# generated using pymatgen
data_Li5Fe2P2(CO7)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.38372085
_cell_length_b   10.16137946
_cell_length_c   6.46824441
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   63.43990537
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li5Fe2P2(CO7)2
_chemical_formula_sum   'Li10 Fe4 P4 C4 O28'
_cell_volume   551.66819628
_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  0.89620130  0.44360961  0.75570771  1
  Li  Li1  1  0.89620130  0.94360961  0.74429229  1
  Li  Li2  1  0.71004498  0.26119852  0.93270277  1
  Li  Li3  1  0.71004498  0.76119852  0.56729723  1
  Li  Li4  1  0.26072238  0.23778567  0.50691296  1
  Li  Li5  1  0.26063307  0.23991913  0.99211196  1
  Li  Li6  1  0.26063307  0.73991913  0.50788804  1
  Li  Li7  1  0.26072238  0.73778567  0.99308704  1
  Li  Li8  1  0.10005541  0.06809175  0.25895715  1
  Li  Li9  1  0.10005541  0.56809175  0.24104285  1
  Fe  Fe10  1  0.67356424  0.06144506  0.24968920  1
  Fe  Fe11  1  0.67356424  0.56144506  0.25031080  1
  Fe  Fe12  1  0.33247605  0.43984964  0.75138403  1
  Fe  Fe13  1  0.33247605  0.93984964  0.74861597  1
  P  P14  1  0.58684362  0.06563109  0.74396870  1
  P  P15  1  0.58684362  0.56563109  0.75603130  1
  P  P16  1  0.41952980  0.42042915  0.24485157  1
  P  P17  1  0.41952980  0.92042915  0.25514843  1
  C  C18  1  0.96309841  0.36992150  0.24858718  1
  C  C19  1  0.96309841  0.86992150  0.25141282  1
  C  C20  1  0.03674918  0.14185889  0.76650128  1
  C  C21  1  0.03674918  0.64185889  0.73349872  1
  O  O22  1  0.93083610  0.00876068  0.24300332  1
  O  O23  1  0.93083610  0.50876068  0.25699668  1
  O  O24  1  0.89921789  0.24695800  0.79448515  1
  O  O25  1  0.84071865  0.34239557  0.24388716  1
  O  O26  1  0.89921789  0.74695800  0.70551485  1
  O  O27  1  0.84071865  0.84239557  0.25611284  1
  O  O28  1  0.69611587  0.06008748  0.93128920  1
  O  O29  1  0.68932927  0.06786217  0.55550828  1
  O  O30  1  0.68932927  0.56786217  0.94449172  1
  O  O31  1  0.69611587  0.56008748  0.56871080  1
  O  O32  1  0.57656982  0.27939270  0.21412456  1
  O  O33  1  0.55980230  0.42701284  0.76731249  1
  O  O34  1  0.57656982  0.77939270  0.28587544  1
  O  O35  1  0.55980230  0.92701284  0.73268751  1
  O  O36  1  0.45936364  0.05501697  0.24902260  1
  O  O37  1  0.42430935  0.20344315  0.75679377  1
  O  O38  1  0.45936364  0.55501697  0.25097740  1
  O  O39  1  0.42430935  0.70344315  0.74320623  1
  O  O40  1  0.32125794  0.42108791  0.43751153  1
  O  O41  1  0.29933275  0.44087184  0.06685314  1
  O  O42  1  0.32125794  0.92108791  0.06248847  1
  O  O43  1  0.29933275  0.94087184  0.43314686  1
  O  O44  1  0.16105288  0.17044860  0.74845012  1
  O  O45  1  0.10737894  0.26503659  0.24605428  1
  O  O46  1  0.16105288  0.67044860  0.75154988  1
  O  O47  1  0.10737894  0.76503659  0.25394572  1
  O  O48  1  0.06590816  0.50371350  0.74304696  1
  O  O49  1  0.06590816  0.00371350  0.75695304  1
