# generated using pymatgen
data_Ca6AcPbN4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.71269003
_cell_length_b   12.04191394
_cell_length_c   11.63186411
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca6AcPbN4
_chemical_formula_sum   'Ca12 Ac2 Pb2 N8'
_cell_volume   520.03614618
_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
  Ca  Ca0  1  0.50032073  0.66756134  0.24367201  1.0
  Ca  Ca1  1  0.50032073  0.33243866  0.75632799  1.0
  Ca  Ca2  1  0.49967927  0.16756134  0.25632799  1.0
  Ca  Ca3  1  0.49967927  0.83243866  0.74367201  1.0
  Ca  Ca4  1  0.99955804  0.92295218  0.24841146  1.0
  Ca  Ca5  1  0.99955804  0.07704782  0.75158854  1.0
  Ca  Ca6  1  0.00044196  0.42295218  0.25158854  1.0
  Ca  Ca7  1  0.00044196  0.57704782  0.74841146  1.0
  Ca  Ca8  1  0.00147607  0.75170366  0.47598391  1.0
  Ca  Ca9  1  0.00147607  0.24829634  0.52401609  1.0
  Ca  Ca10  1  0.99852393  0.25170366  0.02401609  1.0
  Ca  Ca11  1  0.99852393  0.74829634  0.97598391  1.0
  Ac  Ac12  1  0.49678807  0.50000000  0.00000000  1.0
  Ac  Ac13  1  0.50321193  0.00000000  0.50000000  1.0
  Pb  Pb14  1  0.50476005  0.50000000  0.50000000  1.0
  Pb  Pb15  1  0.49523995  0.00000000  0.00000000  1.0
  N  N16  1  0.00048048  0.60795276  0.12917300  1.0
  N  N17  1  0.00048048  0.39204724  0.87082700  1.0
  N  N18  1  0.99951952  0.10795276  0.37082700  1.0
  N  N19  1  0.99951952  0.89204724  0.62917300  1.0
  N  N20  1  0.49810185  0.83380671  0.35343083  1.0
  N  N21  1  0.49810185  0.16619329  0.64656917  1.0
  N  N22  1  0.50189815  0.33380671  0.14656917  1.0
  N  N23  1  0.50189815  0.66619329  0.85343083  1.0