# generated using pymatgen data_LiSc2(Co3P2)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.58172153 _cell_length_b 10.04374051 _cell_length_c 11.60221317 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiSc2(Co3P2)3 _chemical_formula_sum 'Li2 Sc4 Co18 P12' _cell_volume 417.37664277 _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 Li Li0 1 0.25000000 0.70283990 0.99159045 1.0 Li Li1 1 0.25000000 0.79716010 0.49159045 1.0 Sc Sc2 1 0.25000000 0.57706556 0.70237432 1.0 Sc Sc3 1 0.25000000 0.92293444 0.20237432 1.0 Sc Sc4 1 0.75000000 0.42160903 0.29854112 1.0 Sc Sc5 1 0.75000000 0.07839097 0.79854112 1.0 Co Co6 1 0.75000000 0.28781404 0.00760850 1.0 Co Co7 1 0.75000000 0.21218596 0.50760850 1.0 Co Co8 1 0.25000000 0.40584181 0.48466051 1.0 Co Co9 1 0.25000000 0.09415819 0.98466051 1.0 Co Co10 1 0.75000000 0.59195030 0.51748509 1.0 Co Co11 1 0.75000000 0.90804970 0.01748509 1.0 Co Co12 1 0.25000000 0.22440159 0.17404031 1.0 Co Co13 1 0.25000000 0.27559941 0.67404031 1.0 Co Co14 1 0.75000000 0.77972365 0.82649508 1.0 Co Co15 1 0.75000000 0.72027635 0.32649508 1.0 Co Co16 1 0.25000000 0.88082040 0.70012687 1.0 Co Co17 1 0.25000000 0.61917960 0.20012687 1.0 Co Co18 1 0.75000000 0.12121515 0.29907306 1.0 Co Co19 1 0.75000000 0.37878485 0.79907306 1.0 Co Co20 1 0.25000000 0.46215781 0.93103810 1.0 Co Co21 1 0.25000000 0.03784219 0.43103810 1.0 Co Co22 1 0.75000000 0.53447035 0.06713090 1.0 Co Co23 1 0.75000000 0.96552965 0.56713090 1.0 P P24 1 0.25000000 0.42357722 0.11495109 1.0 P P25 1 0.25000000 0.07642278 0.61495109 1.0 P P26 1 0.75000000 0.57652478 0.88134275 1.0 P P27 1 0.75000000 0.92347522 0.38134275 1.0 P P28 1 0.25000000 0.26320721 0.86408627 1.0 P P29 1 0.25000000 0.23679279 0.36408627 1.0 P P30 1 0.75000000 0.73529555 0.13902372 1.0 P P31 1 0.75000000 0.76470445 0.63902372 1.0 P P32 1 0.25000000 0.59891262 0.39151643 1.0 P P33 1 0.25000000 0.90108738 0.89151643 1.0 P P34 1 0.75000000 0.39866691 0.60891745 1.0 P P35 1 0.75000000 0.10133309 0.10891745 1.0