# generated using pymatgen
data_Li3BePCO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.15323485
_cell_length_b   4.69490886
_cell_length_c   8.12924223
_cell_angle_alpha   87.26340574
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3BePCO7
_chemical_formula_sum   'Li6 Be2 P2 C2 O14'
_cell_volume   234.57685676
_cell_formula_units_Z   2
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  0.75000000  0.25025875  0.87675017  1
  Li  Li1  1  0.02095613  0.77454095  0.76192676  1
  Li  Li2  1  0.47904387  0.77454095  0.76192676  1
  Li  Li3  1  0.52095613  0.22545905  0.23807324  1
  Li  Li4  1  0.97904387  0.22545905  0.23807324  1
  Li  Li5  1  0.25000000  0.74974125  0.12324983  1
  Be  Be6  1  0.25000000  0.22256967  0.63558135  1
  Be  Be7  1  0.75000000  0.77743033  0.36441865  1
  P  P8  1  0.75000000  0.26784766  0.57263337  1
  P  P9  1  0.25000000  0.73215234  0.42736663  1
  C  C10  1  0.25000000  0.24762787  0.94640213  1
  C  C11  1  0.75000000  0.75237213  0.05359787  1
  O  O12  1  0.25000000  0.97647243  0.92873196  1
  O  O13  1  0.75000000  0.65260589  0.90775100  1
  O  O14  1  0.25000000  0.41854051  0.81686784  1
  O  O15  1  0.94484529  0.18268050  0.68109702  1
  O  O16  1  0.55515471  0.18268050  0.68109702  1
  O  O17  1  0.75000000  0.59235633  0.53571284  1
  O  O18  1  0.25000000  0.87274876  0.59364693  1
  O  O19  1  0.75000000  0.12725124  0.40635307  1
  O  O20  1  0.25000000  0.40764367  0.46428716  1
  O  O21  1  0.44484529  0.81731950  0.31890298  1
  O  O22  1  0.05515471  0.81731950  0.31890298  1
  O  O23  1  0.75000000  0.58145949  0.18313216  1
  O  O24  1  0.25000000  0.34739411  0.09224900  1
  O  O25  1  0.75000000  0.02352757  0.07126804  1
