# generated using pymatgen data_Zr8Co16(SiP3)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.07699307 _cell_length_b 12.08688351 _cell_length_c 3.64343448 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.97306250 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr8Co16(SiP3)3 _chemical_formula_sum 'Zr8 Co16 Si3 P9' _cell_volume 460.71523172 _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 Zr Zr0 1 0.82336057 0.82412505 0.50000000 1.0 Zr Zr1 1 0.44231347 0.44142964 0.00000000 1.0 Zr Zr2 1 0.99801425 0.17354141 0.50000000 1.0 Zr Zr3 1 0.55513274 0.99982867 0.00000000 1.0 Zr Zr4 1 0.33397087 0.66608082 0.00000000 1.0 Zr Zr5 1 0.66794062 0.33390884 0.00000000 1.0 Zr Zr6 1 0.00090648 0.55801363 0.00000000 1.0 Zr Zr7 1 0.17488818 0.99926907 0.50000000 1.0 Co Co8 1 0.62737590 0.82510536 0.00000000 1.0 Co Co9 1 0.37500667 0.19339621 0.00000000 1.0 Co Co10 1 0.00210802 0.72312048 0.50000000 1.0 Co Co11 1 0.28244434 0.28042091 0.50000000 1.0 Co Co12 1 0.87300714 0.35495278 0.50000000 1.0 Co Co13 1 0.72061370 0.99993098 0.50000000 1.0 Co Co14 1 0.82543090 0.62844576 0.00000000 1.0 Co Co15 1 0.17844321 0.80735935 0.00000000 1.0 Co Co16 1 0.35390576 0.87386603 0.50000000 1.0 Co Co17 1 0.12736304 0.48360752 0.50000000 1.0 Co Co18 1 0.64562782 0.51765632 0.50000000 1.0 Co Co19 1 0.99594772 0.99565696 0.00000000 1.0 Co Co20 1 0.51856971 0.64547142 0.50000000 1.0 Co Co21 1 0.48067701 0.12560540 0.50000000 1.0 Co Co22 1 0.19785069 0.37589428 0.00000000 1.0 Co Co23 1 0.80202308 0.17467190 0.00000000 1.0 Si Si24 1 0.99997160 0.34484842 0.00000000 1.0 Si Si25 1 0.17546202 0.17630939 0.00000000 1.0 Si Si26 1 0.65422162 0.65448615 0.00000000 1.0 P P27 1 0.82610587 0.51906748 0.50000000 1.0 P P28 1 0.69256721 0.17455196 0.50000000 1.0 P P29 1 0.82282451 0.99966427 0.00000000 1.0 P P30 1 0.51824315 0.82539200 0.50000000 1.0 P P31 1 0.17503588 0.69283311 0.50000000 1.0 P P32 1 0.34458405 0.00032878 0.00000000 1.0 P P33 1 0.48198358 0.30675951 0.50000000 1.0 P P34 1 0.99930282 0.82337664 0.00000000 1.0 P P35 1 0.30677779 0.48102451 0.50000000 1.0