# generated using pymatgen
data_Mn(C4N3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.12035601
_cell_length_b   5.08785251
_cell_length_c   10.22927977
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn(C4N3)2
_chemical_formula_sum   'Mn2 C16 N12'
_cell_volume   370.57940385
_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  0.00000000  0.50000000  0.50000000  1
  Mn  Mn1  1  0.00000000  0.00000000  0.00000000  1
  C  C2  1  0.62209500  0.00000000  0.75915900  1
  C  C3  1  0.62209500  0.50000000  0.74084100  1
  C  C4  1  0.37790500  0.00000000  0.24084100  1
  C  C5  1  0.37790500  0.50000000  0.25915900  1
  C  C6  1  0.42609700  0.00000000  0.66214100  1
  C  C7  1  0.42609700  0.50000000  0.83785900  1
  C  C8  1  0.57390300  0.00000000  0.33785900  1
  C  C9  1  0.57390300  0.50000000  0.16214100  1
  C  C10  1  0.31146900  0.16678800  0.61615700  1
  C  C11  1  0.31146900  0.33321200  0.88384300  1
  C  C12  1  0.68853100  0.16678800  0.38384300  1
  C  C13  1  0.31146900  0.66678800  0.88384300  1
  C  C14  1  0.68853100  0.83321200  0.38384300  1
  C  C15  1  0.68853100  0.66678800  0.11615700  1
  C  C16  1  0.31146900  0.83321200  0.61615700  1
  C  C17  1  0.68853100  0.33321200  0.11615700  1
  N  N18  1  0.20518900  0.29977800  0.57382800  1
  N  N19  1  0.20518900  0.20022200  0.92617200  1
  N  N20  1  0.79481100  0.29977800  0.42617200  1
  N  N21  1  0.20518900  0.79977800  0.92617200  1
  N  N22  1  0.79481100  0.70022200  0.42617200  1
  N  N23  1  0.79481100  0.79977800  0.07382800  1
  N  N24  1  0.20518900  0.70022200  0.57382800  1
  N  N25  1  0.79481100  0.20022200  0.07382800  1
  N  N26  1  0.77749900  0.00000000  0.84417100  1
  N  N27  1  0.77749900  0.50000000  0.65582900  1
  N  N28  1  0.22250100  0.00000000  0.15582900  1
  N  N29  1  0.22250100  0.50000000  0.34417100  1
