# generated using pymatgen
data_Li3CN2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.04148459
_cell_length_b   6.82697600
_cell_length_c   6.85735050
_cell_angle_alpha   90.00000000
_cell_angle_beta   112.24083100
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3CN2
_chemical_formula_sum   'Li12 C4 N8'
_cell_volume   218.45753283
_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
  Li  Li0  1  0.25281400  0.02631100  0.99698400  1
  Li  Li1  1  0.74718600  0.52631100  0.50301600  1
  Li  Li2  1  0.74718600  0.97368900  0.00301600  1
  Li  Li3  1  0.25281400  0.47368900  0.49698400  1
  Li  Li4  1  0.25223300  0.48542900  0.87210700  1
  Li  Li5  1  0.74776700  0.98542900  0.62789300  1
  Li  Li6  1  0.74776700  0.51457100  0.12789300  1
  Li  Li7  1  0.25223300  0.01457100  0.37210700  1
  Li  Li8  1  0.75391600  0.30278300  0.82281600  1
  Li  Li9  1  0.24608400  0.80278300  0.67718400  1
  Li  Li10  1  0.24608400  0.69721700  0.17718400  1
  Li  Li11  1  0.75391600  0.19721700  0.32281600  1
  C  C12  1  0.16048000  0.13808200  0.63190800  1
  C  C13  1  0.83951900  0.63808200  0.86809200  1
  C  C14  1  0.83951900  0.86191800  0.36809200  1
  C  C15  1  0.16048000  0.36191800  0.13190800  1
  N  N16  1  0.42587400  0.07551800  0.72065700  1
  N  N17  1  0.57412600  0.57551800  0.77934300  1
  N  N18  1  0.57412600  0.92448200  0.27934300  1
  N  N19  1  0.42587400  0.42448200  0.22065700  1
  N  N20  1  0.00141900  0.29020400  0.62907500  1
  N  N21  1  0.99858100  0.79020400  0.87092500  1
  N  N22  1  0.99858100  0.70979600  0.37092500  1
  N  N23  1  0.00141900  0.20979600  0.12907500  1
