# generated using pymatgen
data_B2H10C2NClO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.56382600
_cell_length_b   8.64227157
_cell_length_c   9.37807318
_cell_angle_alpha   116.98464751
_cell_angle_beta   95.82982540
_cell_angle_gamma   93.93469072
_symmetry_Int_Tables_number   1
_chemical_formula_structural   B2H10C2NClO3
_chemical_formula_sum   'B4 H20 C4 N2 Cl2 O6'
_cell_volume   396.40294416
_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
  B  B0  1  0.89117100  0.06922300  0.59288700  1.0
  B  B1  1  0.82560300  0.86931300  0.59589800  1.0
  B  B2  1  0.10882900  0.93077700  0.40711300  1.0
  B  B3  1  0.17439700  0.13068700  0.40410200  1.0
  H  H4  1  0.20949900  0.50375700  0.57811700  1.0
  H  H5  1  0.57461600  0.78892900  0.74197000  1.0
  H  H6  1  0.04264000  0.51268800  0.22293900  1.0
  H  H7  1  0.00837600  0.69852700  0.02547800  1.0
  H  H8  1  0.22703500  0.46286700  0.91854500  1.0
  H  H9  1  0.41205100  0.32586100  0.63117100  1.0
  H  H10  1  0.77296500  0.53713300  0.08145500  1.0
  H  H11  1  0.99162400  0.30147300  0.97452200  1.0
  H  H12  1  0.68232100  0.05281800  0.75254300  1.0
  H  H13  1  0.48312900  0.47602800  0.71547200  1.0
  H  H14  1  0.79050100  0.49624300  0.42188300  1.0
  H  H15  1  0.51687100  0.52397200  0.28452800  1.0
  H  H16  1  0.31767900  0.94718200  0.24745700  1.0
  H  H17  1  0.95736000  0.48731200  0.77706100  1.0
  H  H18  1  0.58794900  0.67413900  0.36882900  1.0
  H  H19  1  0.07605600  0.22118500  0.77685600  1.0
  H  H20  1  0.42538400  0.21107100  0.25803000  1.0
  H  H21  1  0.33239000  0.20614000  0.90852300  1.0
  H  H22  1  0.66761000  0.79386000  0.09147700  1.0
  H  H23  1  0.92394400  0.77881500  0.22314400  1.0
  C  C24  1  0.33797700  0.40720100  0.67468600  1.0
  C  C25  1  0.91329900  0.60682000  0.12487600  1.0
  C  C26  1  0.08670100  0.39318000  0.87512400  1.0
  C  C27  1  0.66202300  0.59279900  0.32531400  1.0
  N  N28  1  0.79306200  0.70668700  0.18726700  1.0
  N  N29  1  0.20693800  0.29331300  0.81273300  1.0
  Cl  Cl30  1  0.41058100  0.88372300  0.86922100  1.0
  Cl  Cl31  1  0.58941900  0.11627700  0.13077900  1.0
  O  O32  1  0.94988200  0.81777800  0.50741100  1.0
  O  O33  1  0.80590200  0.13056800  0.68677100  1.0
  O  O34  1  0.19409800  0.86943200  0.31322900  1.0
  O  O35  1  0.05011800  0.18222200  0.49258900  1.0
  O  O36  1  0.33633800  0.25026200  0.31929200  1.0
  O  O37  1  0.66366200  0.74973800  0.68070800  1.0