# generated using pymatgen
data_AcTh(Ni2B)12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.02850537
_cell_length_b   6.02850432
_cell_length_c   11.01961778
_cell_angle_alpha   90.05909472
_cell_angle_beta   90.05909870
_cell_angle_gamma   104.75905715
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AcTh(Ni2B)12
_chemical_formula_sum   'Ac1 Th1 Ni24 B12'
_cell_volume   387.27027534
_cell_formula_units_Z   1
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
  Ac  Ac0  1  0.83296260  0.83296260  0.50076803  1.0
  Th  Th1  1  0.16735193  0.16735193  0.99643478  1.0
  Ni  Ni2  1  0.56487493  0.56487493  0.91814485  1.0
  Ni  Ni3  1  0.42649627  0.42649627  0.41337807  1.0
  Ni  Ni4  1  0.77855371  0.77855371  0.09764486  1.0
  Ni  Ni5  1  0.22931848  0.22931848  0.60036769  1.0
  Ni  Ni6  1  0.53696332  0.80434589  0.73821181  1.0
  Ni  Ni7  1  0.80434589  0.53696332  0.73821181  1.0
  Ni  Ni8  1  0.46062732  0.19581646  0.23339969  1.0
  Ni  Ni9  1  0.19581646  0.46062732  0.23339969  1.0
  Ni  Ni10  1  0.14778452  0.87933480  0.75819994  1.0
  Ni  Ni11  1  0.87933480  0.14778452  0.75819994  1.0
  Ni  Ni12  1  0.85291004  0.12266927  0.25425443  1.0
  Ni  Ni13  1  0.12266927  0.85291004  0.25425443  1.0
  Ni  Ni14  1  0.65437452  0.27776748  0.56758785  1.0
  Ni  Ni15  1  0.27776748  0.65437452  0.56758785  1.0
  Ni  Ni16  1  0.34208600  0.72743593  0.06671037  1.0
  Ni  Ni17  1  0.72743593  0.34208600  0.06671037  1.0
  Ni  Ni18  1  0.63006173  0.99215516  0.93777335  1.0
  Ni  Ni19  1  0.99215516  0.63006173  0.93777335  1.0
  Ni  Ni20  1  0.37174356  0.00816658  0.43677614  1.0
  Ni  Ni21  1  0.00816658  0.37174356  0.43677614  1.0
  Ni  Ni22  1  0.47325534  0.20852822  0.77699987  1.0
  Ni  Ni23  1  0.20852822  0.47325534  0.77699987  1.0
  Ni  Ni24  1  0.52432776  0.78853934  0.27091389  1.0
  Ni  Ni25  1  0.78853934  0.52432776  0.27091389  1.0
  B  B26  1  0.83656534  0.83656534  0.83304564  1.0
  B  B27  1  0.16465585  0.16465585  0.32843257  1.0
  B  B28  1  0.48576269  0.48576269  0.66676301  1.0
  B  B29  1  0.51210814  0.51210814  0.15620445  1.0
  B  B30  1  0.32252651  0.75179608  0.88725259  1.0
  B  B31  1  0.75179608  0.32252651  0.88725259  1.0
  B  B32  1  0.67805276  0.25584875  0.38524044  1.0
  B  B33  1  0.25584875  0.67805276  0.38524044  1.0
  B  B34  1  0.39441947  0.98502924  0.62271653  1.0
  B  B35  1  0.98502924  0.39441947  0.62271653  1.0
  B  B36  1  0.60144232  0.01334368  0.12136865  1.0
  B  B37  1  0.01334368  0.60144232  0.12136865  1.0