# generated using pymatgen
data_CuMoS4N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.43672327
_cell_length_b   6.43672327
_cell_length_c   6.43672327
_cell_angle_alpha   100.40424033
_cell_angle_beta   100.40424033
_cell_angle_gamma   129.70359760
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CuMoS4N
_chemical_formula_sum   'Cu1 Mo1 S4 N1'
_cell_volume   185.72651954
_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
  Cu  Cu0  1  0.50000000  0.50000000  0.00000000  1.0
  Mo  Mo1  1  0.00000000  0.00000000  0.00000000  1.0
  S  S2  1  0.34817900  0.42852100  0.29699600  1.0
  S  S3  1  0.13152500  0.05118300  0.70300400  1.0
  S  S4  1  0.94881700  0.65182100  0.08034300  1.0
  S  S5  1  0.57147900  0.86847500  0.91965700  1.0
  N  N6  1  0.75000000  0.25000000  0.50000000  1.0