.500734  0.641026  1
  Mo  Mo57  1  0.002474  0.200682  0.615540  1
  Mo  Mo58  1  0.502474  0.650706  0.654337  1
  Mo  Mo59  1  0.502474  0.350085  0.628057  1
  Mo  Mo60  1  0.502474  0.051743  0.602953  1
  Mo  Mo61  1  0.502474  0.751683  0.705132  1
  Mo  Mo62  1  0.502474  0.449171  0.678841  1
  Mo  Mo63  1  0.502474  0.150758  0.654687  1
  Mo  Mo64  1  0.002474  0.601969  0.692604  1
  Mo  Mo65  1  0.002474  0.299165  0.666911  1
  Mo  Mo66  1  0.002474  0.898473  0.713590  1
  Mo  Mo67  1  0.002474  0.800157  0.666720  1
  Mo  Mo68  1  0.002474  0.402570  0.716004  1
  Mo  Mo69  1  0.002474  0.102331  0.692953  1
  Mo  Mo70  1  0.502474  0.545915  0.725736  1
  Mo  Mo71  1  0.502474  0.254497  0.703977  1
  Mo  Mo72  1  0.502474  0.952025  0.680343  1
