# generated using pymatgen data_Sn4P3C(NO4)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.18892000 _cell_length_b 9.18892000 _cell_length_c 21.02103900 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sn4P3C(NO4)3 _chemical_formula_sum 'Sn16 P12 C4 N12 O48' _cell_volume 1774.93772037 _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 Sn Sn0 1 0.11272500 0.08368700 0.27681500 1.0 Sn Sn1 1 0.88727500 0.91631300 0.77681500 1.0 Sn Sn2 1 0.08368700 0.88727500 0.52681500 1.0 Sn Sn3 1 0.91631300 0.11272500 0.02681500 1.0 Sn Sn4 1 0.55070700 0.07356500 0.43500500 1.0 Sn Sn5 1 0.44929300 0.92643500 0.93500500 1.0 Sn Sn6 1 0.07356500 0.44929300 0.68500500 1.0 Sn Sn7 1 0.92643500 0.55070700 0.18500500 1.0 Sn Sn8 1 0.15680900 0.33312800 0.48465600 1.0 Sn Sn9 1 0.84319100 0.66687200 0.98465600 1.0 Sn Sn10 1 0.33312800 0.84319100 0.73465600 1.0 Sn Sn11 1 0.66687200 0.15680900 0.23465600 1.0 Sn Sn12 1 0.57385600 0.63389700 0.49531700 1.0 Sn Sn13 1 0.42614400 0.36610300 0.99531700 1.0 Sn Sn14 1 0.63389700 0.42614400 0.74531700 1.0 Sn Sn15 1 0.36610300 0.57385600 0.24531700 1.0 P P16 1 0.91513300 0.56867100 0.54751900 1.0 P P17 1 0.08486700 0.43132900 0.04751900 1.0 P P18 1 0.56867100 0.08486700 0.79751900 1.0 P P19 1 0.43132900 0.91513300 0.29751900 1.0 P P20 1 0.91655000 0.09769400 0.41317900 1.0 P P21 1 0.08345000 0.90230600 0.91317900 1.0 P P22 1 0.09769400 0.08345000 0.66317900 1.0 P P23 1 0.90230600 0.91655000 0.16317900 1.0 P P24 1 0.42225100 0.39733900 0.38916100 1.0 P P25 1 0.57774900 0.60266100 0.88916100 1.0 P P26 1 0.39733900 0.57774900 0.63916100 1.0 P P27 1 0.60266100 0.42225100 0.13916100 1.0 C C28 1 0.63915400 0.11030900 0.60219700 1.0 C C29 1 0.36084600 0.88969100 0.10219700 1.0 C C30 1 0.11030900 0.36084600 0.85219700 1.0 C C31 1 0.88969100 0.63915400 0.35219700 1.0 N N32 1 0.67219800 0.96893100 0.61461600 1.0 N N33 1 0.32780200 0.03106900 0.11461600 1.0 N N34 1 0.96893100 0.32780200 0.86461600 1.0 N N35 1 0.03106900 0.67219800 0.36461600 1.0 N N36 1 0.50141100 0.16122200 0.61142900 1.0 N N37 1 0.49858900 0.83877800 0.11142900 1.0 N N38 1 0.16122200 0.49858900 0.86142900 1.0 N N39 1 0.83877800 0.50141100 0.36142900 1.0 N N40 1 0.74348600 0.20118000 0.57884900 1.0 N N41 1 0.25651400 0.79882000 0.07884900 1.0 N N42 1 0.20118000 0.25651400 0.82884900 1.0 N N43 1 0.79882000 0.74348600 0.32884900 1.0 O O44 1 0.98246600 0.01958400 0.35451800 1.0 O O45 1 0.01753400 0.98041600 0.85451800 1.0 O O46 1 0.01958400 0.01753400 0.60451800 1.0 O O47 1 0.98041600 0.98246600 0.10451800 1.0 O O48 1 0.75498300 0.13706100 0.39875500 1.0 O O49 1 0.24501700 0.86293900 0.89875500 1.0 O O50 1 0.13706100 0.24501700 0.64875500 1.0 O O51 1 0.86293900 0.75498300 0.14875500 1.0 O O52 1 0.26231000 0.43750200 0.40801200 1.0 O O53 1 0.73769000 0.56249800 0.90801200 1.0 O O54 1 0.43750200 0.73769000 0.65801200 1.0 O O55 1 0.56249800 0.26231000 0.15801200 1.0 O O56 1 0.00445800 0.92147700 0.22169900 1.0 O O57 1 0.99554200 0.07852300 0.72169900 1.0 O O58 1 0.92147700 0.99554200 0.47169900 1.0 O O59 1 0.07852300 0.00445800 0.97169900 1.0 O O60 1 0.26435300 0.92607400 0.30657300 1.0 O O61 1 0.73564700 0.07392600 0.80657300 1.0 O O62 1 0.92607400 0.73564700 0.55657300 1.0 O O63 1 0.07392600 0.26435300 0.05657300 1.0 O O64 1 0.52848600 0.44274800 0.44273400 1.0 O O65 1 0.47151400 0.55725200 0.94273400 1.0 O O66 1 0.44274800 0.47151400 0.69273400 1.0 O O67 1 0.55725200 0.52848600 0.19273400 1.0 O O68 1 0.51238500 0.92306600 0.36215400 1.0 O O69 1 0.48761500 0.07693400 0.86215400 1.0 O O70 1 0.92306600 0.48761500 0.61215400 1.0 O O71 1 0.07693400 0.51238500 0.11215400 1.0 O O72 1 0.04112900 0.52166800 0.50188900 1.0 O O73 1 0.95887100 0.47833200 0.00188900 1.0 O O74 1 0.52166800 0.95887100 0.75188900 1.0 O O75 1 0.47833200 0.04112900 0.25188900 1.0 O O76 1 0.76783700 0.52833400 0.51705100 1.0 O O77 1 0.23216300 0.47166600 0.01705100 1.0 O O78 1 0.52833400 0.23216300 0.76705100 1.0 O O79 1 0.47166600 0.76783700 0.26705100 1.0 O O80 1 0.00057400 0.24274000 0.42456400 1.0 O O81 1 0.99942600 0.75726000 0.92456400 1.0 O O82 1 0.24274000 0.99942600 0.67456400 1.0 O O83 1 0.75726000 0.00057400 0.17456400 1.0 O O84 1 0.43362700 0.22885200 0.38105100 1.0 O O85 1 0.56637300 0.77114800 0.88105100 1.0 O O86 1 0.22885200 0.56637300 0.63105100 1.0 O O87 1 0.77114800 0.43362700 0.13105100 1.0 O O88 1 0.46122500 0.47121100 0.32545700 1.0 O O89 1 0.53877500 0.52878900 0.82545700 1.0 O O90 1 0.47121100 0.53877500 0.57545700 1.0 O O91 1 0.52878900 0.46122500 0.07545700 1.0