# generated using pymatgen
data_Ca3NpTi4O12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.69822535
_cell_length_b   5.39506397
_cell_length_c   5.49873619
_cell_angle_alpha   89.74906982
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca3NpTi4O12
_chemical_formula_sum   'Ca3 Np1 Ti4 O12'
_cell_volume   228.37362113
_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
  Ca  Ca0  1  0.50000000  0.49149405  0.54409668  1.0
  Ca  Ca1  1  0.00000000  0.99221290  0.95280031  1.0
  Ca  Ca2  1  0.00000000  0.50859447  0.45818270  1.0
  Np  Np3  1  0.50000000  0.00789266  0.04544628  1.0
  Ti  Ti4  1  0.24705894  0.99893721  0.49876971  1.0
  Ti  Ti5  1  0.75408185  0.50120007  0.99936442  1.0
  Ti  Ti6  1  0.75294106  0.99893721  0.49876971  1.0
  Ti  Ti7  1  0.24591815  0.50120007  0.99936442  1.0
  O  O8  1  0.50000000  0.57466233  0.97793321  1.0
  O  O9  1  0.50000000  0.92286692  0.48735880  1.0
  O  O10  1  0.00000000  0.42418631  0.02488005  1.0
  O  O11  1  0.00000000  0.07733583  0.51644554  1.0
  O  O12  1  0.78578182  0.79729928  0.20429270  1.0
  O  O13  1  0.20947113  0.70686205  0.70860605  1.0
  O  O14  1  0.28852867  0.20439340  0.79493742  1.0
  O  O15  1  0.70511666  0.29168477  0.29045793  1.0
  O  O16  1  0.71147133  0.20439340  0.79493742  1.0
  O  O17  1  0.29488334  0.29168477  0.29045793  1.0
  O  O18  1  0.21421818  0.79729928  0.20429270  1.0
  O  O19  1  0.79052887  0.70686205  0.70860605  1.0