# generated using pymatgen data_SrCaNi(PO4)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.72020400 _cell_length_b 6.92796924 _cell_length_c 9.44796243 _cell_angle_alpha 109.40931253 _cell_angle_beta 101.90167088 _cell_angle_gamma 98.52377363 _symmetry_Int_Tables_number 1 _chemical_formula_structural SrCaNi(PO4)2 _chemical_formula_sum 'Sr2 Ca2 Ni2 P4 O16' _cell_volume 335.88149825 _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 Sr Sr0 1 0.20309900 0.74809400 0.06018600 1.0 Sr Sr1 1 0.79690100 0.25190600 0.93981400 1.0 Ca Ca2 1 0.33451900 0.75822300 0.66106400 1.0 Ca Ca3 1 0.66548100 0.24177700 0.33893600 1.0 Ni Ni4 1 0.09320600 0.29082600 0.55954400 1.0 Ni Ni5 1 0.90679400 0.70917400 0.44045600 1.0 P P6 1 0.16809000 0.18924400 0.22800800 1.0 P P7 1 0.83191000 0.81075600 0.77199200 1.0 P P8 1 0.54148100 0.73119200 0.29957800 1.0 P P9 1 0.45851900 0.26880800 0.70042200 1.0 O O10 1 0.95840800 0.68072100 0.87913800 1.0 O O11 1 0.45582700 0.28293300 0.16798100 1.0 O O12 1 0.89341900 0.04255700 0.75857700 1.0 O O13 1 0.26306500 0.40711500 0.69628100 1.0 O O14 1 0.54417300 0.71706700 0.83201900 1.0 O O15 1 0.41324100 0.14412100 0.59402000 1.0 O O16 1 0.58675900 0.85587900 0.40598000 1.0 O O17 1 0.40504900 0.12835000 0.86888600 1.0 O O18 1 0.10658100 0.95744300 0.24142300 1.0 O O19 1 0.59495100 0.87165000 0.13111400 1.0 O O20 1 0.04159200 0.31927900 0.12086200 1.0 O O21 1 0.03459400 0.19876600 0.39158800 1.0 O O22 1 0.96540600 0.80123400 0.60841200 1.0 O O23 1 0.26210000 0.59033900 0.37633400 1.0 O O24 1 0.73693500 0.59288500 0.30371900 1.0 O O25 1 0.73790000 0.40966100 0.62366600 1.0