# generated using pymatgen data_Ni(BO2)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.42338654 _cell_length_b 8.90105716 _cell_length_c 5.50608775 _cell_angle_alpha 90.00020041 _cell_angle_beta 89.99982949 _cell_angle_gamma 99.73382607 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ni(BO2)2 _chemical_formula_sum 'Ni4 B8 O16' _cell_volume 213.66923290 _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 Ni Ni0 1 0.25001373 0.00000481 0.35020914 1.0 Ni Ni1 1 0.75001383 -0.00000121 0.64979212 1.0 Ni Ni2 1 0.75001446 0.50000554 0.85021340 1.0 Ni Ni3 1 0.25001453 0.49999843 0.14978868 1.0 B B4 1 0.68563376 0.81581634 0.10750146 1.0 B B5 1 0.18561714 0.31582016 0.60750128 1.0 B B6 1 0.81436244 0.18418466 0.10749687 1.0 B B7 1 0.31437622 0.68418074 0.60749490 1.0 B B8 1 0.31436463 0.18418385 0.89250097 1.0 B B9 1 0.81437804 0.68417985 0.39250258 1.0 B B10 1 0.18563686 0.81581737 0.89249956 1.0 B B11 1 0.68561973 0.31582174 0.39250212 1.0 O O12 1 0.33691942 0.35571647 0.85107385 1.0 O O13 1 0.83692936 0.85571222 0.35107525 1.0 O O14 1 0.66307586 0.64427953 0.14892612 1.0 O O15 1 0.16306554 0.14428372 0.64892440 1.0 O O16 1 0.16307498 0.64428166 0.85107093 1.0 O O17 1 0.66306267 0.14428634 0.35107282 1.0 O O18 1 0.83692091 0.35571767 0.14892939 1.0 O O19 1 0.33693105 0.85571333 0.64892619 1.0 O O20 1 0.60893840 0.13630541 0.90832725 1.0 O O21 1 0.10895029 0.63630211 0.40832434 1.0 O O22 1 0.89105829 0.86369393 0.90832959 1.0 O O23 1 0.39104523 0.36369758 0.40832690 1.0 O O24 1 0.10893287 0.13630379 0.09167218 1.0 O O25 1 0.60894624 0.63630045 0.59167376 1.0 O O26 1 0.39105807 0.86369360 0.09167145 1.0 O O27 1 0.89104345 0.36369690 0.59167452 1.0