# generated using pymatgen
data_FeAg3H6(C3N4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.77420340
_cell_length_b   7.77420340
_cell_length_c   12.43388828
_cell_angle_alpha   87.11160868
_cell_angle_beta   87.11160868
_cell_angle_gamma   104.64130664
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeAg3H6(C3N4)2
_chemical_formula_sum   'Fe2 Ag6 H12 C12 N16'
_cell_volume   724.60462704
_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
  Fe  Fe0  1  0.00659700  0.49626500  0.49537600  1.0
  Fe  Fe1  1  0.49626500  0.00659700  0.99537600  1.0
  Ag  Ag2  1  0.05446200  0.39295100  0.90436300  1.0
  Ag  Ag3  1  0.39295100  0.05446200  0.40436300  1.0
  Ag  Ag4  1  0.93427900  0.62611300  0.09200100  1.0
  Ag  Ag5  1  0.62611300  0.93427900  0.59200100  1.0
  Ag  Ag6  1  0.84305900  0.75338200  0.77760600  1.0
  Ag  Ag7  1  0.75338200  0.84305900  0.27760600  1.0
  H  H8  1  0.13844600  0.99761100  0.80674200  1.0
  H  H9  1  0.99761100  0.13844600  0.30674200  1.0
  H  H10  1  0.05145100  0.07251900  0.70187400  1.0
  H  H11  1  0.07251900  0.05145100  0.20187400  1.0
  H  H12  1  0.16495300  0.92174700  0.68648100  1.0
  H  H13  1  0.92174700  0.16495300  0.18648100  1.0
  H  H14  1  0.49458200  0.59613900  0.82561200  1.0
  H  H15  1  0.59613900  0.49458200  0.32561200  1.0
  H  H16  1  0.60603400  0.45412200  0.87146500  1.0
  H  H17  1  0.45412100  0.60603400  0.37146500  1.0
  H  H18  1  0.57678000  0.47314600  0.74075500  1.0
  H  H19  1  0.47314600  0.57678000  0.24075500  1.0
  C  C20  1  0.79006200  0.32137700  0.47735900  1.0
  C  C21  1  0.32137700  0.79006200  0.97735900  1.0
  C  C22  1  0.21963000  0.67011900  0.51603800  1.0
  C  C23  1  0.67011900  0.21963000  0.01603800  1.0
  C  C24  1  0.99037700  0.43625900  0.64512500  1.0
  C  C25  1  0.43625900  0.99037700  0.14512500  1.0
  C  C26  1  0.02635200  0.55289700  0.34292800  1.0
  C  C27  1  0.55289700  0.02635200  0.84292800  1.0
  C  C28  1  0.13022300  0.31738200  0.47392600  1.0
  C  C29  1  0.31738200  0.13022300  0.97392600  1.0
  C  C30  1  0.87989100  0.67097000  0.51584300  1.0
  C  C31  1  0.67097000  0.87989100  0.01584300  1.0
  N  N32  1  0.66105300  0.20784800  0.46441900  1.0
  N  N33  1  0.20784800  0.66105300  0.96441900  1.0
  N  N34  1  0.34868400  0.78327700  0.52959800  1.0
  N  N35  1  0.78327700  0.34868400  0.02959800  1.0
  N  N36  1  0.98666900  0.40158300  0.73869500  1.0
  N  N37  1  0.40158300  0.98666900  0.23869500  1.0
  N  N38  1  0.03250700  0.58301400  0.24883700  1.0
  N  N39  1  0.58301400  0.03250700  0.74883700  1.0
  N  N40  1  0.20322800  0.20434100  0.46026500  1.0
  N  N41  1  0.20434100  0.20322800  0.96026500  1.0
  N  N42  1  0.80241800  0.78113100  0.52856400  1.0
  N  N43  1  0.78113100  0.80241800  0.02856400  1.0
  N  N44  1  0.07737200  0.96124800  0.73760200  1.0
  N  N45  1  0.96124800  0.07737200  0.23760200  1.0
  N  N46  1  0.59947200  0.54238000  0.80862500  1.0
  N  N47  1  0.54238000  0.59947200  0.30862500  1.0