# generated using pymatgen
data_Nb4Co2C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.68763390
_cell_length_b   11.68763390
_cell_length_c   11.68763390
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb4Co2C
_chemical_formula_sum   'Nb64 Co32 C16'
_cell_volume   1596.53997933
_cell_formula_units_Z   16
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
  Nb  Nb0  1  0.12500000  0.87500000  0.37500000  1
  Nb  Nb1  1  0.37500000  0.12500000  0.87500000  1
  Nb  Nb2  1  0.37500000  0.37500000  0.62500000  1
  Nb  Nb3  1  0.12500000  0.12500000  0.62500000  1
  Nb  Nb4  1  0.50000000  0.00000000  0.31274100  1
  Nb  Nb5  1  0.50000000  0.00000000  0.68725900  1
  Nb  Nb6  1  0.50000000  0.81274100  0.50000000  1
  Nb  Nb7  1  0.50000000  0.18725900  0.50000000  1
  Nb  Nb8  1  0.31274100  0.00000000  0.50000000  1
  Nb  Nb9  1  0.18725900  0.00000000  0.00000000  1
  Nb  Nb10  1  0.25000000  0.25000000  0.43725900  1
  Nb  Nb11  1  0.25000000  0.25000000  0.06274100  1
  Nb  Nb12  1  0.25000000  0.43725900  0.25000000  1
  Nb  Nb13  1  0.25000000  0.06274100  0.25000000  1
  Nb  Nb14  1  0.43725900  0.25000000  0.25000000  1
  Nb  Nb15  1  0.56274100  0.25000000  0.75000000  1
  Nb  Nb16  1  0.12500000  0.37500000  0.87500000  1
  Nb  Nb17  1  0.37500000  0.62500000  0.37500000  1
  Nb  Nb18  1  0.37500000  0.87500000  0.12500000  1
  Nb  Nb19  1  0.12500000  0.62500000  0.12500000  1
  Nb  Nb20  1  0.50000000  0.50000000  0.81274100  1
  Nb  Nb21  1  0.50000000  0.50000000  0.18725900  1
  Nb  Nb22  1  0.50000000  0.31274100  0.00000000  1
  Nb  Nb23  1  0.50000000  0.68725900  0.00000000  1
  Nb  Nb24  1  0.31274100  0.50000000  0.00000000  1
  Nb  Nb25  1  0.18725900  0.50000000  0.50000000  1
  Nb  Nb26  1  0.25000000  0.75000000  0.93725900  1
  Nb  Nb27  1  0.25000000  0.75000000  0.56274100  1
  Nb  Nb28  1  0.25000000  0.93725900  0.75000000  1
  Nb  Nb29  1  0.25000000  0.56274100  0.75000000  1
  Nb  Nb30  1  0.43725900  0.75000000  0.75000000  1
  Nb  Nb31  1  0.56274100  0.75000000  0.25000000  1
  Nb  Nb32  1  0.62500000  0.87500000  0.87500000  1
  Nb  Nb33  1  0.87500000  0.12500000  0.37500000  1
  Nb  Nb34  1  0.87500000  0.37500000  0.12500000  1
  Nb  Nb35  1  0.62500000  0.12500000  0.12500000  1
  Nb  Nb36  1  0.00000000  0.00000000  0.81274100  1
  Nb  Nb37  1  0.00000000  0.00000000  0.18725900  1
  Nb  Nb38  1  0.00000000  0.81274100  0.00000000  1
  Nb  Nb39  1  0.00000000  0.18725900  0.00000000  1
  Nb  Nb40  1  0.81274100  0.00000000  0.00000000  1
  Nb  Nb41  1  0.68725900  0.00000000  0.50000000  1
  Nb  Nb42  1  0.75000000  0.25000000  0.93725900  1
  Nb  Nb43  1  0.75000000  0.25000000  0.56274100  1
  Nb  Nb44  1  0.75000000  0.43725900  0.75000000  1
  Nb  Nb45  1  0.75000000  0.06274100  0.75000000  1
  Nb  Nb46  1  0.93725900  0.25000000  0.75000000  1
  Nb  Nb47  1  0.06274100  0.25000000  0.25000000  1
  Nb  Nb48  1  0.62500000  0.37500000  0.37500000  1
  Nb  Nb49  1  0.87500000  0.62500000  0.87500000  1
  Nb  Nb50  1  0.87500000  0.87500000  0.62500000  1
  Nb  Nb51  1  0.62500000  0.62500000  0.62500000  1
  Nb  Nb52  1  0.00000000  0.50000000  0.31274100  1
  Nb  Nb53  1  0.00000000  0.50000000  0.68725900  1
  Nb  Nb54  1  0.00000000  0.31274100  0.50000000  1
  Nb  Nb55  1  0.00000000  0.68725900  0.50000000  1
  Nb  Nb56  1  0.81274100  0.50000000  0.50000000  1
  Nb  Nb57  1  0.68725900  0.50000000  0.00000000  1
  Nb  Nb58  1  0.75000000  0.75000000  0.43725900  1
  Nb  Nb59  1  0.75000000  0.75000000  0.06274100  1
  Nb  Nb60  1  0.75000000  0.93725900  0.25000000  1
  Nb  Nb61  1  0.75000000  0.56274100  0.25000000  1
  Nb  Nb62  1  0.93725900  0.75000000  0.25000000  1
  Nb  Nb63  1  0.06274100  0.75000000  0.75000000  1
  Co  Co64  1  0.42015700  0.07984300  0.07984300  1
  Co  Co65  1  0.57984300  0.42015700  0.57984300  1
  Co  Co66  1  0.57984300  0.07984300  0.92015700  1
  Co  Co67  1  0.42015700  0.42015700  0.42015700  1
  Co  Co68  1  0.32984300  0.17015700  0.67015700  1
  Co  Co69  1  0.17015700  0.82984300  0.17015700  1
  Co  Co70  1  0.17015700  0.17015700  0.82984300  1
  Co  Co71  1  0.32984300  0.82984300  0.32984300  1
  Co  Co72  1  0.42015700  0.57984300  0.57984300  1
  Co  Co73  1  0.57984300  0.92015700  0.07984300  1
  Co  Co74  1  0.57984300  0.57984300  0.42015700  1
  Co  Co75  1  0.42015700  0.92015700  0.92015700  1
  Co  Co76  1  0.32984300  0.67015700  0.17015700  1
  Co  Co77  1  0.17015700  0.32984300  0.67015700  1
  Co  Co78  1  0.17015700  0.67015700  0.32984300  1
  Co  Co79  1  0.32984300  0.32984300  0.82984300  1
  Co  Co80  1  0.92015700  0.07984300  0.57984300  1
  Co  Co81  1  0.07984300  0.42015700  0.07984300  1
  Co  Co82  1  0.07984300  0.07984300  0.42015700  1
  Co  Co83  1  0.92015700  0.42015700  0.92015700  1
  Co  Co84  1  0.82984300  0.17015700  0.17015700  1
  Co  Co85  1  0.67015700  0.82984300  0.67015700  1
  Co  Co86  1  0.67015700  0.17015700  0.32984300  1
  Co  Co87  1  0.82984300  0.82984300  0.82984300  1
  Co  Co88  1  0.92015700  0.57984300  0.07984300  1
  Co  Co89  1  0.07984300  0.92015700  0.57984300  1
  Co  Co90  1  0.07984300  0.57984300  0.92015700  1
  Co  Co91  1  0.92015700  0.92015700  0.42015700  1
  Co  Co92  1  0.82984300  0.67015700  0.67015700  1
  Co  Co93  1  0.67015700  0.32984300  0.17015700  1
  Co  Co94  1  0.67015700  0.67015700  0.82984300  1
  Co  Co95  1  0.82984300  0.32984300  0.32984300  1
  C  C96  1  0.12500000  0.37500000  0.37500000  1
  C  C97  1  0.37500000  0.12500000  0.37500000  1
  C  C98  1  0.37500000  0.87500000  0.62500000  1
  C  C99  1  0.12500000  0.12500000  0.12500000  1
  C  C100  1  0.12500000  0.87500000  0.87500000  1
  C  C101  1  0.37500000  0.62500000  0.87500000  1
  C  C102  1  0.37500000  0.37500000  0.12500000  1
  C  C103  1  0.12500000  0.62500000  0.62500000  1
  C  C104  1  0.62500000  0.37500000  0.87500000  1
  C  C105  1  0.87500000  0.12500000  0.87500000  1
  C  C106  1  0.87500000  0.87500000  0.12500000  1
  C  C107  1  0.62500000  0.12500000  0.62500000  1
  C  C108  1  0.62500000  0.87500000  0.37500000  1
  C  C109  1  0.87500000  0.62500000  0.37500000  1
  C  C110  1  0.87500000  0.37500000  0.62500000  1
  C  C111  1  0.62500000  0.62500000  0.12500000  1
