# generated using pymatgen
data_CrH8(C3O2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.80669364
_cell_length_b   9.06275502
_cell_length_c   9.06275030
_cell_angle_alpha   82.73245209
_cell_angle_beta   75.71529015
_cell_angle_gamma   75.71525744
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrH8(C3O2)2
_chemical_formula_sum   'Cr2 H16 C12 O8'
_cell_volume   369.84903574
_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
  Cr  Cr0  1  0.24999891  0.06684457  0.93315538  1
  Cr  Cr1  1  0.74999969  0.93315504  0.06684561  1
  H  H2  1  0.67736309  0.51555113  0.72757827  1
  H  H3  1  0.82263540  0.27242182  0.48444829  1
  H  H4  1  0.32263697  0.48444919  0.27242161  1
  H  H5  1  0.17736361  0.72757876  0.51555136  1
  H  H6  1  0.29781405  0.60456062  0.78697655  1
  H  H7  1  0.20218443  0.21302369  0.39543963  1
  H  H8  1  0.70218613  0.39544031  0.21302242  1
  H  H9  1  0.79781421  0.78697663  0.60455942  1
  H  H10  1  0.40227398  0.41238557  0.73462659  1
  H  H11  1  0.09772447  0.26537340  0.58761420  1
  H  H12  1  0.59772571  0.58761517  0.26537284  1
  H  H13  1  0.90227509  0.73462697  0.41238492  1
  H  H14  1  0.24691573  0.42179410  0.01518761  1
  H  H15  1  0.25308333  0.98481243  0.57820650  1
  H  H16  1  0.75308293  0.57820632  0.98481187  1
  H  H17  1  0.74691615  0.01518796  0.42179331  1
  C  C18  1  0.67835373  0.28573782  0.97250016  1
  C  C19  1  0.82165109  0.02750006  0.71426010  1
  C  C20  1  0.32165103  0.71426183  0.02749963  1
  C  C21  1  0.17834124  0.97250163  0.28574039  1
  C  C22  1  0.46149655  0.49654359  0.79120453  1
  C  C23  1  0.03850236  0.20879548  0.50345626  1
  C  C24  1  0.53850361  0.50345676  0.20879523  1
  C  C25  1  0.96149622  0.79120488  0.49654348  1
  C  C26  1  0.46633939  0.44055240  0.95686652  1
  C  C27  1  0.03365778  0.04313498  0.55944632  1
  C  C28  1  0.53365824  0.55944669  0.04313423  1
  C  C29  1  0.96634250  0.95686448  0.44055488  1
  O  O30  1  0.56507340  0.17361569  0.04144846  1
  O  O31  1  0.93492243  0.95855037  0.82638805  1
  O  O32  1  0.43492289  0.82638757  0.95855029  1
  O  O33  1  0.06507817  0.04145147  0.17360911  1
  O  O34  1  0.95146618  0.27510259  0.91777169  1
  O  O35  1  0.54853078  0.08223030  0.72489813  1
  O  O36  1  0.04853112  0.72489913  0.08222965  1
  O  O37  1  0.45146932  0.91777021  0.27510086  1
