# generated using pymatgen
data_NiMo2P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.34363351
_cell_length_b   8.49676932
_cell_length_c   4.78868496
_cell_angle_alpha   90.00000000
_cell_angle_beta   113.41932993
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NiMo2P
_chemical_formula_sum   'Ni8 Mo16 P8'
_cell_volume   423.53122039
_cell_formula_units_Z   8
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
  Ni  Ni0  1  0.33714300  0.65048300  0.09042500  1
  Ni  Ni1  1  0.33714300  0.34951700  0.09042500  1
  Ni  Ni2  1  0.66285700  0.65048300  0.90957500  1
  Ni  Ni3  1  0.66285700  0.34951700  0.90957500  1
  Ni  Ni4  1  0.83714300  0.15048300  0.09042500  1
  Ni  Ni5  1  0.83714300  0.84951700  0.09042500  1
  Ni  Ni6  1  0.16285700  0.15048300  0.90957500  1
  Ni  Ni7  1  0.16285700  0.84951700  0.90957500  1
  Mo  Mo8  1  0.86390500  0.50000000  0.87161700  1
  Mo  Mo9  1  0.57735300  0.50000000  0.35514500  1
  Mo  Mo10  1  0.00000000  0.34133500  0.50000000  1
  Mo  Mo11  1  0.00000000  0.65866500  0.50000000  1
  Mo  Mo12  1  0.13609500  0.50000000  0.12838300  1
  Mo  Mo13  1  0.75000000  0.25000000  0.50000000  1
  Mo  Mo14  1  0.75000000  0.75000000  0.50000000  1
  Mo  Mo15  1  0.42264700  0.50000000  0.64485500  1
  Mo  Mo16  1  0.36390500  0.00000000  0.87161700  1
  Mo  Mo17  1  0.07735300  0.00000000  0.35514500  1
  Mo  Mo18  1  0.50000000  0.84133500  0.50000000  1
  Mo  Mo19  1  0.50000000  0.15866500  0.50000000  1
  Mo  Mo20  1  0.63609500  0.00000000  0.12838300  1
  Mo  Mo21  1  0.25000000  0.75000000  0.50000000  1
  Mo  Mo22  1  0.25000000  0.25000000  0.50000000  1
  Mo  Mo23  1  0.92264700  0.00000000  0.64485500  1
  P  P24  1  0.19922300  0.50000000  0.69940600  1
  P  P25  1  0.80077700  0.50000000  0.30059400  1
  P  P26  1  0.50000000  0.74733200  0.00000000  1
  P  P27  1  0.50000000  0.25266800  0.00000000  1
  P  P28  1  0.69922300  0.00000000  0.69940600  1
  P  P29  1  0.30077700  0.00000000  0.30059400  1
  P  P30  1  0.00000000  0.24733200  0.00000000  1
  P  P31  1  0.00000000  0.75266800  0.00000000  1
