# generated using pymatgen
data_Li5BO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.59244400
_cell_length_b   8.70293600
_cell_length_c   8.94575000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li5BO4
_chemical_formula_sum   'Li40 B8 O32'
_cell_volume   668.95862460
_cell_formula_units_Z   8
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
  Li  Li0  1  0.40729600  0.17719600  0.12927900  1
  Li  Li1  1  0.90729600  0.17719600  0.37072100  1
  Li  Li2  1  0.56939300  0.08723600  0.59674100  1
  Li  Li3  1  0.06939300  0.08723600  0.90325900  1
  Li  Li4  1  0.36575300  0.14445600  0.85870900  1
  Li  Li5  1  0.86575300  0.14445600  0.64129100  1
  Li  Li6  1  0.18593900  0.12366100  0.40929900  1
  Li  Li7  1  0.68593900  0.12366100  0.09070100  1
  Li  Li8  1  0.14013400  0.08283200  0.65377900  1
  Li  Li9  1  0.64013400  0.08283200  0.84622100  1
  Li  Li10  1  0.14013400  0.41716800  0.15377900  1
  Li  Li11  1  0.64013400  0.41716800  0.34622100  1
  Li  Li12  1  0.18593900  0.37633900  0.90929900  1
  Li  Li13  1  0.68593900  0.37633900  0.59070100  1
  Li  Li14  1  0.36575300  0.35554400  0.35870900  1
  Li  Li15  1  0.86575300  0.35554400  0.14129100  1
  Li  Li16  1  0.06939300  0.41276400  0.40325900  1
  Li  Li17  1  0.56939300  0.41276400  0.09674100  1
  Li  Li18  1  0.90729600  0.32280400  0.87072100  1
  Li  Li19  1  0.40729600  0.32280400  0.62927900  1
  Li  Li20  1  0.09270400  0.67719600  0.12927900  1
  Li  Li21  1  0.59270400  0.67719600  0.37072100  1
  Li  Li22  1  0.93060700  0.58723600  0.59674100  1
  Li  Li23  1  0.43060700  0.58723600  0.90325900  1
  Li  Li24  1  0.63424700  0.64445600  0.64129100  1
  Li  Li25  1  0.13424700  0.64445600  0.85870900  1
  Li  Li26  1  0.31406100  0.62366100  0.40929900  1
  Li  Li27  1  0.81406100  0.62366100  0.09070100  1
  Li  Li28  1  0.35986600  0.58283200  0.65377900  1
  Li  Li29  1  0.85986600  0.58283200  0.84622100  1
  Li  Li30  1  0.35986600  0.91716800  0.15377900  1
  Li  Li31  1  0.85986600  0.91716800  0.34622100  1
  Li  Li32  1  0.31406100  0.87633900  0.90929900  1
  Li  Li33  1  0.81406100  0.87633900  0.59070100  1
  Li  Li34  1  0.63424700  0.85554400  0.14129100  1
  Li  Li35  1  0.13424700  0.85554400  0.35870900  1
  Li  Li36  1  0.93060700  0.91276400  0.09674100  1
  Li  Li37  1  0.43060700  0.91276400  0.40325900  1
  Li  Li38  1  0.09270400  0.82280400  0.62927900  1
  Li  Li39  1  0.59270400  0.82280400  0.87072100  1
  B  B40  1  0.13304500  0.14377600  0.14237800  1
  B  B41  1  0.63304500  0.14377600  0.35762200  1
  B  B42  1  0.13304500  0.35622400  0.64237800  1
  B  B43  1  0.63304500  0.35622400  0.85762200  1
  B  B44  1  0.36695500  0.64377600  0.14237800  1
  B  B45  1  0.86695500  0.64377600  0.35762200  1
  B  B46  1  0.36695500  0.85622400  0.64237800  1
  B  B47  1  0.86695500  0.85622400  0.85762200  1
  O  O48  1  0.03895400  0.03539100  0.24253600  1
  O  O49  1  0.53895400  0.03539100  0.25746400  1
  O  O50  1  0.24074700  0.05266400  0.03467300  1
  O  O51  1  0.74074700  0.05266400  0.46532700  1
  O  O52  1  0.22869400  0.24472000  0.24154800  1
  O  O53  1  0.72869400  0.24472000  0.25845200  1
  O  O54  1  0.53389600  0.25124100  0.95684200  1
  O  O55  1  0.03389600  0.25124100  0.54315800  1
  O  O56  1  0.03389600  0.24875900  0.04315800  1
  O  O57  1  0.53389600  0.24875900  0.45684200  1
  O  O58  1  0.22869400  0.25528000  0.74154800  1
  O  O59  1  0.72869400  0.25528000  0.75845200  1
  O  O60  1  0.24074700  0.44733600  0.53467300  1
  O  O61  1  0.74074700  0.44733600  0.96532700  1
  O  O62  1  0.53895400  0.46460900  0.75746400  1
  O  O63  1  0.03895400  0.46460900  0.74253600  1
  O  O64  1  0.46104600  0.53539100  0.24253600  1
  O  O65  1  0.96104600  0.53539100  0.25746400  1
  O  O66  1  0.25925300  0.55266400  0.03467300  1
  O  O67  1  0.75925300  0.55266400  0.46532700  1
  O  O68  1  0.27130600  0.74472000  0.24154800  1
  O  O69  1  0.77130600  0.74472000  0.25845200  1
  O  O70  1  0.46610400  0.75124100  0.54315800  1
  O  O71  1  0.96610400  0.75124100  0.95684200  1
  O  O72  1  0.96610400  0.74875900  0.45684200  1
  O  O73  1  0.46610400  0.74875900  0.04315800  1
  O  O74  1  0.27130600  0.75528000  0.74154800  1
  O  O75  1  0.77130600  0.75528000  0.75845200  1
  O  O76  1  0.25925300  0.94733600  0.53467300  1
  O  O77  1  0.75925300  0.94733600  0.96532700  1
  O  O78  1  0.46104600  0.96460900  0.74253600  1
  O  O79  1  0.96104600  0.96460900  0.75746400  1
