# generated using pymatgen
data_Mn2NbC8(NO)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.51112033
_cell_length_b   10.51112033
_cell_length_c   10.51112033
_cell_angle_alpha   113.57042152
_cell_angle_beta   113.57042152
_cell_angle_gamma   101.55147178
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2NbC8(NO)8
_chemical_formula_sum   'Mn4 Nb2 C16 N16 O16'
_cell_volume   881.41553378
_cell_formula_units_Z   2
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
  Mn  Mn0  1  0.19142200  0.68793100  0.87935300  1.0
  Mn  Mn1  1  0.80857800  0.31206900  0.12064700  1.0
  Mn  Mn2  1  0.68793100  0.80857800  0.49650900  1.0
  Mn  Mn3  1  0.31206900  0.19142200  0.50349100  1.0
  Nb  Nb4  1  0.25378400  0.25378400  0.00000000  1.0
  Nb  Nb5  1  0.74621600  0.74621600  0.00000000  1.0
  C  C6  1  0.24346300  0.02136500  0.94029200  1.0
  C  C7  1  0.08107400  0.30317100  0.05970800  1.0
  C  C8  1  0.02136500  0.08107400  0.77790300  1.0
  C  C9  1  0.30317100  0.24346300  0.22209700  1.0
  C  C10  1  0.75653700  0.97863500  0.05970800  1.0
  C  C11  1  0.91892600  0.69682900  0.94029200  1.0
  C  C12  1  0.97863500  0.91892600  0.22209700  1.0
  C  C13  1  0.69682900  0.75653700  0.77790300  1.0
  C  C14  1  0.18455900  0.39357800  0.89476100  1.0
  C  C15  1  0.49881700  0.28979800  0.10523900  1.0
  C  C16  1  0.39357800  0.49881700  0.20901900  1.0
  C  C17  1  0.28979800  0.18455900  0.79098100  1.0
  C  C18  1  0.81544100  0.60642200  0.10523900  1.0
  C  C19  1  0.50118300  0.71020200  0.89476100  1.0
  C  C20  1  0.60642200  0.50118300  0.79098100  1.0
  C  C21  1  0.71020200  0.81544100  0.20901900  1.0
  N  N22  1  0.22975700  0.89903400  0.91399100  1.0
  N  N23  1  0.98504300  0.31576500  0.08600900  1.0
  N  N24  1  0.89903400  0.98504300  0.66927800  1.0
  N  N25  1  0.31576500  0.22975700  0.33072200  1.0
  N  N26  1  0.77024300  0.10096600  0.08600900  1.0
  N  N27  1  0.01495700  0.68423500  0.91399100  1.0
  N  N28  1  0.10096600  0.01495700  0.33072200  1.0
  N  N29  1  0.68423500  0.77024300  0.66927800  1.0
  N  N30  1  0.16517700  0.48371500  0.86048100  1.0
  N  N31  1  0.62323400  0.30469500  0.13951900  1.0
  N  N32  1  0.48371500  0.62323400  0.31853800  1.0
  N  N33  1  0.30469500  0.16517700  0.68146200  1.0
  N  N34  1  0.83482300  0.51628500  0.13951900  1.0
  N  N35  1  0.37676600  0.69530500  0.86048100  1.0
  N  N36  1  0.51628500  0.37676600  0.68146200  1.0
  N  N37  1  0.69530500  0.83482300  0.31853800  1.0
  O  O38  1  0.07279700  0.60717000  0.67996700  1.0
  O  O39  1  0.92720300  0.39283000  0.32003300  1.0
  O  O40  1  0.60717000  0.92720300  0.53437300  1.0
  O  O41  1  0.39283000  0.07279700  0.46562700  1.0
  O  O42  1  0.30950200  0.77287800  0.08238000  1.0
  O  O43  1  0.69049800  0.22712200  0.91762000  1.0
  O  O44  1  0.77287800  0.69049800  0.46337700  1.0
  O  O45  1  0.22712200  0.30950200  0.53662300  1.0
  O  O46  1  0.67307100  0.18652900  0.37552400  1.0
  O  O47  1  0.81100500  0.29754700  0.62447600  1.0
  O  O48  1  0.18652900  0.81100500  0.51345800  1.0
  O  O49  1  0.29754700  0.67307100  0.48654200  1.0
  O  O50  1  0.32692900  0.81347100  0.62447600  1.0
  O  O51  1  0.18899500  0.70245300  0.37552400  1.0
  O  O52  1  0.81347100  0.18899500  0.48654200  1.0
  O  O53  1  0.70245300  0.32692900  0.51345800  1.0