data_global _chemical_name_mineral 'Monipite' loop_ _publ_author_name 'Guerin R' 'Sergent M' _journal_name_full 'Acta Crystallographica, Section B' _journal_volume 33 _journal_year 1977 _journal_page_first 2820 _journal_page_last 2823 _publ_section_title ; Structure cristalline de NiMoP Localite: synthetic ; _database_code_amcsd 0009604 _chemical_formula_sum 'Ni Mo P' _cell_length_a 5.861 _cell_length_b 5.861 _cell_length_c 3.704 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 120 _cell_volume 110.191 _exptl_crystal_density_diffrn 8.391 _symmetry_space_group_name_H-M 'P -6 2 m' loop_ _space_group_symop_operation_xyz 'x,y,z' '-x,-x+y,z' '-x+y,-x,-z' 'y,x,-z' '-y,x-y,z' 'x-y,-y,z' 'x,y,-z' '-x,-x+y,-z' '-x+y,-x,z' 'y,x,z' '-y,x-y,-z' 'x-y,-y,-z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z Ni 0.25034 0.00000 0.00000 Mo 0.58647 0.00000 0.50000 P1 0.33333 0.66667 0.00000 P2 0.00000 0.00000 0.50000 loop_ _atom_site_aniso_label _atom_site_aniso_U_11 _atom_site_aniso_U_22 _atom_site_aniso_U_33 _atom_site_aniso_U_12 _atom_site_aniso_U_13 _atom_site_aniso_U_23 Ni 0.00313 0.00379 0.00327 0.00183 0.00000 0.00000 Mo 0.00248 0.00287 0.00104 0.00144 0.00000 0.00000 P1 0.00287 0.00287 0.00327 0.00144 0.00000 0.00000 P2 0.00405 0.00405 0.00229 0.00196 0.00000 0.00000