# generated using pymatgen
data_Zn3BO5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.13426200
_cell_length_b   9.42162000
_cell_length_c   12.40114500
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zn3BO5
_chemical_formula_sum   'Zn12 B4 O20'
_cell_volume   366.20364840
_cell_formula_units_Z   4
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
  Zn  Zn0  1  0.50000000  0.00679800  0.22105400  1.0
  Zn  Zn1  1  0.50000000  0.99320200  0.77894600  1.0
  Zn  Zn2  1  0.50000000  0.49320200  0.72105400  1.0
  Zn  Zn3  1  0.50000000  0.50679800  0.27894600  1.0
  Zn  Zn4  1  0.00000000  0.24005100  0.38239700  1.0
  Zn  Zn5  1  0.00000000  0.75994900  0.61760300  1.0
  Zn  Zn6  1  0.00000000  0.25994900  0.88239700  1.0
  Zn  Zn7  1  0.00000000  0.74005100  0.11760300  1.0
  Zn  Zn8  1  0.50000000  0.00000000  0.50000000  1.0
  Zn  Zn9  1  0.50000000  0.50000000  0.00000000  1.0
  Zn  Zn10  1  0.00000000  0.00000000  0.00000000  1.0
  Zn  Zn11  1  0.00000000  0.50000000  0.50000000  1.0
  B  B12  1  0.00000000  0.27823000  0.13947700  1.0
  B  B13  1  0.00000000  0.72177000  0.86052300  1.0
  B  B14  1  0.00000000  0.22177000  0.63947700  1.0
  B  B15  1  0.00000000  0.77823000  0.36052300  1.0
  O  O16  1  0.50000000  0.39470000  0.41985300  1.0
  O  O17  1  0.50000000  0.60530000  0.58014700  1.0
  O  O18  1  0.50000000  0.10530000  0.91985300  1.0
  O  O19  1  0.50000000  0.89470000  0.08014700  1.0
  O  O20  1  0.00000000  0.35110000  0.04264500  1.0
  O  O21  1  0.00000000  0.64890000  0.95735500  1.0
  O  O22  1  0.00000000  0.14890000  0.54264500  1.0
  O  O23  1  0.00000000  0.85110000  0.45735500  1.0
  O  O24  1  0.00000000  0.13108700  0.14174900  1.0
  O  O25  1  0.00000000  0.86891300  0.85825100  1.0
  O  O26  1  0.00000000  0.36891300  0.64174900  1.0
  O  O27  1  0.00000000  0.63108700  0.35825100  1.0
  O  O28  1  0.00000000  0.35334600  0.23589500  1.0
  O  O29  1  0.00000000  0.64665400  0.76410500  1.0
  O  O30  1  0.00000000  0.14665400  0.73589500  1.0
  O  O31  1  0.00000000  0.85334600  0.26410500  1.0
  O  O32  1  0.50000000  0.10697700  0.35847600  1.0
  O  O33  1  0.50000000  0.89302300  0.64152400  1.0
  O  O34  1  0.50000000  0.39302300  0.85847600  1.0
  O  O35  1  0.50000000  0.60697700  0.14152400  1.0