# generated using pymatgen data_Tm5Mg3(Ni4P3)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.11174936 _cell_length_b 12.11174995 _cell_length_c 3.74206352 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000647 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm5Mg3(Ni4P3)4 _chemical_formula_sum 'Tm5 Mg3 Ni16 P12' _cell_volume 475.39600794 _cell_formula_units_Z 1 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 Tm Tm0 1 0.18437703 0.18437703 0.50000000 1.0 Tm Tm1 1 0.81562297 1.00000000 0.50000000 1.0 Tm Tm2 1 1.00000000 0.81562297 0.50000000 1.0 Tm Tm3 1 0.33333300 0.66666700 0.00000000 1.0 Tm Tm4 1 0.66666700 0.33333300 0.00000000 1.0 Mg Mg5 1 0.56251761 0.56251761 0.00000000 1.0 Mg Mg6 1 0.43748239 1.00000000 0.00000000 1.0 Mg Mg7 1 1.00000000 0.43748239 0.00000000 1.0 Ni Ni8 1 0.71998998 0.71998998 0.50000000 1.0 Ni Ni9 1 0.28001002 0.00000000 0.50000000 1.0 Ni Ni10 1 0.00000000 0.28001002 0.50000000 1.0 Ni Ni11 1 0.18414709 0.37864245 0.00000000 1.0 Ni Ni12 1 0.62135755 0.80550464 0.00000000 1.0 Ni Ni13 1 0.19449536 0.81585291 0.00000000 1.0 Ni Ni14 1 0.80550464 0.62135755 0.00000000 1.0 Ni Ni15 1 0.81585291 0.19449536 0.00000000 1.0 Ni Ni16 1 0.37864245 0.18414709 0.00000000 1.0 Ni Ni17 1 0.36287450 0.48501586 0.50000000 1.0 Ni Ni18 1 0.51498414 0.87785963 0.50000000 1.0 Ni Ni19 1 0.12214037 0.63712550 0.50000000 1.0 Ni Ni20 1 0.87785963 0.51498414 0.50000000 1.0 Ni Ni21 1 0.63712550 0.12214037 0.50000000 1.0 Ni Ni22 1 0.48501586 0.36287450 0.50000000 1.0 Ni Ni23 1 0.00000000 0.00000000 0.00000000 1.0 P P24 1 0.82328816 0.82328816 0.00000000 1.0 P P25 1 0.17671184 0.00000000 0.00000000 1.0 P P26 1 0.00000000 0.17671184 0.00000000 1.0 P P27 1 0.17257442 0.47762556 0.50000000 1.0 P P28 1 0.52237444 0.69494887 0.50000000 1.0 P P29 1 0.30505113 0.82742558 0.50000000 1.0 P P30 1 0.69494887 0.52237444 0.50000000 1.0 P P31 1 0.82742558 0.30505113 0.50000000 1.0 P P32 1 0.47762556 0.17257442 0.50000000 1.0 P P33 1 0.35665173 0.35665173 0.00000000 1.0 P P34 1 0.64334827 0.00000000 0.00000000 1.0 P P35 1 0.00000000 0.64334827 0.00000000 1.0