# generated using pymatgen
data_Cu3(Mo3S4)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.52035500
_cell_length_b   8.84288645
_cell_length_c   9.53813423
_cell_angle_alpha   89.77000657
_cell_angle_beta   88.64279677
_cell_angle_gamma   83.83054656
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu3(Mo3S4)4
_chemical_formula_sum   'Cu3 Mo12 S16'
_cell_volume   546.61786390
_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  0.07318900  0.53676500  0.42447800  1.0
  Cu  Cu1  1  0.93197000  0.96096900  0.07652700  1.0
  Cu  Cu2  1  0.98522200  0.13364100  0.80849100  1.0
  Mo  Mo3  1  0.21294300  0.52703400  0.93248000  1.0
  Mo  Mo4  1  0.21839700  0.02496100  0.43035400  1.0
  Mo  Mo5  1  0.40191000  0.12113200  0.66324800  1.0
  Mo  Mo6  1  0.45814900  0.81126800  0.59403100  1.0
  Mo  Mo7  1  0.54420200  0.68804000  0.90706000  1.0
  Mo  Mo8  1  0.59497200  0.38200100  0.83579300  1.0
  Mo  Mo9  1  0.40357100  0.61780900  0.16362500  1.0
  Mo  Mo10  1  0.44912800  0.31137200  0.09465300  1.0
  Mo  Mo11  1  0.54712000  0.18764100  0.40279600  1.0
  Mo  Mo12  1  0.59704400  0.88188300  0.33638600  1.0
  Mo  Mo13  1  0.78228600  0.97364800  0.56795300  1.0
  Mo  Mo14  1  0.78399200  0.47623400  0.07084800  1.0
  S  S15  1  0.12999600  0.94014800  0.66908400  1.0
  S  S16  1  0.27216700  0.25964200  0.87952100  1.0
  S  S17  1  0.12836900  0.44843800  0.17821700  1.0
  S  S18  1  0.27464000  0.75422900  0.38193000  1.0
  S  S19  1  0.21065000  0.29605300  0.49601200  1.0
  S  S20  1  0.38077900  0.57054800  0.70752000  1.0
  S  S21  1  0.20295800  0.79220700  0.00566500  1.0
  S  S22  1  0.38210000  0.07043900  0.20599300  1.0
  S  S23  1  0.61429600  0.93021400  0.79360500  1.0
  S  S24  1  0.79707400  0.20413100  0.00882700  1.0
  S  S25  1  0.61606700  0.42834100  0.29282600  1.0
  S  S26  1  0.79620100  0.70668700  0.49393100  1.0
  S  S27  1  0.71942600  0.24535400  0.61946700  1.0
  S  S28  1  0.86512100  0.55107900  0.82893300  1.0
  S  S29  1  0.72647300  0.74587000  0.11894000  1.0
  S  S30  1  0.87258900  0.05272000  0.32230800  1.0