# generated using pymatgen data_Ni5(MoP)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.54638040 _cell_length_b 5.76272394 _cell_length_c 12.73712865 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ni5(MoP)3 _chemical_formula_sum 'Ni10 Mo6 P6' _cell_volume 260.30629386 _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 Ni Ni0 1 0.50000000 0.44679879 0.10036529 1.0 Ni Ni1 1 0.50000000 0.07565410 0.00000000 1.0 Ni Ni2 1 0.50000000 0.36134961 0.71068643 1.0 Ni Ni3 1 0.00000000 0.92434590 0.50000000 1.0 Ni Ni4 1 0.00000000 0.63865039 0.78931357 1.0 Ni Ni5 1 0.00000000 0.63865039 0.21068643 1.0 Ni Ni6 1 0.50000000 0.44679879 0.89963471 1.0 Ni Ni7 1 0.50000000 0.36134961 0.28931357 1.0 Ni Ni8 1 0.00000000 0.55320121 0.60036529 1.0 Ni Ni9 1 0.00000000 0.55320121 0.39963471 1.0 Mo Mo10 1 0.50000000 0.25781439 0.50000000 1.0 Mo Mo11 1 0.00000000 0.74218561 0.00000000 1.0 Mo Mo12 1 0.50000000 0.88308522 0.66833008 1.0 Mo Mo13 1 0.00000000 0.11691478 0.83166992 1.0 Mo Mo14 1 0.00000000 0.11691478 0.16833008 1.0 Mo Mo15 1 0.50000000 0.88308522 0.33166992 1.0 P P16 1 0.00000000 0.17931348 0.36117347 1.0 P P17 1 0.50000000 0.82068652 0.86117347 1.0 P P18 1 0.00000000 0.32802150 0.00000000 1.0 P P19 1 0.50000000 0.67197850 0.50000000 1.0 P P20 1 0.50000000 0.82068652 0.13882653 1.0 P P21 1 0.00000000 0.17931348 0.63882653 1.0