# generated using pymatgen
data_Co2Mo3N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.66791827
_cell_length_b   6.66791827
_cell_length_c   6.66791827
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Co2Mo3N
_chemical_formula_sum   'Co8 Mo12 N4'
_cell_volume   296.46320807
_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
  Co  Co0  1  0.06901000  0.06901000  0.06901000  1
  Co  Co1  1  0.31901000  0.18099000  0.81901000  1
  Co  Co2  1  0.81901000  0.31901000  0.18099000  1
  Co  Co3  1  0.18099000  0.81901000  0.31901000  1
  Co  Co4  1  0.43099000  0.93099000  0.56901000  1
  Co  Co5  1  0.56901000  0.43099000  0.93099000  1
  Co  Co6  1  0.93099000  0.56901000  0.43099000  1
  Co  Co7  1  0.68099000  0.68099000  0.68099000  1
  Mo  Mo8  1  0.12500000  0.20140100  0.45140100  1
  Mo  Mo9  1  0.37500000  0.79859900  0.95140100  1
  Mo  Mo10  1  0.87500000  0.70140100  0.04859900  1
  Mo  Mo11  1  0.20140100  0.45140100  0.12500000  1
  Mo  Mo12  1  0.79859900  0.95140100  0.37500000  1
  Mo  Mo13  1  0.04859900  0.87500000  0.70140100  1
  Mo  Mo14  1  0.45140100  0.12500000  0.20140100  1
  Mo  Mo15  1  0.29859900  0.54859900  0.62500000  1
  Mo  Mo16  1  0.95140100  0.37500000  0.79859900  1
  Mo  Mo17  1  0.54859900  0.62500000  0.29859900  1
  Mo  Mo18  1  0.70140100  0.04859900  0.87500000  1
  Mo  Mo19  1  0.62500000  0.29859900  0.54859900  1
  N  N20  1  0.37500000  0.37500000  0.37500000  1
  N  N21  1  0.62500000  0.87500000  0.12500000  1
  N  N22  1  0.12500000  0.62500000  0.87500000  1
  N  N23  1  0.87500000  0.12500000  0.62500000  1
